| 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 | 36.4 | Very low | 48.6 | Very low | 250 Ų | 250 | 119 Ų | 119 | 100% | 1.232 | 75% | 0.75 | S | S | * | * | 0 | 89.1 | 0 | -86.1 | 158.8 | 151.8 | 0 | 0 | 107.7 | |||||
| 2 | G | 33.8 | Very low | 50.6 | Low | 83 Ų | 83 | 115.6 Ų | 115.6 | 86% | 0.856 | 72% | 0.719 | S | S | * | * | trans | -83.2 | 116.4 | 173 | 0 | 0 | 0 | 0 | 0 | 108.2 | A4 | G2-A4 PolarHBondContact O-N 3.49Å; G2-A4 VanDerWaalsContact O-N 3.16Å | ||
| 3 | S | 37.9 | Very low | 53.1 | Low | 118 Ų | 118 | 107.5 Ų | 107.5 | 83% | 0.825 | 67% | 0.669 | S | S | * | * | trans | -59.4 | 112.3 | 171.6 | -178.2 | 0 | 0 | 0 | 0 | 108.4 | G5 | S3-G5 PolarHBondContact O-N 3.4Å; S3-G5 VanDerWaalsContact O-N 3.17Å | ||
| 4 | A | 41.3 | Very low | 55.6 | Low | 95 Ų | 95 | 102.4 Ų | 102.4 | 79% | 0.785 | 65% | 0.648 | S | S | * | * | trans | -66.5 | 111 | 166 | 0 | 0 | 0 | 0 | 0 | 106.7 | G2 | G2-A4 PolarHBondContact O-N 3.49Å; G2-A4 VanDerWaalsContact O-N 3.16Å | ||
| 5 | G | 39.4 | Very low | 57.8 | Low | 47 Ų | 47 | 102.1 Ų | 102.1 | 49% | 0.485 | 63% | 0.63 | S | S | . | * | trans | -56.4 | 159.8 | 171.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | S3 V7 | S3-G5 PolarHBondContact O-N 3.4Å; S3-G5 VanDerWaalsContact O-N 3.17Å; G5-V7 PolarHBondContact O-N 3.4Å; G5-V7 VanDerWaalsContact O-N 3.08Å | ||
| 6 | P | 41.8 | Very low | 59.7 | Low | 134 Ų | 134 | 108.1 Ų | 108.1 | 87% | 0.87 | 64% | 0.638 | S | S | * | * | trans | -55.1 | 121.2 | 176.2 | 23.3 | -31.2 | 0 | 0 | 0 | 108.8 | E8 | P6-E8 PolarHBondContact O-N 3.08Š| ||
| 7 | V | 53 | Low | 61.3 | Low | 105 Ų | 105 | 105.4 Ų | 105.4 | 64% | 0.636 | 62% | 0.618 | S | S | * | * | trans | -61.8 | 111.7 | 172.7 | 179.3 | 0 | 0 | 0 | 0 | 106.1 | G5 V9 | G5-V7 PolarHBondContact O-N 3.4Å; G5-V7 VanDerWaalsContact O-N 3.08Å; V7-V9 PolarHBondContact O-N 3.36Å | ||
| 8 | E | 54.3 | Low | 62.8 | Low | 185 Ų | 185 | 100.4 Ų | 100.4 | 86% | 0.864 | 59% | 0.588 | S | S | * | * | trans | -62.8 | 105.6 | 173.7 | -118.4 | -178.1 | 162.3 | 0 | 0 | 107.5 | P6 E10 | P6-E8 PolarHBondContact O-N 3.08Å; E8-E10 PolarHBondContact O-N 2.88Å | ||
| 9 | V | 60.9 | Low | 64.2 | Low | 85 Ų | 85 | 100.6 Ų | 100.6 | 52% | 0.515 | 59% | 0.585 | S | S | . | * | trans | -74.2 | 114.1 | 175 | -179.9 | 0 | 0 | 0 | 0 | 106.8 | V7 N125 | V7-V9 PolarHBondContact O-N 3.36Å; V9-N125 WeakPolarHBondContact CG1-O 3.42Å | ||
| 10 | E | 64.9 | Low | 65.4 | Low | 92 Ų | 92 | 98.2 Ų | 98.2 | 43% | 0.43 | 57% | 0.571 | S | S | . | * | P | Polyproline II helix | trans | -57.4 | 136.1 | 173.9 | -75.9 | -166.3 | 160.1 | 0 | 0 | 109.7 | E8 M12 | E8-E10 PolarHBondContact O-N 2.88Å; E10-M12 PolarHBondContact O-N 3.03Å |
| 11 | P | 70.4 | Confident | 66.4 | Low | 115 Ų | 115 | 97.4 Ų | 97.4 | 75% | 0.747 | 56% | 0.559 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 142.1 | 177.5 | 25.5 | -33.2 | 0 | 0 | 0 | 110.1 | ||
| 12 | M | 73.2 | Confident | 68.7 | Low | 78 Ų | 78 | 85.7 Ų | 85.7 | 38% | 0.384 | 50% | 0.502 | S | S | . | . | P | Polyproline II helix | trans | -60 | 127.7 | -178 | -166.9 | 174.7 | 70.3 | 0 | 0 | 110 | E10 Y253 L257 K258 | E10-M12 PolarHBondContact O-N 3.03Å; M12-Y253 HydrophobicContact CE-CE1 3.58Å; M12-Y253 WeakPolarHBondContact CE-OH 3.38Å; M12-L257 HydrophobicContact CE-CD1 4.32Å; M12-L257 HydrophobicContact CG-CB 4.48Å; M12-K258 HydrophobicContact SD-CG 4.46Å |
| 13 | P | 82.6 | Confident | 71.1 | Confident | 10 Ų | 10 | 84.4 Ų | 84.4 | 7% | 0.065 | 48% | 0.48 | C | S | . | . | P | Polyproline II helix | trans | -67.6 | 150.7 | -174 | 29.2 | -37.7 | 0 | 0 | 0 | 110.9 | E17 L257 Y261 | P13-E17 HydrophobicContact CB-CB 4.3Å; P13-E17 HydrophobicContact CB-CG 4.31Å; P13-L257 WeakPolarHBondContact CG-O 3.28Å; P13-L257 WeakPolarHBondContact O-CD1 3.47Å; P13-L257 WeakPolarHBondContact O-CD2 3.4Å; P13-Y261 HydrophobicContact CB-CD1 4.37Å; P13-Y261 HydrophobicContact CB-CD2 3.77Å; P13-Y261 HydrophobicContact CB-CE1 4.33Å; P13-Y261 HydrophobicContact CB-CE2 3.74Å; P13-Y261 HydrophobicContact CB-CG 4.09Å; P13-Y261 HydrophobicContact CG-CD1 3.67Å; P13-Y261 HydrophobicContact CG-CD2 3.71Å; P13-Y261 HydrophobicContact CG-CE1 4.02Å; P13-Y261 HydrophobicContact CG-CE2 4.07Å; P13-Y261 HydrophobicContact CG-CG 3.49Å; P13-Y261 VanDerWaalsContact CG-CG 3.49Å |
| 14 | G | 88.6 | Confident | 73.4 | Confident | 37 Ų | 37 | 82.7 Ų | 82.7 | 38% | 0.381 | 47% | 0.468 | S | S | . | . | P | Polyproline II helix | trans | -84.7 | 166.3 | 168.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | W16 E17 L18 | G14-W16 PolarHBondContact O-N 3.47Å; G14-E17 WeakPolarHBondContact O-CB 3.46Å; G14-E17 PolarHBondContact O-N 3Å; G14-E17 VanDerWaalsContact O-N 3.08Å; G14-L18 PolarHBondContact O-N 3.36Å |
| 15 | Y | 88.8 | Confident | 75.5 | Confident | 97 Ų | 97 | 79.2 Ų | 79.2 | 38% | 0.38 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -59.1 | -35.8 | 174.4 | -79.5 | -81.2 | 0 | 0 | 0 | 113.1 | E17 L18 I19 L252 Y253 P256 L257 | Y15-E17 VanDerWaalsContact C-N 3.27Å; Y15-E17 PolarHBondContact O-N 3.47Å; Y15-L18 HydrophobicContact CD1-CD2 4.5Å; Y15-L18 PolarHBondContact O-N 3.31Å; Y15-I19 WeakPolarHBondContact O-CB 3.39Å; Y15-I19 VanDerWaalsContact O-CG1 3.24Å; Y15-I19 WeakPolarHBondContact O-CG1 3.37Å; Y15-I19 PolarHBondContact O-N 3.48Å; Y15-L252 VanDerWaalsContact OH-C 3.26Å; Y15-L252 PolarHBondContact OH-O 2.92Å; Y15-Y253 HydrophobicContact CE2-CD2 4.12Å; Y15-P256 HydrophobicContact CE1-CB 4.1Å; Y15-P256 HydrophobicContact CE1-CG 4.41Å; Y15-L257 HydrophobicContact CD1-CD2 4.31Å; Y15-L257 HydrophobicContact CD2-CD2 4.41Å; Y15-L257 HydrophobicContact CG-CD2 4.22Å |
| 16 | W | 87.6 | Confident | 77.7 | Confident | 199 Ų | 199 | 79.4 Ų | 79.4 | 75% | 0.754 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -59.6 | -43.2 | 176 | 179.9 | -107.5 | 0 | 0 | 0 | 111.3 | G14 I19 T20 | G14-W16 PolarHBondContact O-N 3.47Å; W16-I19 PolarHBondContact O-N 2.92Å; W16-T20 HydrophobicContact CD2-CG2 4.03Å; W16-T20 HydrophobicContact CE3-CG2 4.49Å; W16-T20 HydrophobicContact CH2-CG2 4.25Å; W16-T20 HydrophobicContact CZ2-CG2 3.74Å; W16-T20 WeakPolarHBondContact O-CB 3.3Å; W16-T20 WeakPolarHBondContact O-CG2 3.49Å; W16-T20 PolarHBondContact O-N 3.05Å; W16-T20 PolarHBondContact O-OG1 3.06Å |
| 17 | E | 87.1 | Confident | 79.7 | Confident | 62 Ų | 62 | 77.4 Ų | 77.4 | 29% | 0.29 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -68.6 | -43.2 | 177.9 | -173 | 172.2 | -168.8 | 0 | 0 | 111.7 | P13 G14 Y15 I19 T20 R21 Y261 | P13-E17 HydrophobicContact CB-CB 4.3Å; P13-E17 HydrophobicContact CB-CG 4.31Å; G14-E17 WeakPolarHBondContact O-CB 3.46Å; G14-E17 PolarHBondContact O-N 3Å; G14-E17 VanDerWaalsContact O-N 3.08Å; Y15-E17 VanDerWaalsContact C-N 3.27Å; Y15-E17 PolarHBondContact O-N 3.47Å; E17-I19 VanDerWaalsContact C-N 3.33Å; E17-I19 PolarHBondContact O-N 3.17Å; E17-T20 WeakPolarHBondContact CA-OG1 3.33Å; E17-T20 PolarHBondContact O-N 3.45Å; E17-T20 PolarHBondContact O-OG1 3Å; E17-R21 HydrophobicContact CG-CG 3.95Å; E17-R21 VanDerWaalsContact O-CB 3.27Å; E17-R21 WeakPolarHBondContact O-CB 3.48Å; E17-R21 PolarHBondContact O-N 3.25Å; E17-R21 WeakPolarHBondContact OE1-CD 3.49Å; E17-R21 IonicContact OE1-CZ 3.92Å; E17-R21 IonicContact OE1-NE 2.99Å; E17-R21 IonicContact OE1-NH1 3.38Å; E17-R21 PolarHBondContact OE1-NH1 2.95Å; E17-Y261 HydrophobicContact CG-CE2 4.16Å |
| 18 | L | 87.5 | Confident | 81.1 | Confident | 16 Ų | 16 | 73.7 Ų | 73.7 | 8% | 0.084 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -56.1 | -47.7 | 173.3 | 173.4 | 63.8 | 0 | 0 | 0 | 111.6 | G14 Y15 G22 P256 L257 L260 Y261 | G14-L18 PolarHBondContact O-N 3.36Å; Y15-L18 HydrophobicContact CD1-CD2 4.5Å; Y15-L18 PolarHBondContact O-N 3.31Å; L18-G22 WeakPolarHBondContact O-CA 3.26Å; L18-G22 PolarHBondContact O-N 3.45Å; L18-P256 HydrophobicContact CD2-CB 3.74Å; L18-L257 HydrophobicContact CB-CD2 4.45Å; L18-L257 HydrophobicContact CD2-CD2 4.37Å; L18-L260 HydrophobicContact CD1-CB 4.24Å; L18-Y261 HydrophobicContact CB-CD2 4.47Å; L18-Y261 HydrophobicContact CD1-CD2 4.2Å |
| 19 | I | 89.3 | Confident | 82.4 | Confident | 104 Ų | 104 | 66.2 Ų | 66.2 | 53% | 0.533 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -66.4 | -49.3 | -179.1 | -68.2 | 166.4 | 0 | 0 | 0 | 110.1 | Y15 W16 E17 S23 | Y15-I19 WeakPolarHBondContact O-CB 3.39Å; Y15-I19 VanDerWaalsContact O-CG1 3.24Å; Y15-I19 WeakPolarHBondContact O-CG1 3.37Å; Y15-I19 PolarHBondContact O-N 3.48Å; W16-I19 PolarHBondContact O-N 2.92Å; E17-I19 VanDerWaalsContact C-N 3.33Å; E17-I19 PolarHBondContact O-N 3.17Å; I19-S23 WeakPolarHBondContact O-CB 3.49Å; I19-S23 PolarHBondContact O-N 2.96Å; I19-S23 PolarHBondContact O-OG 2.92Å |
| 20 | T | 89.1 | Confident | 83.3 | Confident | 51 Ų | 51 | 70.2 Ų | 70.2 | 31% | 0.313 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -71.2 | -53.6 | -175.2 | 52.2 | 0 | 0 | 0 | 0 | 112.6 | W16 E17 S23 S24 | W16-T20 HydrophobicContact CD2-CG2 4.03Å; W16-T20 HydrophobicContact CE3-CG2 4.49Å; W16-T20 HydrophobicContact CH2-CG2 4.25Å; W16-T20 HydrophobicContact CZ2-CG2 3.74Å; W16-T20 WeakPolarHBondContact O-CB 3.3Å; W16-T20 WeakPolarHBondContact O-CG2 3.49Å; W16-T20 PolarHBondContact O-N 3.05Å; W16-T20 PolarHBondContact O-OG1 3.06Å; E17-T20 WeakPolarHBondContact CA-OG1 3.33Å; E17-T20 PolarHBondContact O-N 3.45Å; E17-T20 PolarHBondContact O-OG1 3Å; T20-S23 PolarHBondContact O-OG 3.31Å; T20-S24 VanDerWaalsContact O-CB 3.24Å; T20-S24 WeakPolarHBondContact O-CB 3.34Å; T20-S24 PolarHBondContact O-N 2.98Å |
| 21 | R | 86.4 | Confident | 84.1 | Confident | 83 Ų | 83 | 75.4 Ų | 75.4 | 31% | 0.313 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -70.5 | -41.3 | 179.5 | -65.5 | -178.5 | 66.8 | 176 | -5.3 | 111.8 | E17 S24 A25 Y261 V265 | E17-R21 HydrophobicContact CG-CG 3.95Å; E17-R21 VanDerWaalsContact O-CB 3.27Å; E17-R21 WeakPolarHBondContact O-CB 3.48Å; E17-R21 PolarHBondContact O-N 3.25Å; E17-R21 WeakPolarHBondContact OE1-CD 3.49Å; E17-R21 IonicContact OE1-CZ 3.92Å; E17-R21 IonicContact OE1-NE 2.99Å; E17-R21 IonicContact OE1-NH1 3.38Å; E17-R21 PolarHBondContact OE1-NH1 2.95Å; R21-S24 PolarHBondContact O-N 3.32Å; R21-A25 VanDerWaalsContact O-CB 3.24Å; R21-A25 WeakPolarHBondContact O-CB 3.47Å; R21-A25 PolarHBondContact O-N 2.91Å; R21-Y261 PolarHBondContact NH1-OH 2.89Å; R21-V265 HydrophobicContact CB-CG2 4.02Å |
| 22 | G | 83.9 | Confident | 84.4 | Confident | 4 Ų | 4 | 76.2 Ų | 76.2 | 4% | 0.041 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -63.1 | -47.7 | 178 | 0 | 0 | 0 | 0 | 0 | 112.1 | L18 A25 M26 | L18-G22 WeakPolarHBondContact O-CA 3.26Å; L18-G22 PolarHBondContact O-N 3.45Å; G22-A25 PolarHBondContact O-N 3.35Å; G22-M26 WeakPolarHBondContact O-CB 3.49Å; G22-M26 VanDerWaalsContact O-CG 3.28Å; G22-M26 WeakPolarHBondContact O-CG 3.4Å; G22-M26 PolarHBondContact O-N 3.24Å |
| 23 | S | 85.4 | Confident | 84.3 | Confident | 56 Ų | 56 | 74.6 Ų | 74.6 | 39% | 0.392 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -64.7 | -41.5 | 176.7 | 63 | 0 | 0 | 0 | 0 | 112.2 | I19 T20 M26 L27 | I19-S23 WeakPolarHBondContact O-CB 3.49Å; I19-S23 PolarHBondContact O-N 2.96Å; I19-S23 PolarHBondContact O-OG 2.92Å; T20-S23 PolarHBondContact O-OG 3.31Å; S23-M26 PolarHBondContact O-N 2.89Å; S23-L27 VanDerWaalsContact O-CB 3.24Å; S23-L27 WeakPolarHBondContact O-CB 3.46Å; S23-L27 WeakPolarHBondContact O-CG 3.35Å; S23-L27 PolarHBondContact O-N 3.12Å |
| 24 | S | 86.9 | Confident | 83.3 | Confident | 81 Ų | 81 | 79 Ų | 79 | 57% | 0.566 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -60.5 | -46.6 | 175.6 | -175.1 | 0 | 0 | 0 | 0 | 111.9 | T20 R21 L27 G28 | T20-S24 VanDerWaalsContact O-CB 3.24Å; T20-S24 WeakPolarHBondContact O-CB 3.34Å; T20-S24 PolarHBondContact O-N 2.98Å; R21-S24 PolarHBondContact O-N 3.32Å; S24-L27 PolarHBondContact O-N 2.92Å; S24-G28 PolarHBondContact O-N 3.45Å |
| 25 | A | 84.3 | Confident | 82.1 | Confident | 22 Ų | 22 | 84.2 Ų | 84.2 | 18% | 0.182 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -63.6 | -46.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | R21 G22 L27 G28 A29 I268 | R21-A25 VanDerWaalsContact O-CB 3.24Å; R21-A25 WeakPolarHBondContact O-CB 3.47Å; R21-A25 PolarHBondContact O-N 2.91Å; G22-A25 PolarHBondContact O-N 3.35Å; A25-L27 PolarHBondContact O-N 3.16Å; A25-G28 PolarHBondContact O-N 2.91Å; A25-A29 WeakPolarHBondContact O-CB 3.42Å; A25-A29 PolarHBondContact O-N 2.87Å; A25-I268 HydrophobicContact CB-CD1 4.01Å |
| 26 | M | 84.7 | Confident | 80.9 | Confident | 51 Ų | 51 | 83.4 Ų | 83.4 | 25% | 0.251 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -63.3 | -41 | 176.3 | -71.7 | -179.6 | 74.4 | 0 | 0 | 112.3 | G22 S23 W30 Y277 F285 | G22-M26 WeakPolarHBondContact O-CB 3.49Å; G22-M26 VanDerWaalsContact O-CG 3.28Å; G22-M26 WeakPolarHBondContact O-CG 3.4Å; G22-M26 PolarHBondContact O-N 3.24Å; S23-M26 PolarHBondContact O-N 2.89Å; M26-W30 VanDerWaalsContact O-CB 3.29Å; M26-W30 WeakPolarHBondContact O-CB 3.27Å; M26-W30 PolarHBondContact O-N 3.41Å; M26-Y277 HydrophobicContact CG-CE1 4.18Å; M26-Y277 WeakPolarHBondContact CG-OH 3.35Å; M26-F285 HydrophobicContact CE-CE2 4.2Å; M26-F285 HydrophobicContact SD-CE2 3.95Å; M26-F285 HydrophobicContact SD-CZ 4.39Å |
| 27 | L | 85.2 | Confident | 80.1 | Confident | 92 Ų | 92 | 75.6 Ų | 75.6 | 48% | 0.482 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -67.8 | -38.9 | 177.1 | -75.9 | 170.3 | 0 | 0 | 0 | 112.1 | S23 S24 A25 W30 R31 | S23-L27 VanDerWaalsContact O-CB 3.24Å; S23-L27 WeakPolarHBondContact O-CB 3.46Å; S23-L27 WeakPolarHBondContact O-CG 3.35Å; S23-L27 PolarHBondContact O-N 3.12Å; S24-L27 PolarHBondContact O-N 2.92Å; A25-L27 PolarHBondContact O-N 3.16Å; L27-W30 PolarHBondContact O-N 3.38Å; L27-R31 VanDerWaalsContact O-CG 3.3Å; L27-R31 WeakPolarHBondContact O-CG 3.26Å; L27-R31 PolarHBondContact O-N 3.49Å |
| 28 | G | 82.3 | Confident | 79.3 | Confident | 28 Ų | 28 | 79.7 Ų | 79.7 | 29% | 0.289 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -60.2 | -54.6 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111 | S24 A25 W30 R31 D32 | S24-G28 PolarHBondContact O-N 3.45Å; A25-G28 PolarHBondContact O-N 2.91Å; G28-W30 PolarHBondContact O-N 3.19Å; G28-R31 PolarHBondContact O-N 3.33Å; G28-D32 PolarHBondContact O-N 3.42Å |
| 29 | A | 80.4 | Confident | 78.7 | Confident | 28 Ų | 28 | 85.2 Ų | 85.2 | 23% | 0.231 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -57.3 | -34.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | A25 C33 I268 F278 | A25-A29 WeakPolarHBondContact O-CB 3.42Å; A25-A29 PolarHBondContact O-N 2.87Å; A29-C33 WeakPolarHBondContact O-CB 3.48Å; A29-C33 PolarHBondContact O-N 3.15Å; A29-I268 HydrophobicContact CB-CD1 3.89Å; A29-F278 HydrophobicContact CB-CE1 4.47Å; A29-F278 HydrophobicContact CB-CE2 4.39Å; A29-F278 HydrophobicContact CB-CZ 3.71Å |
| 30 | W | 80.9 | Confident | 78.1 | Confident | 169 Ų | 169 | 85.8 Ų | 85.8 | 64% | 0.64 | 46% | 0.46 | S | S | * | . | H | α-helix | trans | -70 | -41.9 | 177.1 | -178.4 | -92.6 | 0 | 0 | 0 | 112 | M26 L27 G28 D32 C33 F278 | M26-W30 VanDerWaalsContact O-CB 3.29Å; M26-W30 WeakPolarHBondContact O-CB 3.27Å; M26-W30 PolarHBondContact O-N 3.41Å; L27-W30 PolarHBondContact O-N 3.38Å; G28-W30 PolarHBondContact O-N 3.19Å; W30-D32 VanDerWaalsContact C-N 3.35Å; W30-C33 WeakPolarHBondContact O-CB 3.48Å; W30-C33 PolarHBondContact O-N 2.94Å; W30-F278 HydrophobicContact CB-CE1 4.49Å; W30-F278 HydrophobicContact CB-CZ 4.2Å; W30-F278 HydrophobicContact CE3-CE1 4.31Å; W30-F278 HydrophobicContact CE3-CZ 4.28Å |
| 31 | R | 82.3 | Confident | 77.6 | Confident | 201 Ų | 201 | 85.8 Ų | 85.8 | 76% | 0.758 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -66.9 | -36.2 | 177.7 | -74.8 | 173.3 | 178.4 | 173.3 | 0.7 | 112.4 | L27 G28 C33 | L27-R31 VanDerWaalsContact O-CG 3.3Å; L27-R31 WeakPolarHBondContact O-CG 3.26Å; L27-R31 PolarHBondContact O-N 3.49Å; G28-R31 PolarHBondContact O-N 3.33Å; R31-C33 VanDerWaalsContact C-N 3.27Å; R31-C33 PolarHBondContact O-N 2.93Å |
| 32 | D | 75.8 | Confident | 77.3 | Confident | 132 Ų | 132 | 87.5 Ų | 87.5 | 71% | 0.706 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -79.6 | -10.6 | 179.6 | -63.6 | -23.5 | 0 | 0 | 0 | 112.7 | G28 W30 S34 | G28-D32 PolarHBondContact O-N 3.42Å; W30-D32 VanDerWaalsContact C-N 3.35Å; D32-S34 VanDerWaalsContact C-N 3.34Å; D32-S34 PolarHBondContact O-N 3.07Å |
| 33 | C | 71.6 | Confident | 77.1 | Confident | 44 Ų | 44 | 95.6 Ų | 95.6 | 30% | 0.297 | 50% | 0.501 | S | S | . | . | trans | -74.8 | 84.5 | 177.1 | -167.7 | 0 | 0 | 0 | 0 | 110.9 | A29 W30 R31 C36 | A29-C33 WeakPolarHBondContact O-CB 3.48Å; A29-C33 PolarHBondContact O-N 3.15Å; W30-C33 WeakPolarHBondContact O-CB 3.48Å; W30-C33 PolarHBondContact O-N 2.94Å; R31-C33 VanDerWaalsContact C-N 3.27Å; R31-C33 PolarHBondContact O-N 2.93Å; C33-C36 WeakPolarHBondContact CB-SG 3.44Å; C33-C36 PolarHBondContact O-SG 3.32Å; C33-C36 WeakPolarHBondContact SG-CB 3.49Å; C33-C36 CovalentContact SG-SG 2.03Å; C33-C36 PolarHBondContact SG-SG 3.05Å | ||
| 34 | S | 62.1 | Low | 76.8 | Confident | 103 Ų | 103 | 93.8 Ų | 93.8 | 72% | 0.72 | 49% | 0.488 | S | S | * | . | S | Bend | trans | -79.8 | -17.5 | 177.8 | 52 | 0 | 0 | 0 | 0 | 114 | D32 | D32-S34 VanDerWaalsContact C-N 3.34Å; D32-S34 PolarHBondContact O-N 3.07Å |
| 35 | H | 62.7 | Low | 76.5 | Confident | 146 Ų | 146 | 93.3 Ų | 93.3 | 68% | 0.676 | 48% | 0.479 | S | S | * | . | trans | -135.4 | 53 | -176.8 | -75.4 | -75.6 | 0 | 0 | 0 | 113.3 | G37 F40 | H35-G37 PolarHBondContact O-N 3.39Å; H35-F40 WeakPolarHBondContact O-CG 3Å | ||
| 36 | C | 64.1 | Low | 76.3 | Confident | 79 Ų | 79 | 98.3 Ų | 98.3 | 53% | 0.534 | 50% | 0.501 | S | S | . | . | trans | -79.3 | 117.1 | 171.3 | -22.5 | 0 | 0 | 0 | 0 | 109.5 | C33 | C33-C36 WeakPolarHBondContact CB-SG 3.44Å; C33-C36 PolarHBondContact O-SG 3.32Å; C33-C36 WeakPolarHBondContact SG-CB 3.49Å; C33-C36 CovalentContact SG-SG 2.03Å; C33-C36 PolarHBondContact SG-SG 3.05Å | ||
| 37 | G | 69.3 | Low | 76.2 | Confident | 36 Ų | 36 | 100.4 Ų | 100.4 | 37% | 0.371 | 51% | 0.514 | S | S | . | . | S | Bend | trans | -170.9 | 162.3 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | H35 E39 F40 S41 | H35-G37 PolarHBondContact O-N 3.39Å; G37-E39 VanDerWaalsContact C-N 3.3Å; G37-E39 PolarHBondContact O-N 3.09Å; G37-F40 PolarHBondContact O-N 2.89Å; G37-F40 VanDerWaalsContact O-N 3.1Å; G37-S41 PolarHBondContact O-N 3.35Å; G37-S41 PolarHBondContact O-OG 2.99Å |
| 38 | L | 70.7 | Confident | 76 | Confident | 148 Ų | 148 | 97.7 Ų | 97.7 | 78% | 0.775 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -56.2 | -41.7 | -175.5 | -166.3 | 93.7 | 0 | 0 | 0 | 112.6 | S41 K42 | L38-S41 PolarHBondContact O-N 2.98Å; L38-K42 WeakPolarHBondContact O-CB 3.38Å; L38-K42 PolarHBondContact O-N 3.08Å |
| 39 | E | 76.1 | Confident | 76.2 | Confident | 132 Ų | 132 | 97.9 Ų | 97.9 | 62% | 0.617 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -65.5 | -39.7 | 178.1 | -75.1 | -60.3 | 143.8 | 0 | 0 | 112.5 | G37 K42 R43 | G37-E39 VanDerWaalsContact C-N 3.3Å; G37-E39 PolarHBondContact O-N 3.09Å; E39-K42 PolarHBondContact O-N 3.17Å; E39-R43 WeakPolarHBondContact O-CB 3.45Å; E39-R43 PolarHBondContact O-N 3.35Å |
| 40 | F | 76.6 | Confident | 76.4 | Confident | 116 Ų | 116 | 101.1 Ų | 101.1 | 51% | 0.509 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -67.7 | -40.7 | 175.6 | -178.7 | -101.1 | 0 | 0 | 0 | 111.6 | H35 G37 K42 R43 T44 | H35-F40 WeakPolarHBondContact O-CG 3Å; G37-F40 PolarHBondContact O-N 2.89Å; G37-F40 VanDerWaalsContact O-N 3.1Å; F40-K42 VanDerWaalsContact C-N 3.35Å; F40-R43 PolarHBondContact O-N 3.09Å; F40-T44 WeakPolarHBondContact O-CB 3.45Å; F40-T44 PolarHBondContact O-N 2.99Å; F40-T44 PolarHBondContact O-OG1 3.34Å |
| 41 | S | 77.8 | Confident | 76.7 | Confident | 51 Ų | 51 | 97 Ų | 97 | 36% | 0.357 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.8 | -42.6 | 173.1 | -60.5 | 0 | 0 | 0 | 0 | 111.6 | G37 L38 T44 L45 F276 | G37-S41 PolarHBondContact O-N 3.35Å; G37-S41 PolarHBondContact O-OG 2.99Å; L38-S41 PolarHBondContact O-N 2.98Å; S41-T44 PolarHBondContact O-N 2.92Å; S41-L45 WeakPolarHBondContact O-CB 3.49Å; S41-L45 PolarHBondContact O-N 3.14Å; S41-F276 WeakPolarHBondContact O-CZ 3.32Å |
| 42 | K | 79.6 | Confident | 77.1 | Confident | 119 Ų | 119 | 90.3 Ų | 90.3 | 52% | 0.517 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -63.9 | -45.2 | 177.4 | -175.2 | -179.1 | 176.7 | -173.7 | 0 | 111.9 | L38 E39 F40 L45 L46 | L38-K42 WeakPolarHBondContact O-CB 3.38Å; L38-K42 PolarHBondContact O-N 3.08Å; E39-K42 PolarHBondContact O-N 3.17Å; F40-K42 VanDerWaalsContact C-N 3.35Å; K42-L45 WeakPolarHBondContact O-CB 3.29Å; K42-L45 PolarHBondContact O-N 3Å; K42-L46 HydrophobicContact CG-CD1 4.36Å; K42-L46 WeakPolarHBondContact O-CG 3.33Å; K42-L46 PolarHBondContact O-N 3.44Å |
| 43 | R | 80.1 | Confident | 77.8 | Confident | 174 Ų | 174 | 94.3 Ų | 94.3 | 66% | 0.657 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -62.4 | -47.5 | 175.2 | 178.5 | 175.2 | -97.4 | 172.9 | -6.7 | 111.3 | E39 F40 L45 L46 D47 | E39-R43 WeakPolarHBondContact O-CB 3.45Å; E39-R43 PolarHBondContact O-N 3.35Å; F40-R43 PolarHBondContact O-N 3.09Å; R43-L45 VanDerWaalsContact C-N 3.25Å; R43-L45 PolarHBondContact O-N 3.49Å; R43-L46 PolarHBondContact O-N 2.8Å; R43-L46 VanDerWaalsContact O-N 3.13Å; R43-D47 WeakPolarHBondContact CG-OD2 3.44Å; R43-D47 WeakPolarHBondContact O-CB 3.42Å; R43-D47 PolarHBondContact O-N 3.39Å |
| 44 | T | 79.4 | Confident | 78.8 | Confident | 18 Ų | 18 | 96.8 Ų | 96.8 | 11% | 0.11 | 50% | 0.496 | C | S | . | . | H | α-helix | trans | -57 | -40.1 | 176.3 | -58.6 | 0 | 0 | 0 | 0 | 112.1 | F40 S41 N48 P275 F276 | F40-T44 WeakPolarHBondContact O-CB 3.45Å; F40-T44 PolarHBondContact O-N 2.99Å; F40-T44 PolarHBondContact O-OG1 3.34Å; S41-T44 PolarHBondContact O-N 2.92Å; T44-N48 WeakPolarHBondContact O-CB 3.42Å; T44-N48 PolarHBondContact O-N 3.45Å; T44-N48 VanDerWaalsContact O-N 3.1Å; T44-N48 PolarHBondContact O-ND2 3.29Å; T44-P275 HydrophobicContact CG2-CB 3.46Å; T44-P275 VanDerWaalsContact CG2-CB 3.46Å; T44-F276 HydrophobicContact CG2-CD2 3.89Å; T44-F276 HydrophobicContact CG2-CE2 3.86Å |
| 45 | L | 81 | Confident | 80.2 | Confident | 71 Ų | 71 | 94.6 Ų | 94.6 | 37% | 0.372 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -63 | -51 | 175.6 | -170.8 | 99 | 0 | 0 | 0 | 110.6 | S41 K42 R43 D47 N48 A49 F188 F192 F276 | S41-L45 WeakPolarHBondContact O-CB 3.49Å; S41-L45 PolarHBondContact O-N 3.14Å; K42-L45 WeakPolarHBondContact O-CB 3.29Å; K42-L45 PolarHBondContact O-N 3Å; R43-L45 VanDerWaalsContact C-N 3.25Å; R43-L45 PolarHBondContact O-N 3.49Å; L45-D47 VanDerWaalsContact C-N 3.3Å; L45-D47 PolarHBondContact O-N 3.14Å; L45-N48 PolarHBondContact O-N 2.96Å; L45-A49 HydrophobicContact CG-CB 4.25Å; L45-A49 WeakPolarHBondContact O-CA 3.38Å; L45-A49 WeakPolarHBondContact O-CB 3.42Å; L45-A49 PolarHBondContact O-N 3.39Å; L45-F188 HydrophobicContact CD1-CE1 4.49Å; L45-F192 HydrophobicContact CD1-CZ 4.16Å; L45-F276 HydrophobicContact CB-CE2 3.96Å; L45-F276 HydrophobicContact CB-CZ 4.04Å; L45-F276 HydrophobicContact CD1-CE2 4.13Å; L45-F276 HydrophobicContact CD1-CZ 3.99Å |
| 46 | L | 80.5 | Confident | 81.6 | Confident | 126 Ų | 126 | 90.7 Ų | 90.7 | 66% | 0.66 | 46% | 0.458 | S | S | * | . | H | α-helix | trans | -63.6 | -35.6 | -179.2 | -69.8 | 171.3 | 0 | 0 | 0 | 112.9 | K42 R43 | K42-L46 HydrophobicContact CG-CD1 4.36Å; K42-L46 WeakPolarHBondContact O-CG 3.33Å; K42-L46 PolarHBondContact O-N 3.44Å; R43-L46 PolarHBondContact O-N 2.8Å; R43-L46 VanDerWaalsContact O-N 3.13Å |
| 47 | D | 80.9 | Confident | 83.1 | Confident | 96 Ų | 96 | 89.8 Ų | 89.8 | 51% | 0.513 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -83.7 | -21.3 | -174.5 | -65.4 | -16.4 | 0 | 0 | 0 | 113.1 | R43 L45 | R43-D47 WeakPolarHBondContact CG-OD2 3.44Å; R43-D47 WeakPolarHBondContact O-CB 3.42Å; R43-D47 PolarHBondContact O-N 3.39Å; L45-D47 VanDerWaalsContact C-N 3.3Å; L45-D47 PolarHBondContact O-N 3.14Å |
| 48 | N | 82.4 | Confident | 84.4 | Confident | 34 Ų | 34 | 92 Ų | 92 | 18% | 0.182 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -129.8 | -9.9 | -171.6 | -59.4 | -89.9 | 0 | 0 | 0 | 115.1 | T44 L45 Y50 S136 A191 F192 P275 | T44-N48 WeakPolarHBondContact O-CB 3.42Å; T44-N48 PolarHBondContact O-N 3.45Å; T44-N48 VanDerWaalsContact O-N 3.1Å; T44-N48 PolarHBondContact O-ND2 3.29Å; L45-N48 PolarHBondContact O-N 2.96Å; N48-Y50 WeakPolarHBondContact O-CD2 3.45Å; N48-Y50 WeakPolarHBondContact O-CE2 3.36Å; N48-Y50 PolarHBondContact O-N 2.82Å; N48-S136 WeakPolarHBondContact OD1-CB 3.27Å; N48-S136 PolarHBondContact OD1-OG 3.36Å; N48-A191 VanDerWaalsContact O-O 3.11Å; N48-F192 HydrophobicContact CB-CD1 3.82Å; N48-F192 HydrophobicContact CB-CE1 3.79Å; N48-P275 HydrophobicContact CB-CB 4.13Å; N48-P275 HydrophobicContact CB-CG 4.01Å |
| 49 | A | 85.9 | Confident | 85.6 | Confident | 33 Ų | 33 | 86.9 Ų | 86.9 | 27% | 0.273 | 43% | 0.431 | S | S | . | . | trans | -85.1 | 112.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 109.9 | L45 A191 F192 | L45-A49 HydrophobicContact CG-CB 4.25Å; L45-A49 WeakPolarHBondContact O-CA 3.38Å; L45-A49 WeakPolarHBondContact O-CB 3.42Å; L45-A49 PolarHBondContact O-N 3.39Å; A49-A191 HydrophobicContact CB-CB 4.14Å; A49-F192 HydrophobicContact CB-CE1 4.36Å; A49-F192 HydrophobicContact CB-CZ 4.22Å | ||
| 50 | Y | 85.3 | Confident | 86.6 | Confident | 96 Ų | 96 | 87.1 Ų | 87.1 | 38% | 0.376 | 43% | 0.43 | S | S | . | . | trans | -107.3 | 92.2 | 176.4 | -62.3 | -90.7 | 0 | 0 | 0 | 109.4 | N48 G137 A191 R193 | N48-Y50 WeakPolarHBondContact O-CD2 3.45Å; N48-Y50 WeakPolarHBondContact O-CE2 3.36Å; N48-Y50 PolarHBondContact O-N 2.82Å; Y50-G137 VanDerWaalsContact CD2-CA 3.47Å; Y50-G137 VanDerWaalsContact CZ-CA 3.45Å; Y50-A191 PolarHBondContact N-O 2.91Å; Y50-R193 VanDerWaalsContact CB-NH2 3.33Å; Y50-R193 PolarHBondContact O-NH2 3.02Å | ||
| 51 | I | 86.6 | Confident | 87.6 | Confident | 81 Ų | 81 | 87.3 Ų | 87.3 | 42% | 0.415 | 43% | 0.43 | S | S | . | . | trans | -125.6 | 128.5 | 170.2 | -63.8 | 169.5 | 0 | 0 | 0 | 108.3 | I56 A191 | I51-I56 HydrophobicContact CG2-CD1 3.71Å; I51-I56 HydrophobicContact CG2-CG1 3.55Å; I51-A191 HydrophobicContact CD1-CB 3.79Å; I51-A191 HydrophobicContact CG1-CB 3.91Å | ||
| 52 | T | 89.8 | Confident | 88.6 | Confident | 61 Ų | 61 | 86.1 Ų | 86.1 | 37% | 0.374 | 42% | 0.422 | S | S | . | . | trans | -91.6 | 149.8 | 176.1 | 65.1 | 0 | 0 | 0 | 0 | 111.1 | T54 E55 I56 | T52-T54 VanDerWaalsContact CB-OG1 3.31Å; T52-T54 WeakPolarHBondContact CB-OG1 3.49Å; T52-T54 PolarHBondContact O-N 3.39Å; T52-T54 PolarHBondContact OG1-OG1 3.14Å; T52-E55 WeakPolarHBondContact CB-OE2 3.47Å; T52-E55 PolarHBondContact N-OE2 3.1Å; T52-E55 PolarHBondContact O-N 2.9Å; T52-E55 VanDerWaalsContact O-N 3.1Å; T52-E55 WeakPolarHBondContact OG1-CG 3.47Å; T52-E55 PolarHBondContact OG1-N 2.88Å; T52-E55 VanDerWaalsContact OG1-N 3.14Å; T52-E55 PolarHBondContact OG1-OE2 3.1Å; T52-I56 PolarHBondContact O-N 3.42Å | ||
| 53 | W | 90.4 | Very high | 89.4 | Confident | 217 Ų | 217 | 81 Ų | 81 | 82% | 0.822 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -58.7 | -29.5 | 172.3 | -68 | 109.2 | 0 | 0 | 0 | 112.7 | I56 A57 | W53-I56 HydrophobicContact CE3-CD1 4.11Å; W53-I56 HydrophobicContact CZ3-CD1 4.32Å; W53-I56 PolarHBondContact O-N 3.27Å; W53-A57 VanDerWaalsContact O-CB 3.32Å; W53-A57 WeakPolarHBondContact O-CB 3.42Å; W53-A57 PolarHBondContact O-N 3Å |
| 54 | T | 92.4 | Very high | 90.2 | Very high | 95 Ų | 95 | 78.9 Ų | 78.9 | 58% | 0.583 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -64.4 | -44.3 | 174.1 | 39 | 0 | 0 | 0 | 0 | 112.2 | T52 A57 L58 | T52-T54 VanDerWaalsContact CB-OG1 3.31Å; T52-T54 WeakPolarHBondContact CB-OG1 3.49Å; T52-T54 PolarHBondContact O-N 3.39Å; T52-T54 PolarHBondContact OG1-OG1 3.14Å; T54-A57 PolarHBondContact O-N 3.46Å; T54-L58 WeakPolarHBondContact O-CB 3.21Å; T54-L58 VanDerWaalsContact O-CG 3.23Å; T54-L58 WeakPolarHBondContact O-CG 3.28Å; T54-L58 PolarHBondContact O-N 3.49Å |
| 55 | E | 91.9 | Very high | 91.1 | Very high | 58 Ų | 58 | 81 Ų | 81 | 27% | 0.271 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -63.4 | -42.6 | 176.4 | -74.2 | 156.2 | 153.6 | 0 | 0 | 111.2 | T52 L58 F59 | T52-E55 WeakPolarHBondContact CB-OE2 3.47Å; T52-E55 PolarHBondContact N-OE2 3.1Å; T52-E55 PolarHBondContact O-N 2.9Å; T52-E55 VanDerWaalsContact O-N 3.1Å; T52-E55 WeakPolarHBondContact OG1-CG 3.47Å; T52-E55 PolarHBondContact OG1-N 2.88Å; T52-E55 VanDerWaalsContact OG1-N 3.14Å; T52-E55 PolarHBondContact OG1-OE2 3.1Å; E55-L58 PolarHBondContact O-N 3.11Å; E55-F59 WeakPolarHBondContact O-CB 3.46Å; E55-F59 PolarHBondContact O-N 3.39Å |
| 56 | I | 93.6 | Very high | 91.9 | Very high | 63 Ų | 63 | 79.5 Ų | 79.5 | 32% | 0.323 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -62.5 | -46.8 | 176.3 | -63.1 | 170.4 | 0 | 0 | 0 | 110.8 | I51 T52 W53 F59 F60 | I51-I56 HydrophobicContact CG2-CD1 3.71Å; I51-I56 HydrophobicContact CG2-CG1 3.55Å; T52-I56 PolarHBondContact O-N 3.42Å; W53-I56 HydrophobicContact CE3-CD1 4.11Å; W53-I56 HydrophobicContact CZ3-CD1 4.32Å; W53-I56 PolarHBondContact O-N 3.27Å; I56-F59 WeakPolarHBondContact O-CB 3.25Å; I56-F59 PolarHBondContact O-N 3.37Å; I56-F60 HydrophobicContact CG2-CD2 3.89Å; I56-F60 HydrophobicContact CG2-CE2 3.67Å; I56-F60 VanDerWaalsContact O-CD2 3.23Å; I56-F60 WeakPolarHBondContact O-CD2 3.39Å; I56-F60 PolarHBondContact O-N 3.45Å |
| 57 | A | 95.7 | Very high | 92.6 | Very high | 60 Ų | 60 | 74.8 Ų | 74.8 | 50% | 0.496 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -62.8 | -44.1 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | W53 T54 F59 F60 F61 | W53-A57 VanDerWaalsContact O-CB 3.32Å; W53-A57 WeakPolarHBondContact O-CB 3.42Å; W53-A57 PolarHBondContact O-N 3Å; T54-A57 PolarHBondContact O-N 3.46Å; A57-F59 VanDerWaalsContact C-N 3.33Å; A57-F59 PolarHBondContact O-N 2.99Å; A57-F60 PolarHBondContact O-N 2.85Å; A57-F61 VanDerWaalsContact O-CB 3.28Å; A57-F61 WeakPolarHBondContact O-CB 3.43Å; A57-F61 PolarHBondContact O-N 3.4Å |
| 58 | L | 95.9 | Very high | 93.4 | Very high | 83 Ų | 83 | 72.9 Ų | 72.9 | 44% | 0.435 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -62.1 | -40.8 | 175.9 | -74.4 | 172.2 | 0 | 0 | 0 | 111.6 | T54 E55 F61 C62 L149 | T54-L58 WeakPolarHBondContact O-CB 3.21Å; T54-L58 VanDerWaalsContact O-CG 3.23Å; T54-L58 WeakPolarHBondContact O-CG 3.28Å; T54-L58 PolarHBondContact O-N 3.49Å; E55-L58 PolarHBondContact O-N 3.11Å; L58-F61 PolarHBondContact O-N 2.85Å; L58-C62 VanDerWaalsContact O-CB 3.3Å; L58-C62 WeakPolarHBondContact O-CB 3.5Å; L58-C62 PolarHBondContact O-N 2.82Å; L58-C62 PolarHBondContact O-SG 3.39Å; L58-C62 VanDerWaalsContact O-SG 3.35Å; L58-L149 HydrophobicContact CB-CD1 3.94Å; L58-L149 HydrophobicContact CB-CD2 4.18Å; L58-L149 HydrophobicContact CD1-CD2 4.47Å |
| 59 | F | 96.6 | Very high | 94.1 | Very high | 41 Ų | 41 | 74.5 Ų | 74.5 | 18% | 0.18 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -56.4 | -53.3 | 176.4 | 170.2 | -88.1 | 0 | 0 | 0 | 111.8 | E55 I56 A57 F61 C62 A63 L149 G152 S153 L183 | E55-F59 WeakPolarHBondContact O-CB 3.46Å; E55-F59 PolarHBondContact O-N 3.39Å; I56-F59 WeakPolarHBondContact O-CB 3.25Å; I56-F59 PolarHBondContact O-N 3.37Å; A57-F59 VanDerWaalsContact C-N 3.33Å; A57-F59 PolarHBondContact O-N 2.99Å; F59-F61 PolarHBondContact O-N 3.4Å; F59-C62 PolarHBondContact O-N 3.4Å; F59-A63 WeakPolarHBondContact O-CB 3.38Å; F59-A63 PolarHBondContact O-N 2.88Å; F59-L149 HydrophobicContact CB-CD1 4.42Å; F59-G152 WeakPolarHBondContact CE2-O 3.39Å; F59-S153 WeakPolarHBondContact O-CB 3.44Å; F59-L183 HydrophobicContact CE2-CD1 3.62Å; F59-L183 HydrophobicContact CZ-CD1 3.75Å; F59-L183 HydrophobicContact CZ-CD2 4.2Å |
| 60 | F | 96.7 | Very high | 94.6 | Very high | 137 Ų | 137 | 73.6 Ų | 73.6 | 60% | 0.601 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -66.7 | -38.9 | -179.2 | -75.5 | -67.8 | 0 | 0 | 0 | 112 | I56 A57 A63 F64 | I56-F60 HydrophobicContact CG2-CD2 3.89Å; I56-F60 HydrophobicContact CG2-CE2 3.67Å; I56-F60 VanDerWaalsContact O-CD2 3.23Å; I56-F60 WeakPolarHBondContact O-CD2 3.39Å; I56-F60 PolarHBondContact O-N 3.45Å; A57-F60 PolarHBondContact O-N 2.85Å; F60-A63 PolarHBondContact O-N 3.44Å; F60-F64 WeakPolarHBondContact O-CB 3.39Å; F60-F64 PolarHBondContact O-N 3.29Å |
| 61 | F | 97.5 | Very high | 95.1 | Very high | 119 Ų | 119 | 75.6 Ų | 75.6 | 52% | 0.522 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -60.4 | -49.9 | 175 | 175.8 | -105.6 | 0 | 0 | 0 | 111.6 | A57 L58 F59 A63 F64 L65 | A57-F61 VanDerWaalsContact O-CB 3.28Å; A57-F61 WeakPolarHBondContact O-CB 3.43Å; A57-F61 PolarHBondContact O-N 3.4Å; L58-F61 PolarHBondContact O-N 2.85Å; F59-F61 PolarHBondContact O-N 3.4Å; F61-A63 PolarHBondContact O-N 3.16Å; F61-F64 PolarHBondContact O-N 2.93Å; F61-L65 HydrophobicContact CD1-CD1 3.89Å; F61-L65 HydrophobicContact CD1-CG 4.45Å; F61-L65 HydrophobicContact CE1-CD1 3.32Å; F61-L65 HydrophobicContact CE1-CG 4.11Å; F61-L65 HydrophobicContact CE2-CD1 4.36Å; F61-L65 HydrophobicContact CE2-CG 4.36Å; F61-L65 HydrophobicContact CZ-CD1 3.59Å; F61-L65 HydrophobicContact CZ-CD2 4.29Å; F61-L65 HydrophobicContact CZ-CG 4.06Å; F61-L65 WeakPolarHBondContact O-CG 3.37Å; F61-L65 PolarHBondContact O-N 2.89Å |
| 62 | C | 97.5 | Very high | 95.6 | Very high | 26 Ų | 26 | 80.1 Ų | 80.1 | 18% | 0.176 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -63.9 | -39 | 177.4 | -72.9 | 0 | 0 | 0 | 0 | 112.1 | L58 F59 F64 L65 W66 S153 | L58-C62 VanDerWaalsContact O-CB 3.3Å; L58-C62 WeakPolarHBondContact O-CB 3.5Å; L58-C62 PolarHBondContact O-N 2.82Å; L58-C62 PolarHBondContact O-SG 3.39Å; L58-C62 VanDerWaalsContact O-SG 3.35Å; F59-C62 PolarHBondContact O-N 3.4Å; C62-F64 VanDerWaalsContact C-N 3.33Å; C62-F64 PolarHBondContact O-N 3.47Å; C62-L65 WeakPolarHBondContact O-CB 3.33Å; C62-L65 PolarHBondContact O-N 2.93Å; C62-W66 PolarHBondContact O-N 3.34Å; C62-S153 VanDerWaalsContact CB-CB 3.47Å; C62-S153 WeakPolarHBondContact CB-OG 3.11Å |
| 63 | A | 97.1 | Very high | 95.9 | Very high | 12 Ų | 12 | 79.7 Ų | 79.7 | 10% | 0.099 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -62.5 | -41.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | F59 F60 F61 W66 T67 S153 | F59-A63 WeakPolarHBondContact O-CB 3.38Å; F59-A63 PolarHBondContact O-N 2.88Å; F60-A63 PolarHBondContact O-N 3.44Å; F61-A63 PolarHBondContact O-N 3.16Å; A63-W66 PolarHBondContact O-N 3.47Å; A63-T67 PolarHBondContact O-N 3.32Å; A63-T67 PolarHBondContact O-OG1 3.35Å; A63-S153 WeakPolarHBondContact CB-O 3.46Å |
| 64 | F | 97.1 | Very high | 96.2 | Very high | 129 Ų | 129 | 70.4 Ų | 70.4 | 57% | 0.566 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -64.8 | -43.2 | 173.2 | -179.7 | -109.1 | 0 | 0 | 0 | 111.9 | F60 F61 C62 W66 T67 I68 | F60-F64 WeakPolarHBondContact O-CB 3.39Å; F60-F64 PolarHBondContact O-N 3.29Å; F61-F64 PolarHBondContact O-N 2.93Å; C62-F64 VanDerWaalsContact C-N 3.33Å; C62-F64 PolarHBondContact O-N 3.47Å; F64-W66 VanDerWaalsContact C-N 3.35Å; F64-W66 PolarHBondContact O-N 3.38Å; F64-T67 VanDerWaalsContact O-CB 3.29Å; F64-T67 WeakPolarHBondContact O-CB 3.21Å; F64-T67 PolarHBondContact O-N 2.93Å; F64-T67 VanDerWaalsContact O-N 3.15Å; F64-I68 HydrophobicContact CD1-CD1 3.76Å; F64-I68 HydrophobicContact CE1-CD1 3.27Å; F64-I68 HydrophobicContact CE1-CG1 4.27Å; F64-I68 HydrophobicContact CE2-CD1 4.44Å; F64-I68 HydrophobicContact CZ-CD1 3.66Å; F64-I68 HydrophobicContact CZ-CG1 4.29Å; F64-I68 PolarHBondContact O-N 2.67Å; F64-I68 VanDerWaalsContact O-N 3.14Å |
| 65 | L | 97.5 | Very high | 96.3 | Very high | 63 Ų | 63 | 70.5 Ų | 70.5 | 33% | 0.33 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -59.6 | -42.7 | 174.8 | -73.5 | -178.1 | 0 | 0 | 0 | 112.3 | F61 C62 T67 I68 I69 | F61-L65 HydrophobicContact CD1-CD1 3.89Å; F61-L65 HydrophobicContact CD1-CG 4.45Å; F61-L65 HydrophobicContact CE1-CD1 3.32Å; F61-L65 HydrophobicContact CE1-CG 4.11Å; F61-L65 HydrophobicContact CE2-CD1 4.36Å; F61-L65 HydrophobicContact CE2-CG 4.36Å; F61-L65 HydrophobicContact CZ-CD1 3.59Å; F61-L65 HydrophobicContact CZ-CD2 4.29Å; F61-L65 HydrophobicContact CZ-CG 4.06Å; F61-L65 WeakPolarHBondContact O-CG 3.37Å; F61-L65 PolarHBondContact O-N 2.89Å; C62-L65 WeakPolarHBondContact O-CB 3.33Å; C62-L65 PolarHBondContact O-N 2.93Å; L65-T67 PolarHBondContact O-N 3.46Å; L65-I68 PolarHBondContact O-N 2.81Å; L65-I68 VanDerWaalsContact O-N 3.09Å; L65-I69 VanDerWaalsContact O-CG1 3.29Å; L65-I69 WeakPolarHBondContact O-CG1 3.25Å; L65-I69 PolarHBondContact O-N 3.25Å |
| 66 | W | 97.8 | Very high | 96.5 | Very high | 39 Ų | 39 | 72.2 Ų | 72.2 | 15% | 0.148 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -57.5 | -39.9 | 175.5 | -72 | 129.2 | 0 | 0 | 0 | 112.1 | C62 A63 F64 I68 I69 R70 W100 F104 M107 I150 S153 F154 H157 | C62-W66 PolarHBondContact O-N 3.34Å; A63-W66 PolarHBondContact O-N 3.47Å; F64-W66 VanDerWaalsContact C-N 3.35Å; F64-W66 PolarHBondContact O-N 3.38Å; W66-I68 PolarHBondContact O-N 2.81Å; W66-I69 HydrophobicContact CE3-CD1 4.09Å; W66-I69 HydrophobicContact CZ3-CD1 4.21Å; W66-I69 PolarHBondContact O-N 2.96Å; W66-R70 VanDerWaalsContact O-CB 3.25Å; W66-R70 WeakPolarHBondContact O-CB 3.39Å; W66-R70 PolarHBondContact O-N 3.49Å; W66-W100 HydrophobicContact CB-CZ2 4.47Å; W66-W100 AromaticContact CE3-CH2 3.71Å; W66-W100 HydrophobicContact CE3-CH2 3.71Å; W66-W100 HydrophobicContact CE3-CZ2 4.06Å; W66-W100 HydrophobicContact CZ3-CH2 4.2Å; W66-F104 HydrophobicContact CH2-CD2 4.36Å; W66-F104 HydrophobicContact CH2-CE2 4.38Å; W66-F104 HydrophobicContact CZ2-CD2 4.49Å; W66-F104 HydrophobicContact CZ2-CE2 4.11Å; W66-M107 HydrophobicContact CH2-CE 3.93Å; W66-I150 HydrophobicContact CZ2-CG2 4.01Å; W66-S153 PolarHBondContact NE1-OG 3.12Å; W66-F154 HydrophobicContact CD2-CD2 4.48Å; W66-F154 HydrophobicContact CG-CD2 4.46Å; W66-H157 HydrophobicContact CB-CB 3.87Å |
| 67 | T | 96.7 | Very high | 96.6 | Very high | 28 Ų | 28 | 73.4 Ų | 73.4 | 17% | 0.172 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -61.1 | -45 | 175.6 | -47.7 | 0 | 0 | 0 | 0 | 111.5 | A63 F64 L65 K71 H157 Y160 M165 | A63-T67 PolarHBondContact O-N 3.32Å; A63-T67 PolarHBondContact O-OG1 3.35Å; F64-T67 VanDerWaalsContact O-CB 3.29Å; F64-T67 WeakPolarHBondContact O-CB 3.21Å; F64-T67 PolarHBondContact O-N 2.93Å; F64-T67 VanDerWaalsContact O-N 3.15Å; L65-T67 PolarHBondContact O-N 3.46Å; T67-K71 WeakPolarHBondContact O-CB 3.44Å; T67-K71 PolarHBondContact O-N 3.12Å; T67-H157 PolarHBondContact OG1-CD2 2.92Å; T67-H157 VanDerWaalsContact OG1-CD2 3.28Å; T67-Y160 HydrophobicContact CG2-CD1 4.24Å; T67-Y160 HydrophobicContact CG2-CE1 3.82Å; T67-M165 HydrophobicContact CG2-SD 4.28Å |
| 68 | I | 96.9 | Very high | 96.6 | Very high | 55 Ų | 55 | 71 Ų | 71 | 28% | 0.282 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -65.7 | -47.8 | 178.4 | -66.5 | 168.2 | 0 | 0 | 0 | 110.7 | F64 L65 W66 R70 K71 R72 | F64-I68 HydrophobicContact CD1-CD1 3.76Å; F64-I68 HydrophobicContact CE1-CD1 3.27Å; F64-I68 HydrophobicContact CE1-CG1 4.27Å; F64-I68 HydrophobicContact CE2-CD1 4.44Å; F64-I68 HydrophobicContact CZ-CD1 3.66Å; F64-I68 HydrophobicContact CZ-CG1 4.29Å; F64-I68 PolarHBondContact O-N 2.67Å; F64-I68 VanDerWaalsContact O-N 3.14Å; L65-I68 PolarHBondContact O-N 2.81Å; L65-I68 VanDerWaalsContact O-N 3.09Å; W66-I68 PolarHBondContact O-N 2.81Å; I68-R70 VanDerWaalsContact C-N 3.35Å; I68-R70 PolarHBondContact O-N 2.98Å; I68-K71 PolarHBondContact O-N 3.35Å; I68-R72 HydrophobicContact CG2-CG 4.36Å; I68-R72 WeakPolarHBondContact O-CG 3.35Å; I68-R72 PolarHBondContact O-N 3.05Å |
| 69 | I | 97.3 | Very high | 96.6 | Very high | 69 Ų | 69 | 71 Ų | 71 | 35% | 0.354 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -60.4 | -47.5 | -179.7 | -66.6 | 167.5 | 0 | 0 | 0 | 109.6 | L65 W66 K71 R72 L73 W100 | L65-I69 VanDerWaalsContact O-CG1 3.29Å; L65-I69 WeakPolarHBondContact O-CG1 3.25Å; L65-I69 PolarHBondContact O-N 3.25Å; W66-I69 HydrophobicContact CE3-CD1 4.09Å; W66-I69 HydrophobicContact CZ3-CD1 4.21Å; W66-I69 PolarHBondContact O-N 2.96Å; I69-K71 VanDerWaalsContact C-N 3.34Å; I69-K71 PolarHBondContact O-N 3.25Å; I69-R72 PolarHBondContact O-N 3.47Å; I69-L73 HydrophobicContact CG2-CD1 3.82Å; I69-L73 HydrophobicContact CG2-CG 4.26Å; I69-L73 WeakPolarHBondContact O-CB 3.46Å; I69-L73 WeakPolarHBondContact O-CG 3.39Å; I69-L73 PolarHBondContact O-N 3.08Å; I69-W100 HydrophobicContact CB-CH2 4.11Å; I69-W100 HydrophobicContact CB-CZ3 4.47Å; I69-W100 HydrophobicContact CG2-CH2 3.74Å; I69-W100 HydrophobicContact CG2-CZ3 3.69Å |
| 70 | R | 97.2 | Very high | 96.5 | Very high | 14 Ų | 14 | 71.5 Ų | 71.5 | 5% | 0.053 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -54.1 | -50.3 | 175.7 | -179.6 | 178 | 175.5 | 178.6 | -1.6 | 111.4 | W66 I68 T74 W100 H157 M165 D166 | W66-R70 VanDerWaalsContact O-CB 3.25Å; W66-R70 WeakPolarHBondContact O-CB 3.39Å; W66-R70 PolarHBondContact O-N 3.49Å; I68-R70 VanDerWaalsContact C-N 3.35Å; I68-R70 PolarHBondContact O-N 2.98Å; R70-T74 VanDerWaalsContact O-CB 3.26Å; R70-T74 WeakPolarHBondContact O-CB 3.37Å; R70-T74 PolarHBondContact O-N 2.79Å; R70-T74 PolarHBondContact O-OG1 3.04Å; R70-W100 HydrophobicContact CB-CD2 3.79Å; R70-W100 HydrophobicContact CB-CE3 4.16Å; R70-W100 HydrophobicContact CB-CG 4.34Å; R70-W100 HydrophobicContact CB-CH2 4.07Å; R70-W100 HydrophobicContact CB-CZ2 3.72Å; R70-W100 HydrophobicContact CB-CZ3 4.32Å; R70-W100 HydrophobicContact CG-CB 4.45Å; R70-W100 HydrophobicContact CG-CD2 3.72Å; R70-W100 HydrophobicContact CG-CE3 4.37Å; R70-W100 HydrophobicContact CG-CG 3.73Å; R70-W100 HydrophobicContact CG-CZ2 4.44Å; R70-H157 WeakPolarHBondContact CD-NE2 3.38Å; R70-M165 HydrophobicContact CG-CE 4.34Å; R70-D166 IonicContact CZ-OD1 3.79Å; R70-D166 VanDerWaalsContact CZ-OD1 3.25Å; R70-D166 IonicContact NH1-OD1 3Å; R70-D166 PolarHBondContact NH1-OD1 3.31Å; R70-D166 IonicContact NH2-OD1 4Å; R70-D166 PolarHBondContact NH2-OD1 3.15Å |
| 71 | K | 95.6 | Very high | 96.4 | Very high | 138 Ų | 138 | 68.3 Ų | 68.3 | 60% | 0.6 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -61.8 | -45.5 | -179 | -172 | 177.3 | -179 | 178.8 | 0 | 111.2 | T67 I68 I69 T74 E75 | T67-K71 WeakPolarHBondContact O-CB 3.44Å; T67-K71 PolarHBondContact O-N 3.12Å; I68-K71 PolarHBondContact O-N 3.35Å; I69-K71 VanDerWaalsContact C-N 3.34Å; I69-K71 PolarHBondContact O-N 3.25Å; K71-T74 PolarHBondContact O-N 2.92Å; K71-E75 PolarHBondContact O-N 2.85Å; K71-E75 VanDerWaalsContact O-N 3.12Å |
| 72 | R | 96.4 | Very high | 96.2 | Very high | 176 Ų | 176 | 62.8 Ų | 62.8 | 66% | 0.664 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -63.3 | -49 | 178.4 | -72.5 | -175.8 | -179.7 | -165.3 | 1.5 | 112 | I68 I69 T74 E75 S76 | I68-R72 HydrophobicContact CG2-CG 4.36Å; I68-R72 WeakPolarHBondContact O-CG 3.35Å; I68-R72 PolarHBondContact O-N 3.05Å; I69-R72 PolarHBondContact O-N 3.47Å; R72-T74 VanDerWaalsContact C-N 3.29Å; R72-T74 PolarHBondContact O-N 3Å; R72-E75 PolarHBondContact O-N 3.01Å; R72-S76 VanDerWaalsContact O-CB 3.24Å; R72-S76 WeakPolarHBondContact O-CB 3.21Å; R72-S76 PolarHBondContact O-N 3.46Å; R72-S76 PolarHBondContact O-OG 3.39Å |
| 73 | L | 96.6 | Very high | 95.9 | Very high | 52 Ų | 52 | 68.5 Ų | 68.5 | 27% | 0.272 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -63.6 | -35.8 | 177.8 | -71.3 | 176.7 | 0 | 0 | 0 | 112.4 | I69 L77 F78 W100 | I69-L73 HydrophobicContact CG2-CD1 3.82Å; I69-L73 HydrophobicContact CG2-CG 4.26Å; I69-L73 WeakPolarHBondContact O-CB 3.46Å; I69-L73 WeakPolarHBondContact O-CG 3.39Å; I69-L73 PolarHBondContact O-N 3.08Å; L73-L77 HydrophobicContact CD2-CD2 4.32Å; L73-L77 WeakPolarHBondContact O-CA 3.21Å; L73-L77 WeakPolarHBondContact O-CB 3.41Å; L73-L77 PolarHBondContact O-N 3.22Å; L73-F78 HydrophobicContact CB-CD2 4.27Å; L73-F78 HydrophobicContact CB-CE2 3.7Å; L73-F78 HydrophobicContact CB-CZ 3.94Å; L73-F78 HydrophobicContact CD1-CZ 4.29Å; L73-F78 PolarHBondContact O-N 3.29Å; L73-W100 HydrophobicContact CD1-CE3 3.94Å; L73-W100 HydrophobicContact CD1-CZ3 3.64Å |
| 74 | T | 95.9 | Very high | 95.7 | Very high | 21 Ų | 21 | 77.3 Ų | 77.3 | 13% | 0.129 | 37% | 0.367 | C | S | . | . | I | π-helix | trans | -59.5 | -50.7 | 175.3 | -64 | 0 | 0 | 0 | 0 | 111.5 | R70 K71 R72 K79 P96 | R70-T74 VanDerWaalsContact O-CB 3.26Å; R70-T74 WeakPolarHBondContact O-CB 3.37Å; R70-T74 PolarHBondContact O-N 2.79Å; R70-T74 PolarHBondContact O-OG1 3.04Å; K71-T74 PolarHBondContact O-N 2.92Å; R72-T74 VanDerWaalsContact C-N 3.29Å; R72-T74 PolarHBondContact O-N 3Å; T74-K79 HydrophobicContact CG2-CD 4.33Å; T74-K79 HydrophobicContact CG2-CG 4.36Å; T74-K79 WeakPolarHBondContact O-CB 3.39Å; T74-K79 WeakPolarHBondContact O-CG 3.35Å; T74-K79 PolarHBondContact O-N 2.77Å; T74-P96 HydrophobicContact CG2-CB 3.86Å; T74-P96 HydrophobicContact CG2-CG 4.48Å |
| 75 | E | 95.3 | Very high | 95.4 | Very high | 97 Ų | 97 | 71.5 Ų | 71.5 | 45% | 0.453 | 34% | 0.342 | S | S | . | . | I | π-helix | trans | -75.4 | -40 | -178.3 | -61.9 | -56.6 | 153.1 | 0 | 0 | 112.9 | K71 R72 K79 P80 | K71-E75 PolarHBondContact O-N 2.85Å; K71-E75 VanDerWaalsContact O-N 3.12Å; R72-E75 PolarHBondContact O-N 3.01Å; E75-K79 IonicContact OE1-NZ 3.68Å; E75-K79 PolarHBondContact OE1-NZ 3.28Å; E75-K79 WeakPolarHBondContact OE2-CD 3.46Å; E75-K79 IonicContact OE2-NZ 3.32Å; E75-K79 PolarHBondContact OE2-NZ 3.38Å; E75-P80 VanDerWaalsContact O-CD 3.23Å; E75-P80 WeakPolarHBondContact O-CD 3.42Å; E75-P80 WeakPolarHBondContact O-CG 3.45Å |
| 76 | S | 95.6 | Very high | 95.2 | Very high | 95 Ų | 95 | 77.7 Ų | 77.7 | 66% | 0.664 | 36% | 0.361 | S | S | * | . | I | π-helix | trans | -89.7 | -24.6 | -171.2 | -57.4 | 0 | 0 | 0 | 0 | 114.4 | R72 | R72-S76 VanDerWaalsContact O-CB 3.24Å; R72-S76 WeakPolarHBondContact O-CB 3.21Å; R72-S76 PolarHBondContact O-N 3.46Å; R72-S76 PolarHBondContact O-OG 3.39Å |
| 77 | L | 96.5 | Very high | 94.9 | Very high | 88 Ų | 88 | 76.7 Ų | 76.7 | 46% | 0.461 | 36% | 0.358 | S | S | . | . | I | π-helix | trans | -124.3 | -57.1 | -174.5 | -177.7 | 64.1 | 0 | 0 | 0 | 112.2 | L73 L81 | L73-L77 HydrophobicContact CD2-CD2 4.32Å; L73-L77 WeakPolarHBondContact O-CA 3.21Å; L73-L77 WeakPolarHBondContact O-CB 3.41Å; L73-L77 PolarHBondContact O-N 3.22Å; L77-L81 WeakPolarHBondContact O-CB 3.47Å; L77-L81 PolarHBondContact O-N 3.32Å |
| 78 | F | 95.9 | Very high | 94.5 | Very high | 9 Ų | 9 | 79.5 Ų | 79.5 | 4% | 0.039 | 37% | 0.371 | C | S | . | . | I | π-helix | trans | -72.1 | -45.9 | -168.2 | -54.7 | -34.9 | 0 | 0 | 0 | 113.2 | L73 L81 A82 M95 P96 A99 W100 V103 | L73-F78 HydrophobicContact CB-CD2 4.27Å; L73-F78 HydrophobicContact CB-CE2 3.7Å; L73-F78 HydrophobicContact CB-CZ 3.94Å; L73-F78 HydrophobicContact CD1-CZ 4.29Å; L73-F78 PolarHBondContact O-N 3.29Å; F78-L81 PolarHBondContact O-N 3.27Å; F78-A82 WeakPolarHBondContact O-CB 3.47Å; F78-A82 PolarHBondContact O-N 2.9Å; F78-M95 HydrophobicContact CB-SD 4.32Å; F78-M95 VanDerWaalsContact O-SD 3.37Å; F78-P96 HydrophobicContact CB-CB 3.85Å; F78-P96 HydrophobicContact CB-CG 4.17Å; F78-P96 HydrophobicContact CD2-CB 4.29Å; F78-A99 HydrophobicContact CD1-CB 3.65Å; F78-A99 HydrophobicContact CD2-CB 4.16Å; F78-A99 HydrophobicContact CE1-CB 3.71Å; F78-A99 HydrophobicContact CE2-CB 4.22Å; F78-A99 HydrophobicContact CG-CB 3.9Å; F78-A99 HydrophobicContact CZ-CB 4Å; F78-W100 HydrophobicContact CE2-CB 3.94Å; F78-W100 HydrophobicContact CE2-CE3 4.47Å; F78-V103 HydrophobicContact CZ-CG2 4.32Å |
| 79 | K | 94.5 | Very high | 94.1 | Very high | 82 Ų | 82 | 82.2 Ų | 82.2 | 36% | 0.357 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -63.9 | -47.8 | 175.9 | -77.1 | 176.3 | 176.6 | 179.1 | 0 | 112.6 | T74 E75 L81 A82 Q83 P96 | T74-K79 HydrophobicContact CG2-CD 4.33Å; T74-K79 HydrophobicContact CG2-CG 4.36Å; T74-K79 WeakPolarHBondContact O-CB 3.39Å; T74-K79 WeakPolarHBondContact O-CG 3.35Å; T74-K79 PolarHBondContact O-N 2.77Å; E75-K79 IonicContact OE1-NZ 3.68Å; E75-K79 PolarHBondContact OE1-NZ 3.28Å; E75-K79 WeakPolarHBondContact OE2-CD 3.46Å; E75-K79 IonicContact OE2-NZ 3.32Å; E75-K79 PolarHBondContact OE2-NZ 3.38Å; K79-L81 VanDerWaalsContact C-N 3.29Å; K79-L81 PolarHBondContact O-N 2.83Å; K79-A82 WeakPolarHBondContact O-CB 3.49Å; K79-A82 PolarHBondContact O-N 3.1Å; K79-Q83 WeakPolarHBondContact O-CG 3.4Å; K79-Q83 PolarHBondContact O-N 3.47Å; K79-P96 HydrophobicContact CG-CG 4.21Å |
| 80 | P | 94.9 | Very high | 93.7 | Very high | 53 Ų | 53 | 84.8 Ų | 84.8 | 34% | 0.344 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -58.3 | -40.6 | 173.6 | -27.9 | 36.3 | 0 | 0 | 0 | 112.7 | E75 Q83 W84 | E75-P80 VanDerWaalsContact O-CD 3.23Å; E75-P80 WeakPolarHBondContact O-CD 3.42Å; E75-P80 WeakPolarHBondContact O-CG 3.45Å; P80-Q83 PolarHBondContact O-N 3.43Å; P80-W84 VanDerWaalsContact O-CB 3.3Å; P80-W84 WeakPolarHBondContact O-CB 3.13Å; P80-W84 PolarHBondContact O-N 3.36Å |
| 81 | L | 93.6 | Very high | 93.4 | Very high | 69 Ų | 69 | 85 Ų | 85 | 36% | 0.361 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -63.9 | -42.1 | 177 | -176.6 | 61.8 | 0 | 0 | 0 | 111.6 | L77 F78 K79 Q83 W84 C85 M95 | L77-L81 WeakPolarHBondContact O-CB 3.47Å; L77-L81 PolarHBondContact O-N 3.32Å; F78-L81 PolarHBondContact O-N 3.27Å; K79-L81 VanDerWaalsContact C-N 3.29Å; K79-L81 PolarHBondContact O-N 2.83Å; L81-Q83 VanDerWaalsContact C-N 3.33Å; L81-Q83 PolarHBondContact O-N 3.22Å; L81-W84 HydrophobicContact CD1-CE3 3.86Å; L81-W84 HydrophobicContact CD1-CZ3 4.28Å; L81-W84 PolarHBondContact O-N 2.97Å; L81-C85 WeakPolarHBondContact O-CB 3.5Å; L81-C85 PolarHBondContact O-N 3.34Å; L81-C85 PolarHBondContact O-SG 2.9Å; L81-M95 HydrophobicContact CB-CE 4.07Å; L81-M95 HydrophobicContact CD2-CE 3.67Å; L81-M95 HydrophobicContact CG-CE 3.78Å |
| 82 | A | 93.7 | Very high | 93.1 | Very high | 3 Ų | 3 | 79.8 Ų | 79.8 | 3% | 0.025 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -60.7 | -40.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | F78 K79 C85 R86 L87 A92 M95 | F78-A82 WeakPolarHBondContact O-CB 3.47Å; F78-A82 PolarHBondContact O-N 2.9Å; K79-A82 WeakPolarHBondContact O-CB 3.49Å; K79-A82 PolarHBondContact O-N 3.1Å; A82-C85 WeakPolarHBondContact O-CB 3.4Å; A82-R86 PolarHBondContact O-N 3.35Å; A82-R86 VanDerWaalsContact O-N 3.1Å; A82-L87 HydrophobicContact CB-CD1 3.9Å; A82-L87 PolarHBondContact O-N 3.16Å; A82-L87 VanDerWaalsContact O-N 3.11Å; A82-A92 HydrophobicContact CB-CB 4.21Å; A82-M95 HydrophobicContact CB-SD 3.85Å |
| 83 | Q | 92.4 | Very high | 92.8 | Very high | 146 Ų | 146 | 75.2 Ų | 75.2 | 68% | 0.682 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -71.2 | -44.5 | 177.8 | -71.3 | 174.1 | -11.7 | 0 | 0 | 112.4 | K79 P80 L81 C85 R86 | K79-Q83 WeakPolarHBondContact O-CG 3.4Å; K79-Q83 PolarHBondContact O-N 3.47Å; P80-Q83 PolarHBondContact O-N 3.43Å; L81-Q83 VanDerWaalsContact C-N 3.33Å; L81-Q83 PolarHBondContact O-N 3.22Å; Q83-C85 PolarHBondContact O-N 2.91Å; Q83-R86 WeakPolarHBondContact O-CA 3.31Å; Q83-R86 PolarHBondContact O-N 3.38Å |
| 84 | W | 91.9 | Very high | 92.6 | Very high | 198 Ų | 198 | 77.3 Ų | 77.3 | 75% | 0.75 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -59.2 | -39.4 | 174.6 | 179.5 | 72.1 | 0 | 0 | 0 | 111 | P80 L81 R86 | P80-W84 VanDerWaalsContact O-CB 3.3Å; P80-W84 WeakPolarHBondContact O-CB 3.13Å; P80-W84 PolarHBondContact O-N 3.36Å; L81-W84 HydrophobicContact CD1-CE3 3.86Å; L81-W84 HydrophobicContact CD1-CZ3 4.28Å; L81-W84 PolarHBondContact O-N 2.97Å; W84-R86 PolarHBondContact O-N 2.99Å |
| 85 | C | 91.4 | Very high | 92.4 | Very high | 7 Ų | 7 | 76.8 Ų | 76.8 | 5% | 0.047 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -65.8 | -23.9 | 171.4 | -75 | 0 | 0 | 0 | 0 | 112.9 | L81 A82 Q83 L87 L221 R224 | L81-C85 WeakPolarHBondContact O-CB 3.5Å; L81-C85 PolarHBondContact O-N 3.34Å; L81-C85 PolarHBondContact O-SG 2.9Å; A82-C85 WeakPolarHBondContact O-CB 3.4Å; Q83-C85 PolarHBondContact O-N 2.91Å; C85-L87 HydrophobicContact CB-CD2 4.19Å; C85-L87 HydrophobicContact CB-CG 3.88Å; C85-L221 HydrophobicContact CB-CD2 4.43Å; C85-R224 HydrophobicContact CB-CG 3.87Å; C85-R224 VanDerWaalsContact O-CD 3.27Å; C85-R224 WeakPolarHBondContact O-CD 3.44Å; C85-R224 WeakPolarHBondContact O-CG 3.49Å; C85-R224 VanDerWaalsContact SG-CD 3.55Å; C85-R224 PolarHBondContact SG-NH1 2.86Å |
| 86 | R | 92.3 | Very high | 92.4 | Very high | 193 Ų | 193 | 72.7 Ų | 72.7 | 73% | 0.728 | 37% | 0.371 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 57 | 49 | -169.7 | -52.7 | 177.6 | -178.9 | -177.3 | -0.6 | 111.4 | A82 Q83 W84 G225 | A82-R86 PolarHBondContact O-N 3.35Å; A82-R86 VanDerWaalsContact O-N 3.1Å; Q83-R86 WeakPolarHBondContact O-CA 3.31Å; Q83-R86 PolarHBondContact O-N 3.38Å; W84-R86 PolarHBondContact O-N 2.99Å; R86-G225 PolarHBondContact O-N 3.34Å; R86-G225 VanDerWaalsContact O-N 3.1Å |
| 87 | L | 92 | Very high | 92.3 | Very high | 17 Ų | 17 | 68.9 Ų | 68.9 | 9% | 0.089 | 34% | 0.342 | C | S | . | . | trans | -65.6 | 150.9 | 173 | -67.2 | -175.9 | 0 | 0 | 0 | 111.1 | A82 C85 A92 M95 Y220 L221 R224 | A82-L87 HydrophobicContact CB-CD1 3.9Å; A82-L87 PolarHBondContact O-N 3.16Å; A82-L87 VanDerWaalsContact O-N 3.11Å; C85-L87 HydrophobicContact CB-CD2 4.19Å; C85-L87 HydrophobicContact CB-CG 3.88Å; L87-A92 HydrophobicContact CB-CB 4.04Å; L87-M95 HydrophobicContact CD1-CB 4.12Å; L87-M95 HydrophobicContact CD1-CG 4.04Å; L87-Y220 VanDerWaalsContact CD2-O 3.22Å; L87-Y220 WeakPolarHBondContact CD2-O 3.35Å; L87-L221 HydrophobicContact CD2-CD2 4.18Å; L87-R224 HydrophobicContact CD2-CB 4.15Å; L87-R224 HydrophobicContact CD2-CG 4.09Å | ||
| 88 | M | 89.2 | Confident | 92.2 | Very high | 88 Ų | 88 | 64.8 Ų | 64.8 | 43% | 0.433 | 32% | 0.321 | S | S | . | . | trans | -58.5 | 144.8 | 170.5 | -66.9 | -173.3 | 71.4 | 0 | 0 | 110.2 | K90 D91 A92 | M88-K90 HydrophobicContact CB-CG 4.1Å; M88-K90 HydrophobicContact CE-CD 4.46Å; M88-K90 PolarHBondContact O-N 3.44Å; M88-K90 VanDerWaalsContact O-N 3.08Å; M88-D91 PolarHBondContact O-N 3.47Å; M88-A92 WeakPolarHBondContact O-CB 3.4Å; M88-A92 PolarHBondContact O-N 2.94Å | ||
| 89 | P | 88.6 | Confident | 92.3 | Very high | 112 Ų | 112 | 64.8 Ų | 64.8 | 73% | 0.727 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -52.7 | -38.5 | -176.7 | -28.8 | 34.8 | 0 | 0 | 0 | 114 | D91 A93 | P89-D91 VanDerWaalsContact C-N 3.31Å; P89-D91 PolarHBondContact O-N 2.97Å; P89-A93 PolarHBondContact O-N 3.46Å; P89-A93 VanDerWaalsContact O-N 3.14Å |
| 90 | K | 88.2 | Confident | 92.4 | Very high | 122 Ų | 122 | 61 Ų | 61 | 53% | 0.53 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -61.7 | -34.9 | 177.2 | 66.6 | 173 | -170.7 | -178.3 | 0 | 113.7 | M88 K94 | M88-K90 HydrophobicContact CB-CG 4.1Å; M88-K90 HydrophobicContact CE-CD 4.46Å; M88-K90 PolarHBondContact O-N 3.44Å; M88-K90 VanDerWaalsContact O-N 3.08Å; K90-K94 WeakPolarHBondContact O-CG 3.23Å |
| 91 | D | 90 | Very high | 92.5 | Very high | 19 Ų | 19 | 60.2 Ų | 60.2 | 10% | 0.102 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -92.2 | -36.5 | -174.8 | -61.5 | -39.6 | 0 | 0 | 0 | 109.7 | M88 P89 A93 K94 M95 Y220 | M88-D91 PolarHBondContact O-N 3.47Å; P89-D91 VanDerWaalsContact C-N 3.31Å; P89-D91 PolarHBondContact O-N 2.97Å; D91-A93 PolarHBondContact O-N 3.18Å; D91-K94 PolarHBondContact O-N 3.23Å; D91-M95 WeakPolarHBondContact O-CB 3.45Å; D91-M95 PolarHBondContact O-N 3.04Å; D91-Y220 HydrophobicContact CB-CD1 3.92Å; D91-Y220 HydrophobicContact CB-CG 4.08Å |
| 92 | A | 91 | Very high | 92.7 | Very high | 29 Ų | 29 | 58.2 Ų | 58.2 | 24% | 0.24 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -57.4 | -33.3 | 170.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | A82 L87 M88 P96 | A82-A92 HydrophobicContact CB-CB 4.21Å; L87-A92 HydrophobicContact CB-CB 4.04Å; M88-A92 WeakPolarHBondContact O-CB 3.4Å; M88-A92 PolarHBondContact O-N 2.94Å; A92-P96 WeakPolarHBondContact O-CD 3.22Å |
| 93 | A | 90.3 | Very high | 92.8 | Very high | 80 Ų | 80 | 61.7 Ų | 61.7 | 66% | 0.661 | 31% | 0.307 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.2 | -28.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.6 | P89 D91 | P89-A93 PolarHBondContact O-N 3.46Å; P89-A93 VanDerWaalsContact O-N 3.14Å; D91-A93 PolarHBondContact O-N 3.18Å |
| 94 | K | 90.5 | Very high | 93.1 | Very high | 96 Ų | 96 | 54.9 Ų | 54.9 | 42% | 0.417 | 28% | 0.275 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.6 | -28.4 | -175.7 | -64.2 | 175.5 | -174.4 | 176 | 0 | 113.3 | K90 D91 E97 S98 Y220 | K90-K94 WeakPolarHBondContact O-CG 3.23Å; D91-K94 PolarHBondContact O-N 3.23Å; K94-E97 PolarHBondContact O-N 3.29Å; K94-S98 PolarHBondContact O-N 3.5Å; K94-S98 PolarHBondContact O-OG 3.24Å; K94-Y220 HydrophobicContact CB-CE2 4.16Å |
| 95 | M | 93.3 | Very high | 93.3 | Very high | 9 Ų | 9 | 46 Ų | 46 | 4% | 0.044 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -55.5 | -41.6 | -176 | 179.6 | -101.3 | -164.5 | 0 | 0 | 113.6 | F78 L81 A82 L87 D91 E97 S98 A99 L217 Y220 | F78-M95 HydrophobicContact CB-SD 4.32Å; F78-M95 VanDerWaalsContact O-SD 3.37Å; L81-M95 HydrophobicContact CB-CE 4.07Å; L81-M95 HydrophobicContact CD2-CE 3.67Å; L81-M95 HydrophobicContact CG-CE 3.78Å; A82-M95 HydrophobicContact CB-SD 3.85Å; L87-M95 HydrophobicContact CD1-CB 4.12Å; L87-M95 HydrophobicContact CD1-CG 4.04Å; D91-M95 WeakPolarHBondContact O-CB 3.45Å; D91-M95 PolarHBondContact O-N 3.04Å; M95-E97 PolarHBondContact O-N 3.41Å; M95-S98 PolarHBondContact O-N 2.92Å; M95-A99 VanDerWaalsContact O-CB 3.32Å; M95-A99 WeakPolarHBondContact O-CB 2.73Å; M95-A99 PolarHBondContact O-N 3.25Å; M95-L217 HydrophobicContact CB-CD2 4.47Å; M95-L217 HydrophobicContact CG-CD2 3.7Å; M95-Y220 HydrophobicContact CB-CD2 3.95Å; M95-Y220 HydrophobicContact CB-CE2 4.47Å; M95-Y220 HydrophobicContact CG-CD2 4.42Å |
| 96 | P | 95.1 | Very high | 93.6 | Very high | 12 Ų | 12 | 48.2 Ų | 48.2 | 8% | 0.078 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -64.2 | -36.8 | 179.6 | -24 | 34.3 | 0 | 0 | 0 | 114.5 | T74 F78 K79 A92 W100 | T74-P96 HydrophobicContact CG2-CB 3.86Å; T74-P96 HydrophobicContact CG2-CG 4.48Å; F78-P96 HydrophobicContact CB-CB 3.85Å; F78-P96 HydrophobicContact CB-CG 4.17Å; F78-P96 HydrophobicContact CD2-CB 4.29Å; K79-P96 HydrophobicContact CG-CG 4.21Å; A92-P96 WeakPolarHBondContact O-CD 3.22Å; P96-W100 VanDerWaalsContact O-CB 3.32Å; P96-W100 WeakPolarHBondContact O-CB 3.42Å; P96-W100 PolarHBondContact O-N 3.13Å |
| 97 | E | 93.3 | Very high | 93.9 | Very high | 15 Ų | 15 | 43.1 Ų | 43.1 | 7% | 0.07 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -64.1 | -45.6 | 174.8 | -175.1 | -164.5 | 136 | 0 | 0 | 110.6 | K94 M95 W100 K101 R169 | K94-E97 PolarHBondContact O-N 3.29Å; M95-E97 PolarHBondContact O-N 3.41Å; E97-W100 PolarHBondContact O-N 2.9Å; E97-K101 HydrophobicContact CG-CD 4.39Å; E97-K101 WeakPolarHBondContact O-CG 3.04Å; E97-K101 PolarHBondContact O-N 3.09Å; E97-K101 VanDerWaalsContact O-N 3.14Å; E97-K101 IonicContact OE1-NZ 2.77Å; E97-K101 PolarHBondContact OE1-NZ 2.98Å; E97-R169 IonicContact OE1-CZ 2.68Å; E97-R169 IonicContact OE1-NH1 3.6Å; E97-R169 IonicContact OE1-NH2 2.72Å; E97-R169 PolarHBondContact OE1-NH2 3.04Å; E97-R169 IonicContact OE2-CZ 3.34Å; E97-R169 IonicContact OE2-NH2 2.91Å; E97-R169 PolarHBondContact OE2-NH2 3.18Å |
| 98 | S | 95.1 | Very high | 94.1 | Very high | 2 Ų | 2 | 42.7 Ų | 42.7 | 1% | 0.014 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -68.8 | -41.4 | -177.8 | -52.4 | 0 | 0 | 0 | 0 | 111.7 | K94 M95 K101 L102 E213 | K94-S98 PolarHBondContact O-N 3.5Å; K94-S98 PolarHBondContact O-OG 3.24Å; M95-S98 PolarHBondContact O-N 2.92Å; S98-K101 PolarHBondContact O-N 3.01Å; S98-L102 WeakPolarHBondContact O-CB 3.27Å; S98-L102 PolarHBondContact O-N 2.8Å; S98-E213 WeakPolarHBondContact CA-OE2 3.41Å; S98-E213 WeakPolarHBondContact CB-OE2 3.29Å; S98-E213 PolarHBondContact OG-OE2 2.78Å |
| 99 | A | 96.9 | Very high | 94.4 | Very high | 8 Ų | 8 | 41.4 Ų | 41.4 | 7% | 0.066 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -64.1 | -41.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | F78 M95 L102 V103 L217 | F78-A99 HydrophobicContact CD1-CB 3.65Å; F78-A99 HydrophobicContact CD2-CB 4.16Å; F78-A99 HydrophobicContact CE1-CB 3.71Å; F78-A99 HydrophobicContact CE2-CB 4.22Å; F78-A99 HydrophobicContact CG-CB 3.9Å; F78-A99 HydrophobicContact CZ-CB 4Å; M95-A99 VanDerWaalsContact O-CB 3.32Å; M95-A99 WeakPolarHBondContact O-CB 2.73Å; M95-A99 PolarHBondContact O-N 3.25Å; A99-L102 PolarHBondContact O-N 2.96Å; A99-V103 WeakPolarHBondContact O-CG2 3.42Å; A99-V103 PolarHBondContact O-N 2.86Å; A99-L217 HydrophobicContact CB-CD1 4.33Å; A99-L217 HydrophobicContact CB-CD2 4.26Å |
| 100 | W | 96.9 | Very high | 94.8 | Very high | 4 Ų | 4 | 39 Ų | 39 | 2% | 0.015 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -59.2 | -49.3 | 175.4 | 171.7 | -111.2 | 0 | 0 | 0 | 112.1 | W66 I69 R70 L73 F78 P96 E97 V103 F104 F154 H157 | W66-W100 HydrophobicContact CB-CZ2 4.47Å; W66-W100 AromaticContact CE3-CH2 3.71Å; W66-W100 HydrophobicContact CE3-CH2 3.71Å; W66-W100 HydrophobicContact CE3-CZ2 4.06Å; W66-W100 HydrophobicContact CZ3-CH2 4.2Å; I69-W100 HydrophobicContact CB-CH2 4.11Å; I69-W100 HydrophobicContact CB-CZ3 4.47Å; I69-W100 HydrophobicContact CG2-CH2 3.74Å; I69-W100 HydrophobicContact CG2-CZ3 3.69Å; R70-W100 HydrophobicContact CB-CD2 3.79Å; R70-W100 HydrophobicContact CB-CE3 4.16Å; R70-W100 HydrophobicContact CB-CG 4.34Å; R70-W100 HydrophobicContact CB-CH2 4.07Å; R70-W100 HydrophobicContact CB-CZ2 3.72Å; R70-W100 HydrophobicContact CB-CZ3 4.32Å; R70-W100 HydrophobicContact CG-CB 4.45Å; R70-W100 HydrophobicContact CG-CD2 3.72Å; R70-W100 HydrophobicContact CG-CE3 4.37Å; R70-W100 HydrophobicContact CG-CG 3.73Å; R70-W100 HydrophobicContact CG-CZ2 4.44Å; L73-W100 HydrophobicContact CD1-CE3 3.94Å; L73-W100 HydrophobicContact CD1-CZ3 3.64Å; F78-W100 HydrophobicContact CE2-CB 3.94Å; F78-W100 HydrophobicContact CE2-CE3 4.47Å; P96-W100 VanDerWaalsContact O-CB 3.32Å; P96-W100 WeakPolarHBondContact O-CB 3.42Å; P96-W100 PolarHBondContact O-N 3.13Å; E97-W100 PolarHBondContact O-N 2.9Å; W100-V103 PolarHBondContact O-N 3.44Å; W100-F104 PolarHBondContact O-N 3.14Å; W100-F104 VanDerWaalsContact O-N 3.15Å; W100-F154 AromaticContact CE2-CE2 3.86Å; W100-F154 HydrophobicContact CZ2-CD2 4.38Å; W100-F154 AromaticContact CZ2-CE2 3.92Å; W100-F154 HydrophobicContact CZ2-CE2 3.92Å; W100-F154 AromaticContact NE1-CE2 3.46Å; W100-F154 AromaticContact NE1-CZ 3.99Å; W100-H157 AromaticContact NE1-CE1 3.46Å; W100-H157 PolarHBondContact NE1-CE1 3.08Å |
| 101 | K | 96.1 | Very high | 95.2 | Very high | 35 Ų | 35 | 36.2 Ų | 36.2 | 15% | 0.152 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -62.8 | -44.1 | 178.2 | -72.6 | 174.3 | 177.6 | 171.9 | 0 | 111.1 | E97 S98 V103 F104 Y105 E213 | E97-K101 HydrophobicContact CG-CD 4.39Å; E97-K101 WeakPolarHBondContact O-CG 3.04Å; E97-K101 PolarHBondContact O-N 3.09Å; E97-K101 VanDerWaalsContact O-N 3.14Å; E97-K101 IonicContact OE1-NZ 2.77Å; E97-K101 PolarHBondContact OE1-NZ 2.98Å; S98-K101 PolarHBondContact O-N 3.01Å; K101-V103 PolarHBondContact O-N 3.38Å; K101-F104 PolarHBondContact O-N 3.23Å; K101-Y105 HydrophobicContact CB-CD2 4.02Å; K101-Y105 HydrophobicContact CB-CE2 3.92Å; K101-Y105 HydrophobicContact CG-CE2 4.24Å; K101-Y105 WeakPolarHBondContact O-CD2 3.42Å; K101-Y105 PolarHBondContact O-N 2.95Å; K101-E213 HydrophobicContact CB-CG 3.73Å |
| 102 | L | 97.6 | Very high | 95.4 | Very high | 28 Ų | 28 | 35.3 Ų | 35.3 | 15% | 0.147 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -57.6 | -47.6 | 177.3 | -179.4 | 61.4 | 0 | 0 | 0 | 112.1 | S98 A99 F104 T106 V210 E213 F214 L217 | S98-L102 WeakPolarHBondContact O-CB 3.27Å; S98-L102 PolarHBondContact O-N 2.8Å; A99-L102 PolarHBondContact O-N 2.96Å; L102-F104 VanDerWaalsContact C-N 3.35Å; L102-F104 PolarHBondContact O-N 2.76Å; L102-T106 WeakPolarHBondContact O-CB 3.49Å; L102-T106 PolarHBondContact O-N 3.29Å; L102-T106 PolarHBondContact O-OG1 3.21Å; L102-V210 HydrophobicContact CD1-CG1 3.97Å; L102-V210 WeakPolarHBondContact CD1-O 3.32Å; L102-E213 HydrophobicContact CB-CB 3.87Å; L102-E213 HydrophobicContact CD1-CB 4.4Å; L102-F214 HydrophobicContact CD1-CB 4.01Å; L102-F214 HydrophobicContact CD2-CB 4.39Å; L102-F214 HydrophobicContact CD2-CD2 4.42Å; L102-L217 HydrophobicContact CB-CD1 4.45Å; L102-L217 HydrophobicContact CD2-CD1 3.48Å; L102-L217 VanDerWaalsContact CD2-CD1 3.48Å |
| 103 | V | 97.3 | Very high | 95.6 | Very high | 75 Ų | 75 | 35.1 Ų | 35.1 | 46% | 0.455 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -58.8 | -48.3 | 178.8 | 169 | 0 | 0 | 0 | 0 | 110.6 | F78 A99 W100 K101 M107 | F78-V103 HydrophobicContact CZ-CG2 4.32Å; A99-V103 WeakPolarHBondContact O-CG2 3.42Å; A99-V103 PolarHBondContact O-N 2.86Å; W100-V103 PolarHBondContact O-N 3.44Å; K101-V103 PolarHBondContact O-N 3.38Å; V103-M107 WeakPolarHBondContact O-CB 3.45Å; V103-M107 PolarHBondContact O-N 3.19Å; V103-M107 VanDerWaalsContact O-N 3.15Å |
| 104 | F | 97.6 | Very high | 95.8 | Very high | 3 Ų | 3 | 37.2 Ų | 37.2 | 1% | 0.013 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -64.3 | -53.9 | -179 | 177.8 | -92.8 | 0 | 0 | 0 | 112.5 | W66 W100 K101 L102 T106 M107 S108 I150 Q151 F154 | W66-F104 HydrophobicContact CH2-CD2 4.36Å; W66-F104 HydrophobicContact CH2-CE2 4.38Å; W66-F104 HydrophobicContact CZ2-CD2 4.49Å; W66-F104 HydrophobicContact CZ2-CE2 4.11Å; W100-F104 PolarHBondContact O-N 3.14Å; W100-F104 VanDerWaalsContact O-N 3.15Å; K101-F104 PolarHBondContact O-N 3.23Å; L102-F104 VanDerWaalsContact C-N 3.35Å; L102-F104 PolarHBondContact O-N 2.76Å; F104-T106 VanDerWaalsContact C-N 3.28Å; F104-T106 PolarHBondContact O-N 3.45Å; F104-M107 HydrophobicContact CD2-CE 3.96Å; F104-M107 HydrophobicContact CE2-CE 4.06Å; F104-M107 WeakPolarHBondContact O-CB 3.29Å; F104-M107 PolarHBondContact O-N 2.89Å; F104-S108 PolarHBondContact O-N 3.48Å; F104-I150 HydrophobicContact CE2-CG2 3.86Å; F104-I150 HydrophobicContact CZ-CG2 4.18Å; F104-Q151 VanDerWaalsContact CZ-OE1 3.3Å; F104-F154 HydrophobicContact CB-CD2 4.21Å; F104-F154 HydrophobicContact CB-CE2 3.59Å; F104-F154 HydrophobicContact CB-CZ 3.79Å; F104-F154 AromaticContact CD1-CD1 3.41Å; F104-F154 HydrophobicContact CD1-CD1 3.41Å; F104-F154 VanDerWaalsContact CD1-CD1 3.41Å; F104-F154 AromaticContact CD1-CD2 3.78Å; F104-F154 HydrophobicContact CD1-CD2 3.78Å; F104-F154 AromaticContact CD1-CE1 3.3Å; F104-F154 HydrophobicContact CD1-CE1 3.3Å; F104-F154 AromaticContact CD1-CE2 3.66Å; F104-F154 HydrophobicContact CD1-CE2 3.66Å; F104-F154 AromaticContact CD1-CG 3.65Å; F104-F154 HydrophobicContact CD1-CG 3.65Å; F104-F154 AromaticContact CD1-CZ 3.42Å; F104-F154 HydrophobicContact CD1-CZ 3.42Å; F104-F154 VanDerWaalsContact CD1-CZ 3.42Å; F104-F154 HydrophobicContact CD2-CB 4.12Å; F104-F154 HydrophobicContact CD2-CD1 4.29Å; F104-F154 AromaticContact CD2-CD2 3.24Å; F104-F154 HydrophobicContact CD2-CD2 3.24Å; F104-F154 AromaticContact CD2-CE2 3.56Å; F104-F154 HydrophobicContact CD2-CE2 3.56Å; F104-F154 AromaticContact CD2-CG 3.63Å; F104-F154 HydrophobicContact CD2-CG 3.63Å; F104-F154 HydrophobicContact CD2-CZ 4.23Å; F104-F154 HydrophobicContact CE1-CB 3.86Å; F104-F154 AromaticContact CE1-CD1 3.16Å; F104-F154 HydrophobicContact CE1-CD1 3.16Å; F104-F154 AromaticContact CE1-CD2 3.97Å; F104-F154 HydrophobicContact CE1-CD2 3.97Å; F104-F154 AromaticContact CE1-CE1 3.56Å; F104-F154 HydrophobicContact CE1-CE1 3.56Å; F104-F154 HydrophobicContact CE1-CE2 4.28Å; F104-F154 AromaticContact CE1-CG 3.38Å; F104-F154 HydrophobicContact CE1-CG 3.38Å; F104-F154 HydrophobicContact CE1-CZ 4.1Å; F104-F154 HydrophobicContact CE2-CB 3.35Å; F104-F154 HydrophobicContact CE2-CD1 4.07Å; F104-F154 AromaticContact CE2-CD2 3.44Å; F104-F154 HydrophobicContact CE2-CD2 3.44Å; F104-F154 VanDerWaalsContact CE2-CD2 3.44Å; F104-F154 HydrophobicContact CE2-CE2 4.19Å; F104-F154 AromaticContact CE2-CG 3.34Å; F104-F154 HydrophobicContact CE2-CG 3.34Å; F104-F154 AromaticContact CG-CD1 3.99Å; F104-F154 HydrophobicContact CG-CD1 3.99Å; F104-F154 AromaticContact CG-CD2 3.43Å; F104-F154 HydrophobicContact CG-CD2 3.43Å; F104-F154 VanDerWaalsContact CG-CD2 3.43Å; F104-F154 AromaticContact CG-CE1 3.87Å; F104-F154 HydrophobicContact CG-CE1 3.87Å; F104-F154 AromaticContact CG-CE2 3.26Å; F104-F154 HydrophobicContact CG-CE2 3.26Å; F104-F154 AromaticContact CG-CG 3.78Å; F104-F154 HydrophobicContact CG-CG 3.78Å; F104-F154 AromaticContact CG-CZ 3.5Å; F104-F154 HydrophobicContact CG-CZ 3.5Å; F104-F154 HydrophobicContact CZ-CB 3.21Å; F104-F154 AromaticContact CZ-CD1 3.53Å; F104-F154 HydrophobicContact CZ-CD1 3.53Å; F104-F154 AromaticContact CZ-CD2 3.81Å; F104-F154 HydrophobicContact CZ-CD2 3.81Å; F104-F154 HydrophobicContact CZ-CE1 4.3Å; F104-F154 AromaticContact CZ-CG 3.23Å; F104-F154 HydrophobicContact CZ-CG 3.23Å |
| 105 | Y | 97.5 | Very high | 95.9 | Very high | 11 Ų | 11 | 32.6 Ų | 32.6 | 4% | 0.043 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -65.6 | -33.1 | -176.5 | -69.6 | -60.9 | 0 | 0 | 0 | 111.8 | K101 S108 W109 F154 D206 D209 V210 | K101-Y105 HydrophobicContact CB-CD2 4.02Å; K101-Y105 HydrophobicContact CB-CE2 3.92Å; K101-Y105 HydrophobicContact CG-CE2 4.24Å; K101-Y105 WeakPolarHBondContact O-CD2 3.42Å; K101-Y105 PolarHBondContact O-N 2.95Å; Y105-S108 PolarHBondContact O-N 3.43Å; Y105-W109 WeakPolarHBondContact O-CB 3.41Å; Y105-W109 PolarHBondContact O-N 3.34Å; Y105-F154 HydrophobicContact CE1-CE1 4.4Å; Y105-D206 HydrophobicContact CD1-CB 4.32Å; Y105-D209 HydrophobicContact CD1-CB 4.02Å; Y105-D209 HydrophobicContact CD2-CB 3.49Å; Y105-D209 VanDerWaalsContact CD2-CB 3.49Å; Y105-D209 HydrophobicContact CE1-CB 4.17Å; Y105-D209 HydrophobicContact CE2-CB 3.69Å; Y105-D209 HydrophobicContact CG-CB 3.68Å; Y105-V210 VanDerWaalsContact C-CG2 3.44Å; Y105-V210 WeakPolarHBondContact O-CG2 3.49Å |
| 106 | T | 97.9 | Very high | 95.7 | Very high | 55 Ų | 55 | 32.4 Ų | 32.4 | 34% | 0.337 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -64.2 | -45.6 | 175 | -57.1 | 0 | 0 | 0 | 0 | 110.5 | L102 F104 S110 | L102-T106 WeakPolarHBondContact O-CB 3.49Å; L102-T106 PolarHBondContact O-N 3.29Å; L102-T106 PolarHBondContact O-OG1 3.21Å; F104-T106 VanDerWaalsContact C-N 3.28Å; F104-T106 PolarHBondContact O-N 3.45Å; T106-S110 VanDerWaalsContact O-CB 3.24Å; T106-S110 WeakPolarHBondContact O-CB 3.42Å; T106-S110 PolarHBondContact O-N 3.29Å; T106-S110 PolarHBondContact O-OG 3.37Å |
| 107 | M | 97.3 | Very high | 95.4 | Very high | 86 Ų | 86 | 36.3 Ų | 36.3 | 42% | 0.424 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -62.9 | -48.9 | 177.3 | 179.4 | -165.2 | 68.2 | 0 | 0 | 111 | W66 V103 F104 S110 Y111 I150 | W66-M107 HydrophobicContact CH2-CE 3.93Å; V103-M107 WeakPolarHBondContact O-CB 3.45Å; V103-M107 PolarHBondContact O-N 3.19Å; V103-M107 VanDerWaalsContact O-N 3.15Å; F104-M107 HydrophobicContact CD2-CE 3.96Å; F104-M107 HydrophobicContact CE2-CE 4.06Å; F104-M107 WeakPolarHBondContact O-CB 3.29Å; F104-M107 PolarHBondContact O-N 2.89Å; M107-S110 PolarHBondContact O-N 3.11Å; M107-Y111 PolarHBondContact O-N 3.48Å; M107-I150 HydrophobicContact CE-CG2 4.03Å |
| 108 | S | 95.9 | Very high | 95.1 | Very high | 7 Ų | 7 | 42.8 Ų | 42.8 | 5% | 0.049 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -66.6 | -44.9 | -176.8 | -170.7 | 0 | 0 | 0 | 0 | 112.7 | F104 Y105 S110 Y111 S112 Q151 D206 | F104-S108 PolarHBondContact O-N 3.48Å; Y105-S108 PolarHBondContact O-N 3.43Å; S108-S110 VanDerWaalsContact C-N 3.35Å; S108-S110 PolarHBondContact O-N 3.13Å; S108-Y111 PolarHBondContact O-N 3.24Å; S108-S112 PolarHBondContact O-N 3.39Å; S108-S112 PolarHBondContact O-OG 2.68Å; S108-S112 VanDerWaalsContact O-OG 3.08Å; S108-Q151 PolarHBondContact OG-OE1 3.03Å; S108-D206 PolarHBondContact OG-OD2 3.4Å |
| 109 | W | 96.9 | Very high | 94.5 | Very high | 62 Ų | 62 | 44.4 Ų | 44.4 | 24% | 0.235 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -64.4 | -40.1 | 176.7 | -176.5 | 75 | 0 | 0 | 0 | 111.9 | Y105 Y111 S112 T113 F203 D206 I207 V210 | Y105-W109 WeakPolarHBondContact O-CB 3.41Å; Y105-W109 PolarHBondContact O-N 3.34Å; W109-Y111 VanDerWaalsContact C-N 3.32Å; W109-Y111 PolarHBondContact O-N 3.45Å; W109-S112 PolarHBondContact O-N 3.01Å; W109-T113 WeakPolarHBondContact O-CB 3.4Å; W109-T113 PolarHBondContact O-N 3.38Å; W109-T113 PolarHBondContact O-OG1 3.17Å; W109-F203 AromaticContact CD1-CD2 3.91Å; W109-F203 AromaticContact CE2-CE2 3.68Å; W109-F203 AromaticContact CZ2-CE2 3.81Å; W109-F203 HydrophobicContact CZ2-CE2 3.81Å; W109-F203 HydrophobicContact CZ2-CZ 4.33Å; W109-F203 AromaticContact NE1-CD2 3.35Å; W109-F203 VanDerWaalsContact NE1-CD2 3.35Å; W109-F203 AromaticContact NE1-CE2 3.25Å; W109-F203 PolarHBondContact NE1-O 2.88Å; W109-D206 HydrophobicContact CB-CB 4.01Å; W109-I207 HydrophobicContact CD2-CB 4.39Å; W109-I207 HydrophobicContact CD2-CD1 3.8Å; W109-I207 HydrophobicContact CE3-CD1 4.06Å; W109-I207 HydrophobicContact CG-CB 4.32Å; W109-I207 HydrophobicContact CG-CD1 4.44Å; W109-I207 HydrophobicContact CH2-CD1 3.88Å; W109-I207 HydrophobicContact CZ2-CB 4.42Å; W109-I207 HydrophobicContact CZ2-CD1 3.63Å; W109-I207 HydrophobicContact CZ2-CG1 4.09Å; W109-I207 HydrophobicContact CZ3-CD1 4.1Å; W109-V210 HydrophobicContact CB-CG2 4.35Å |
| 110 | S | 97.1 | Very high | 93.6 | Very high | 60 Ų | 60 | 50.3 Ų | 50.3 | 42% | 0.42 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -61.9 | -40.9 | 174.9 | -59.7 | 0 | 0 | 0 | 0 | 111.6 | T106 M107 S108 T113 Y114 | T106-S110 VanDerWaalsContact O-CB 3.24Å; T106-S110 WeakPolarHBondContact O-CB 3.42Å; T106-S110 PolarHBondContact O-N 3.29Å; T106-S110 PolarHBondContact O-OG 3.37Å; M107-S110 PolarHBondContact O-N 3.11Å; S108-S110 VanDerWaalsContact C-N 3.35Å; S108-S110 PolarHBondContact O-N 3.13Å; S110-T113 WeakPolarHBondContact O-CB 3.43Å; S110-T113 PolarHBondContact O-N 2.98Å; S110-Y114 PolarHBondContact O-N 3.5Å |
| 111 | Y | 96.1 | Very high | 92.9 | Very high | 64 Ų | 64 | 52.6 Ų | 52.6 | 25% | 0.251 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -66.5 | -43.9 | 176.8 | -170.3 | -122.2 | 0 | 0 | 0 | 111.9 | M107 S108 W109 T113 Y114 L115 D143 I146 A147 | M107-Y111 PolarHBondContact O-N 3.48Å; S108-Y111 PolarHBondContact O-N 3.24Å; W109-Y111 VanDerWaalsContact C-N 3.32Å; W109-Y111 PolarHBondContact O-N 3.45Å; Y111-T113 VanDerWaalsContact C-N 3.31Å; Y111-T113 PolarHBondContact O-N 2.86Å; Y111-Y114 HydrophobicContact CD2-CD1 4.41Å; Y111-Y114 HydrophobicContact CE2-CD1 4.31Å; Y111-Y114 WeakPolarHBondContact O-CB 3.42Å; Y111-Y114 PolarHBondContact O-N 2.82Å; Y111-Y114 VanDerWaalsContact O-N 3.16Å; Y111-L115 HydrophobicContact CD1-CD1 4.31Å; Y111-L115 HydrophobicContact CE1-CD1 4.06Å; Y111-L115 WeakPolarHBondContact O-CG 3.49Å; Y111-L115 PolarHBondContact O-N 3.12Å; Y111-D143 WeakPolarHBondContact OH-CA 3.31Å; Y111-D143 PolarHBondContact OH-O 3.14Å; Y111-I146 HydrophobicContact CE1-CB 4.47Å; Y111-I146 HydrophobicContact CE1-CG2 4.12Å; Y111-A147 HydrophobicContact CD1-CB 3.86Å; Y111-A147 HydrophobicContact CE1-CB 3.68Å |
| 112 | S | 94.5 | Very high | 92.1 | Very high | 1 Ų | 1 | 54 Ų | 54 | 1% | 0.007 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -61.8 | -39.2 | 175 | -58.8 | 0 | 0 | 0 | 0 | 112 | S108 W109 L115 L116 | S108-S112 PolarHBondContact O-N 3.39Å; S108-S112 PolarHBondContact O-OG 2.68Å; S108-S112 VanDerWaalsContact O-OG 3.08Å; W109-S112 PolarHBondContact O-N 3.01Å; S112-L115 PolarHBondContact O-N 3.33Å; S112-L116 WeakPolarHBondContact O-CG 3.28Å; S112-L116 PolarHBondContact O-N 2.96Å |
| 113 | T | 94.4 | Very high | 91.3 | Very high | 24 Ų | 24 | 53 Ų | 53 | 15% | 0.147 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -62.7 | -43.6 | 173.9 | -56.5 | 0 | 0 | 0 | 0 | 111.2 | W109 S110 Y111 L115 L116 F117 F203 | W109-T113 WeakPolarHBondContact O-CB 3.4Å; W109-T113 PolarHBondContact O-N 3.38Å; W109-T113 PolarHBondContact O-OG1 3.17Å; S110-T113 WeakPolarHBondContact O-CB 3.43Å; S110-T113 PolarHBondContact O-N 2.98Å; Y111-T113 VanDerWaalsContact C-N 3.31Å; Y111-T113 PolarHBondContact O-N 2.86Å; T113-L115 VanDerWaalsContact C-N 3.34Å; T113-L115 PolarHBondContact O-N 2.96Å; T113-L116 PolarHBondContact O-N 3.28Å; T113-F117 HydrophobicContact CG2-CD2 3.75Å; T113-F117 HydrophobicContact CG2-CE2 4.31Å; T113-F117 WeakPolarHBondContact O-CD2 3.37Å; T113-F117 PolarHBondContact O-N 3.3Å; T113-F203 WeakPolarHBondContact OG1-CE2 3.35Å |
| 114 | Y | 94.2 | Very high | 90.5 | Very high | 124 Ų | 124 | 50.2 Ų | 50.2 | 49% | 0.486 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -57.8 | -45.7 | 174.8 | 170.9 | -99.5 | 0 | 0 | 0 | 112 | S110 Y111 F118 S119 | S110-Y114 PolarHBondContact O-N 3.5Å; Y111-Y114 HydrophobicContact CD2-CD1 4.41Å; Y111-Y114 HydrophobicContact CE2-CD1 4.31Å; Y111-Y114 WeakPolarHBondContact O-CB 3.42Å; Y111-Y114 PolarHBondContact O-N 2.82Å; Y111-Y114 VanDerWaalsContact O-N 3.16Å; Y114-F118 HydrophobicContact CD2-CB 3.73Å; Y114-F118 HydrophobicContact CD2-CG 4.39Å; Y114-F118 HydrophobicContact CE2-CB 3.99Å; Y114-F118 CarbonylContact O-C 3.55Å; Y114-F118 WeakPolarHBondContact O-CA 3.23Å; Y114-F118 WeakPolarHBondContact O-CB 3.38Å; Y114-F118 PolarHBondContact O-N 2.72Å; Y114-S119 PolarHBondContact O-N 3.39Å; Y114-S119 PolarHBondContact O-OG 3.01Å |
| 115 | L | 92 | Very high | 89.7 | Confident | 0 Ų | 0 | 54.7 Ų | 54.7 | 0% | 0 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -61.8 | -46.7 | 176.6 | -63.8 | 177 | 0 | 0 | 0 | 111.6 | Y111 S112 T113 S119 Y121 D143 A147 I199 | Y111-L115 HydrophobicContact CD1-CD1 4.31Å; Y111-L115 HydrophobicContact CE1-CD1 4.06Å; Y111-L115 WeakPolarHBondContact O-CG 3.49Å; Y111-L115 PolarHBondContact O-N 3.12Å; S112-L115 PolarHBondContact O-N 3.33Å; T113-L115 VanDerWaalsContact C-N 3.34Å; T113-L115 PolarHBondContact O-N 2.96Å; L115-S119 VanDerWaalsContact O-CB 3.28Å; L115-S119 WeakPolarHBondContact O-CB 3.3Å; L115-Y121 HydrophobicContact CD2-CE2 4.47Å; L115-Y121 WeakPolarHBondContact O-CD2 3.48Å; L115-D143 HydrophobicContact CD2-CB 3.82Å; L115-D143 WeakPolarHBondContact CD2-OD2 3.32Å; L115-A147 HydrophobicContact CD1-CB 4.08Å; L115-I199 HydrophobicContact CD1-CD1 4.12Å |
| 116 | L | 89.4 | Confident | 88.8 | Confident | 4 Ų | 4 | 54.5 Ų | 54.5 | 2% | 0.021 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -73.9 | -33.9 | -173.4 | -70.9 | 179.4 | 0 | 0 | 0 | 115 | S112 T113 F123 F124 I199 F203 | S112-L116 WeakPolarHBondContact O-CG 3.28Å; S112-L116 PolarHBondContact O-N 2.96Å; T113-L116 PolarHBondContact O-N 3.28Å; L116-F123 HydrophobicContact CD2-CD2 3.77Å; L116-F123 HydrophobicContact CD2-CE2 3.16Å; L116-F123 HydrophobicContact CD2-CZ 3.79Å; L116-F124 HydrophobicContact CD1-CD2 4.12Å; L116-F124 HydrophobicContact CD2-CB 4.23Å; L116-I199 HydrophobicContact CD2-CG2 3.95Å; L116-I199 HydrophobicContact CG-CG2 4.15Å; L116-F203 HydrophobicContact CD1-CB 3.47Å; L116-F203 VanDerWaalsContact CD1-CB 3.47Å; L116-F203 HydrophobicContact CD1-CD1 3.59Å; L116-F203 HydrophobicContact CD1-CD2 3.8Å; L116-F203 HydrophobicContact CD1-CE1 4.28Å; L116-F203 HydrophobicContact CD1-CE2 4.44Å; L116-F203 HydrophobicContact CD1-CG 3.31Å |
| 117 | F | 89.6 | Confident | 87.7 | Confident | 94 Ų | 94 | 52.4 Ų | 52.4 | 41% | 0.412 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -115.1 | -18.9 | -170.2 | -63.1 | -75.9 | 0 | 0 | 0 | 114.2 | T113 F124 F203 | T113-F117 HydrophobicContact CG2-CD2 3.75Å; T113-F117 HydrophobicContact CG2-CE2 4.31Å; T113-F117 WeakPolarHBondContact O-CD2 3.37Å; T113-F117 PolarHBondContact O-N 3.3Å; F117-F124 AromaticContact CE1-CD1 3.67Å; F117-F124 HydrophobicContact CE1-CD1 3.67Å; F117-F124 AromaticContact CE1-CE1 3.9Å; F117-F124 HydrophobicContact CE1-CE1 3.9Å; F117-F124 HydrophobicContact CE1-CG 4.27Å; F117-F124 AromaticContact CZ-CD1 3.69Å; F117-F124 HydrophobicContact CZ-CD1 3.69Å; F117-F124 HydrophobicContact CZ-CD2 4.31Å; F117-F124 AromaticContact CZ-CE1 3.69Å; F117-F124 HydrophobicContact CZ-CE1 3.69Å; F117-F124 HydrophobicContact CZ-CE2 4.34Å; F117-F124 HydrophobicContact CZ-CG 4.01Å; F117-F124 HydrophobicContact CZ-CZ 4.03Å; F117-F203 HydrophobicContact CE2-CE1 4.34Å; F117-F203 AromaticContact CE2-CE2 3.91Å; F117-F203 HydrophobicContact CE2-CE2 3.91Å; F117-F203 AromaticContact CE2-CZ 3.68Å; F117-F203 HydrophobicContact CE2-CZ 3.68Å; F117-F203 HydrophobicContact CZ-CZ 4.17Å |
| 118 | F | 85.9 | Confident | 86.7 | Confident | 152 Ų | 152 | 48.7 Ų | 48.7 | 67% | 0.667 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -118.7 | 0.8 | -175.4 | -60.7 | -89.4 | 0 | 0 | 0 | 113.2 | Y114 | Y114-F118 HydrophobicContact CD2-CB 3.73Å; Y114-F118 HydrophobicContact CD2-CG 4.39Å; Y114-F118 HydrophobicContact CE2-CB 3.99Å; Y114-F118 CarbonylContact O-C 3.55Å; Y114-F118 WeakPolarHBondContact O-CA 3.23Å; Y114-F118 WeakPolarHBondContact O-CB 3.38Å; Y114-F118 PolarHBondContact O-N 2.72Å |
| 119 | S | 83.1 | Confident | 85.8 | Confident | 35 Ų | 35 | 49 Ų | 49 | 25% | 0.245 | 26% | 0.255 | C | S | . | . | S | Bend | trans | -113.8 | 174.6 | 171.8 | -49.3 | 0 | 0 | 0 | 0 | 110.6 | Y114 L115 Y121 | Y114-S119 PolarHBondContact O-N 3.39Å; Y114-S119 PolarHBondContact O-OG 3.01Å; L115-S119 VanDerWaalsContact O-CB 3.28Å; L115-S119 WeakPolarHBondContact O-CB 3.3Å; S119-Y121 PolarHBondContact O-N 3.2Å |
| 120 | S | 78.5 | Confident | 85 | Confident | 133 Ų | 133 | 46.3 Ų | 46.3 | 93% | 0.93 | 25% | 0.246 | S | C | * | . | S | Bend | trans | -75.6 | 18.2 | -175 | -52.7 | 0 | 0 | 0 | 0 | 115.1 | ||
| 121 | Y | 82.5 | Confident | 84.2 | Confident | 51 Ų | 51 | 43.8 Ų | 43.8 | 20% | 0.2 | 23% | 0.227 | C | C | . | . | trans | -89.5 | 124 | -176.6 | -62.3 | -60.1 | 0 | 0 | 0 | 111.6 | L115 S119 F123 P141 D143 I144 | L115-Y121 HydrophobicContact CD2-CE2 4.47Å; L115-Y121 WeakPolarHBondContact O-CD2 3.48Å; S119-Y121 PolarHBondContact O-N 3.2Å; Y121-F123 VanDerWaalsContact CB-CE1 3.42Å; Y121-F123 HydrophobicContact CD1-CD1 4.27Å; Y121-F123 AromaticContact CD1-CE1 3.61Å; Y121-F123 HydrophobicContact CD1-CE1 3.61Å; Y121-F123 HydrophobicContact CD2-CE1 4.38Å; Y121-F123 HydrophobicContact CE1-CE1 4.5Å; Y121-F123 HydrophobicContact CG-CD1 4.3Å; Y121-F123 AromaticContact CG-CE1 3.55Å; Y121-F123 HydrophobicContact CG-CE1 3.55Å; Y121-F123 HydrophobicContact CG-CZ 4.18Å; Y121-P141 VanDerWaalsContact OH-CB 3.28Å; Y121-P141 WeakPolarHBondContact OH-CB 3.43Å; Y121-D143 VanDerWaalsContact CE2-OD2 3.27Å; Y121-D143 WeakPolarHBondContact CE2-OD2 3.46Å; Y121-D143 PolarHBondContact OH-OD1 2.97Å; Y121-D143 PolarHBondContact OH-OD2 3.12Å; Y121-I144 HydrophobicContact CE1-CD1 3.93Å; Y121-I144 HydrophobicContact CE2-CD1 4.13Å; Y121-I144 HydrophobicContact CE2-CG1 4.31Å | ||
| 122 | S | 79.1 | Confident | 83.4 | Confident | 66 Ų | 66 | 45.9 Ų | 45.9 | 46% | 0.462 | 24% | 0.235 | S | C | . | . | trans | -94.4 | -7.6 | -177.9 | 55.5 | 0 | 0 | 0 | 0 | 114.4 | F124 N125 D126 | S122-F124 PolarHBondContact O-N 3.38Å; S122-F124 VanDerWaalsContact O-N 3.09Å; S122-N125 PolarHBondContact O-N 2.81Å; S122-D126 PolarHBondContact O-N 3.12Å | ||
| 123 | F | 80.4 | Confident | 82.5 | Confident | 5 Ų | 5 | 52.6 Ų | 52.6 | 2% | 0.022 | 27% | 0.271 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -71.9 | -8.3 | -163.6 | 56.3 | -107.1 | 0 | 0 | 0 | 116 | L116 Y121 S129 V130 N196 I199 | L116-F123 HydrophobicContact CD2-CD2 3.77Å; L116-F123 HydrophobicContact CD2-CE2 3.16Å; L116-F123 HydrophobicContact CD2-CZ 3.79Å; Y121-F123 VanDerWaalsContact CB-CE1 3.42Å; Y121-F123 HydrophobicContact CD1-CD1 4.27Å; Y121-F123 AromaticContact CD1-CE1 3.61Å; Y121-F123 HydrophobicContact CD1-CE1 3.61Å; Y121-F123 HydrophobicContact CD2-CE1 4.38Å; Y121-F123 HydrophobicContact CE1-CE1 4.5Å; Y121-F123 HydrophobicContact CG-CD1 4.3Å; Y121-F123 AromaticContact CG-CE1 3.55Å; Y121-F123 HydrophobicContact CG-CE1 3.55Å; Y121-F123 HydrophobicContact CG-CZ 4.18Å; F123-S129 VanDerWaalsContact CA-OG 3.26Å; F123-S129 WeakPolarHBondContact CA-OG 3.26Å; F123-S129 WeakPolarHBondContact CB-OG 3.23Å; F123-V130 HydrophobicContact CB-CG1 3.6Å; F123-V130 HydrophobicContact CD2-CG1 4.26Å; F123-V130 HydrophobicContact CG-CG1 4.13Å; F123-N196 HydrophobicContact CD1-CB 3.99Å; F123-N196 HydrophobicContact CE1-CB 3.98Å; F123-N196 WeakPolarHBondContact CE2-O 3.18Å; F123-N196 HydrophobicContact CG-CB 4.31Å; F123-N196 HydrophobicContact CZ-CB 4.3Å; F123-I199 HydrophobicContact CE2-CB 4.14Å; F123-I199 HydrophobicContact CE2-CG2 4.07Å; F123-I199 HydrophobicContact CZ-CB 4.17Å; F123-I199 HydrophobicContact CZ-CG2 4.13Å |
| 124 | F | 80.7 | Confident | 82 | Confident | 17 Ų | 17 | 53.9 Ų | 53.9 | 8% | 0.075 | 27% | 0.273 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -73.4 | -40.9 | 165.2 | -174.2 | -95.9 | 0 | 0 | 0 | 112 | L116 F117 S122 L200 F203 L204 W254 K258 | L116-F124 HydrophobicContact CD1-CD2 4.12Å; L116-F124 HydrophobicContact CD2-CB 4.23Å; F117-F124 AromaticContact CE1-CD1 3.67Å; F117-F124 HydrophobicContact CE1-CD1 3.67Å; F117-F124 AromaticContact CE1-CE1 3.9Å; F117-F124 HydrophobicContact CE1-CE1 3.9Å; F117-F124 HydrophobicContact CE1-CG 4.27Å; F117-F124 AromaticContact CZ-CD1 3.69Å; F117-F124 HydrophobicContact CZ-CD1 3.69Å; F117-F124 HydrophobicContact CZ-CD2 4.31Å; F117-F124 AromaticContact CZ-CE1 3.69Å; F117-F124 HydrophobicContact CZ-CE1 3.69Å; F117-F124 HydrophobicContact CZ-CE2 4.34Å; F117-F124 HydrophobicContact CZ-CG 4.01Å; F117-F124 HydrophobicContact CZ-CZ 4.03Å; S122-F124 PolarHBondContact O-N 3.38Å; S122-F124 VanDerWaalsContact O-N 3.09Å; F124-L200 HydrophobicContact CD2-CD1 3.6Å; F124-L200 HydrophobicContact CE2-CD1 4.19Å; F124-F203 HydrophobicContact CD2-CD1 4.28Å; F124-F203 HydrophobicContact CD2-CE1 4.16Å; F124-F203 AromaticContact CE2-CD1 3.95Å; F124-F203 HydrophobicContact CE2-CD1 3.95Å; F124-F203 AromaticContact CE2-CE1 3.52Å; F124-F203 HydrophobicContact CE2-CE1 3.52Å; F124-F203 HydrophobicContact CZ-CE1 4.16Å; F124-L204 HydrophobicContact CE2-CD2 4.48Å; F124-W254 HydrophobicContact CZ-CE3 4.24Å; F124-W254 HydrophobicContact CZ-CH2 4.09Å; F124-W254 HydrophobicContact CZ-CZ2 4.5Å; F124-W254 AromaticContact CZ-CZ3 3.94Å; F124-W254 HydrophobicContact CZ-CZ3 3.94Å; F124-K258 HydrophobicContact CE2-CD 4.47Å; F124-K258 PolarHBondContact O-NZ 2.87Å |
| 125 | N | 80 | Confident | 81.4 | Confident | 98 Ų | 98 | 54.9 Ų | 54.9 | 52% | 0.524 | 28% | 0.28 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.5 | -33.2 | -176.9 | -63.9 | -48 | 0 | 0 | 0 | 111.9 | V9 S122 P127 | V9-N125 WeakPolarHBondContact CG1-O 3.42Å; S122-N125 PolarHBondContact O-N 2.81Å; N125-P127 WeakPolarHBondContact O-CD 3.38Å |
| 126 | D | 78.5 | Confident | 80.9 | Confident | 7 Ų | 7 | 57.1 Ų | 57.1 | 4% | 0.037 | 30% | 0.295 | C | S | . | . | S | Bend | trans | -119.6 | 82.4 | 175.6 | -179.6 | 21.3 | 0 | 0 | 0 | 109.9 | S122 P128 S129 Y132 | S122-D126 PolarHBondContact O-N 3.12Å; D126-P128 VanDerWaalsContact C-CD 3.5Å; D126-P128 WeakPolarHBondContact OD1-CD 3.34Å; D126-S129 VanDerWaalsContact O-CB 3.31Å; D126-S129 WeakPolarHBondContact O-CB 3.37Å; D126-S129 PolarHBondContact O-N 3.47Å; D126-S129 PolarHBondContact O-OG 3.38Å; D126-S129 WeakPolarHBondContact OD2-CB 3.32Å; D126-Y132 WeakPolarHBondContact OD2-CE2 3.42Å |
| 127 | P | 75.7 | Confident | 80.5 | Confident | 10 Ų | 10 | 58.3 Ų | 58.3 | 7% | 0.065 | 31% | 0.309 | C | S | . | . | G | 310 helix | trans | -56.2 | -37.7 | -175.9 | -22.6 | 32.1 | 0 | 0 | 0 | 115 | N125 S129 V130 K258 | N125-P127 WeakPolarHBondContact O-CD 3.38Å; P127-S129 PolarHBondContact O-N 3.25Å; P127-S129 VanDerWaalsContact O-N 3.16Å; P127-V130 WeakPolarHBondContact O-CG1 3.48Å; P127-V130 WeakPolarHBondContact O-CG2 3.15Å; P127-V130 PolarHBondContact O-N 3.4Å; P127-K258 HydrophobicContact CB-CB 4.09Å; P127-K258 HydrophobicContact CB-CG 4.49Å; P127-K258 HydrophobicContact CG-CB 3.98Å; P127-K258 HydrophobicContact CG-CD 4.35Å; P127-K258 HydrophobicContact CG-CG 3.83Å |
| 128 | P | 77 | Confident | 80.3 | Confident | 9 Ų | 9 | 56.7 Ų | 56.7 | 6% | 0.058 | 30% | 0.303 | C | S | . | . | G | 310 helix | trans | -54.8 | -29.2 | 172.2 | -30.2 | 37.2 | 0 | 0 | 0 | 114.4 | D126 V130 F131 Y132 | D126-P128 VanDerWaalsContact C-CD 3.5Å; D126-P128 WeakPolarHBondContact OD1-CD 3.34Å; P128-V130 PolarHBondContact O-N 3.03Å; P128-F131 PolarHBondContact O-N 2.92Å; P128-Y132 HydrophobicContact CB-CE1 4.04Å; P128-Y132 WeakPolarHBondContact CB-OH 3.39Å; P128-Y132 WeakPolarHBondContact O-CE1 3.45Å |
| 129 | S | 76.8 | Confident | 80.3 | Confident | 13 Ų | 13 | 55.3 Ų | 55.3 | 9% | 0.091 | 31% | 0.308 | C | S | . | . | G | 310 helix | trans | -63.5 | -13.8 | -178.9 | 70.5 | 0 | 0 | 0 | 0 | 115.5 | F123 D126 P127 F131 Y132 | F123-S129 VanDerWaalsContact CA-OG 3.26Å; F123-S129 WeakPolarHBondContact CA-OG 3.26Å; F123-S129 WeakPolarHBondContact CB-OG 3.23Å; D126-S129 VanDerWaalsContact O-CB 3.31Å; D126-S129 WeakPolarHBondContact O-CB 3.37Å; D126-S129 PolarHBondContact O-N 3.47Å; D126-S129 PolarHBondContact O-OG 3.38Å; D126-S129 WeakPolarHBondContact OD2-CB 3.32Å; P127-S129 PolarHBondContact O-N 3.25Å; P127-S129 VanDerWaalsContact O-N 3.16Å; S129-F131 PolarHBondContact O-N 3.37Å; S129-F131 VanDerWaalsContact O-N 3.1Å; S129-Y132 VanDerWaalsContact CB-CD2 3.41Å; S129-Y132 PolarHBondContact O-N 2.96Å; S129-Y132 VanDerWaalsContact O-N 3.09Å |
| 130 | V | 79.5 | Confident | 80.6 | Confident | 6 Ų | 6 | 54.8 Ų | 54.8 | 4% | 0.036 | 30% | 0.303 | C | S | . | . | G | 310 helix | trans | -57 | -25.6 | 174.5 | -63.4 | 0 | 0 | 0 | 0 | 113.3 | F123 P127 P128 N196 V197 A262 | F123-V130 HydrophobicContact CB-CG1 3.6Å; F123-V130 HydrophobicContact CD2-CG1 4.26Å; F123-V130 HydrophobicContact CG-CG1 4.13Å; P127-V130 WeakPolarHBondContact O-CG1 3.48Å; P127-V130 WeakPolarHBondContact O-CG2 3.15Å; P127-V130 PolarHBondContact O-N 3.4Å; P128-V130 PolarHBondContact O-N 3.03Å; V130-N196 HydrophobicContact CB-CB 4.13Å; V130-N196 HydrophobicContact CG1-CB 4.27Å; V130-V197 HydrophobicContact CB-CG2 3.64Å; V130-V197 HydrophobicContact CG1-CG2 4.21Å; V130-V197 HydrophobicContact CG2-CG2 3.54Å; V130-A262 HydrophobicContact CG2-CB 3.81Å |
| 131 | F | 81 | Confident | 81.2 | Confident | 6 Ų | 6 | 50.4 Ų | 50.4 | 3% | 0.026 | 27% | 0.271 | C | S | . | . | G | 310 helix | trans | -107.4 | -2.6 | 178.1 | -69.7 | -71.5 | 0 | 0 | 0 | 114.1 | P128 S129 N133 W134 Y194 V197 A262 T263 S270 I274 | P128-F131 PolarHBondContact O-N 2.92Å; S129-F131 PolarHBondContact O-N 3.37Å; S129-F131 VanDerWaalsContact O-N 3.1Å; F131-N133 PolarHBondContact O-N 2.93Å; F131-W134 VanDerWaalsContact O-CB 3.3Å; F131-W134 WeakPolarHBondContact O-CB 3.31Å; F131-W134 PolarHBondContact O-N 2.8Å; F131-W134 VanDerWaalsContact O-N 3.09Å; F131-Y194 AromaticContact CE1-CD1 3.79Å; F131-Y194 HydrophobicContact CE1-CD1 3.79Å; F131-Y194 HydrophobicContact CE1-CE1 4.05Å; F131-Y194 HydrophobicContact CE1-CG 4.46Å; F131-V197 HydrophobicContact CE1-CG2 4.42Å; F131-V197 HydrophobicContact CE2-CG2 3.92Å; F131-V197 HydrophobicContact CZ-CG2 3.77Å; F131-A262 VanDerWaalsContact CE2-O 3.32Å; F131-A262 WeakPolarHBondContact CE2-O 3.3Å; F131-T263 HydrophobicContact CE2-CG2 4.12Å; F131-T263 HydrophobicContact CZ-CG2 4.09Å; F131-S270 WeakPolarHBondContact CB-OG 3.3Å; F131-I274 HydrophobicContact CD1-CD1 3.93Å; F131-I274 HydrophobicContact CE1-CD1 4.12Å |
| 132 | Y | 78.9 | Confident | 81.7 | Confident | 109 Ų | 109 | 53.1 Ų | 53.1 | 43% | 0.427 | 29% | 0.294 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.9 | 130.1 | 179.2 | -67.5 | -6.1 | 0 | 0 | 0 | 110.4 | D126 P128 S129 W134 | D126-Y132 WeakPolarHBondContact OD2-CE2 3.42Å; P128-Y132 HydrophobicContact CB-CE1 4.04Å; P128-Y132 WeakPolarHBondContact CB-OH 3.39Å; P128-Y132 WeakPolarHBondContact O-CE1 3.45Å; S129-Y132 VanDerWaalsContact CB-CD2 3.41Å; S129-Y132 PolarHBondContact O-N 2.96Å; S129-Y132 VanDerWaalsContact O-N 3.09Å; Y132-W134 PolarHBondContact O-N 3.34Å; Y132-W134 VanDerWaalsContact O-N 3.15Å |
| 133 | N | 76.2 | Confident | 82.4 | Confident | 142 Ų | 142 | 52 Ų | 52 | 76% | 0.759 | 28% | 0.282 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58 | 19.4 | -176.4 | -53.2 | -62.7 | 0 | 0 | 0 | 114.8 | F131 K135 | F131-N133 PolarHBondContact O-N 2.93Å; N133-K135 PolarHBondContact O-N 2.9Å |
| 134 | W | 83.6 | Confident | 83 | Confident | 50 Ų | 50 | 51.8 Ų | 51.8 | 19% | 0.189 | 28% | 0.281 | C | S | . | . | trans | -58 | 130.8 | 174.3 | 177.9 | 87.5 | 0 | 0 | 0 | 110 | F131 Y132 F192 R193 Y194 I274 P275 | F131-W134 VanDerWaalsContact O-CB 3.3Å; F131-W134 WeakPolarHBondContact O-CB 3.31Å; F131-W134 PolarHBondContact O-N 2.8Å; F131-W134 VanDerWaalsContact O-N 3.09Å; Y132-W134 PolarHBondContact O-N 3.34Å; Y132-W134 VanDerWaalsContact O-N 3.15Å; W134-F192 WeakPolarHBondContact CZ2-O 3.45Å; W134-F192 PolarHBondContact NE1-O 3.35Å; W134-R193 PolarHBondContact NE1-O 3.33Å; W134-Y194 HydrophobicContact CD2-CE1 4.44Å; W134-Y194 AromaticContact CE2-CE1 3.62Å; W134-Y194 AromaticContact CZ2-CE1 3.84Å; W134-Y194 HydrophobicContact CZ2-CE1 3.84Å; W134-Y194 AromaticContact NE1-CD1 3.55Å; W134-Y194 AromaticContact NE1-CE1 3.41Å; W134-I274 HydrophobicContact CE3-CG1 4.43Å; W134-I274 HydrophobicContact CZ3-CG1 4.39Å; W134-P275 HydrophobicContact CH2-CG 3.88Å; W134-P275 HydrophobicContact CZ2-CG 4.03Å | ||
| 135 | K | 81.6 | Confident | 83.6 | Confident | 146 Ų | 146 | 52.6 Ų | 52.6 | 64% | 0.635 | 29% | 0.291 | S | S | * | . | trans | -137.7 | 139.3 | 176.3 | -67.4 | 179.9 | -175 | 179 | 0 | 109 | N133 G137 M138 | N133-K135 PolarHBondContact O-N 2.9Å; K135-G137 PolarHBondContact O-N 3.46Å; K135-M138 WeakPolarHBondContact O-CB 3.09Å; K135-M138 WeakPolarHBondContact O-CG 3.13Å; K135-M138 PolarHBondContact O-N 3.06Å; K135-M138 VanDerWaalsContact O-N 3.14Å | ||
| 136 | S | 81.4 | Confident | 84.4 | Confident | 46 Ų | 46 | 51.6 Ų | 51.6 | 32% | 0.322 | 29% | 0.285 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -55.5 | 132.5 | 172.1 | -165.4 | 0 | 0 | 0 | 0 | 110 | N48 M138 | N48-S136 WeakPolarHBondContact OD1-CB 3.27Å; N48-S136 PolarHBondContact OD1-OG 3.36Å; S136-M138 VanDerWaalsContact C-N 3.29Å; S136-M138 PolarHBondContact O-N 3.24Å |
| 137 | G | 79.9 | Confident | 85.2 | Confident | 30 Ų | 30 | 51.4 Ų | 51.4 | 31% | 0.309 | 28% | 0.284 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 74.6 | 9.2 | 179.7 | 0 | 0 | 0 | 0 | 0 | 116 | Y50 K135 | Y50-G137 VanDerWaalsContact CD2-CA 3.47Å; Y50-G137 VanDerWaalsContact CZ-CA 3.45Å; K135-G137 PolarHBondContact O-N 3.46Å |
| 138 | M | 85.6 | Confident | 86.1 | Confident | 59 Ų | 59 | 51.5 Ų | 51.5 | 29% | 0.291 | 28% | 0.284 | S | S | . | . | P | Polyproline II helix | trans | -57.3 | 144.3 | 174.5 | 69 | -177.3 | -65.8 | 0 | 0 | 111.6 | K135 S136 V140 R193 | K135-M138 WeakPolarHBondContact O-CB 3.09Å; K135-M138 WeakPolarHBondContact O-CG 3.13Å; K135-M138 PolarHBondContact O-N 3.06Å; K135-M138 VanDerWaalsContact O-N 3.14Å; S136-M138 VanDerWaalsContact C-N 3.29Å; S136-M138 PolarHBondContact O-N 3.24Å; M138-V140 PolarHBondContact O-N 2.72Å; M138-R193 HydrophobicContact CG-CB 3.75Å; M138-R193 HydrophobicContact CG-CG 4.07Å; M138-R193 VanDerWaalsContact O-CD 3.26Å; M138-R193 WeakPolarHBondContact O-CD 3.35Å; M138-R193 PolarHBondContact O-NE 3.42Å; M138-R193 HydrophobicContact SD-CB 4.46Å |
| 139 | T | 87.3 | Confident | 87 | Confident | 123 Ų | 123 | 53.4 Ų | 53.4 | 76% | 0.755 | 29% | 0.293 | S | S | * | . | P | Polyproline II helix | trans | -66.2 | 130.5 | 178.5 | 52.2 | 0 | 0 | 0 | 0 | 110.2 | ||
| 140 | V | 89 | Confident | 88 | Confident | 24 Ų | 24 | 55.1 Ų | 55.1 | 15% | 0.145 | 30% | 0.301 | C | S | . | . | P | Polyproline II helix | trans | -77.6 | 126.9 | 171 | -175.6 | 0 | 0 | 0 | 0 | 108.2 | M138 T142 I144 A145 R193 H195 | M138-V140 PolarHBondContact O-N 2.72Å; V140-T142 PolarHBondContact O-N 2.9Å; V140-I144 HydrophobicContact CG1-CB 4.08Å; V140-I144 HydrophobicContact CG1-CG2 3.86Å; V140-A145 HydrophobicContact CG1-CB 4.08Å; V140-R193 VanDerWaalsContact CG2-CD 3.45Å; V140-H195 HydrophobicContact CG1-CB 4.22Å |
| 141 | P | 91.4 | Very high | 88.8 | Confident | 41 Ų | 41 | 54.8 Ų | 54.8 | 27% | 0.266 | 30% | 0.299 | S | S | . | . | P | Polyproline II helix | trans | -54.2 | 137.6 | 171.8 | -27.9 | 37.7 | 0 | 0 | 0 | 111.7 | Y121 D143 I144 A145 | Y121-P141 VanDerWaalsContact OH-CB 3.28Å; Y121-P141 WeakPolarHBondContact OH-CB 3.43Å; P141-D143 VanDerWaalsContact C-N 3.27Å; P141-D143 VanDerWaalsContact C-OD1 3.29Å; P141-D143 WeakPolarHBondContact CB-OD1 3.39Å; P141-D143 PolarHBondContact O-N 3.41Å; P141-I144 HydrophobicContact CB-CB 4.43Å; P141-I144 HydrophobicContact CB-CD1 4.36Å; P141-I144 HydrophobicContact CB-CG1 4.34Å; P141-I144 HydrophobicContact CG-CD1 4.18Å; P141-I144 PolarHBondContact O-N 3.23Å; P141-A145 PolarHBondContact O-N 3.46Å |
| 142 | T | 92.2 | Very high | 89.5 | Confident | 109 Ų | 109 | 54.6 Ų | 54.6 | 67% | 0.669 | 30% | 0.298 | S | S | * | . | H | α-helix | trans | -58.7 | -38 | -172.3 | -54.9 | 0 | 0 | 0 | 0 | 113.2 | V140 A145 I146 | V140-T142 PolarHBondContact O-N 2.9Å; T142-A145 PolarHBondContact O-N 2.84Å; T142-I146 HydrophobicContact CG2-CD1 4.15Å; T142-I146 VanDerWaalsContact O-CG1 3.25Å; T142-I146 WeakPolarHBondContact O-CG1 3.43Å; T142-I146 PolarHBondContact O-N 3.06Å |
| 143 | D | 93.3 | Very high | 90.4 | Very high | 42 Ų | 42 | 49.4 Ų | 49.4 | 23% | 0.225 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -59.8 | -44.5 | 174.2 | 57.6 | -34.7 | 0 | 0 | 0 | 112.1 | Y111 L115 Y121 P141 I146 A147 | Y111-D143 WeakPolarHBondContact OH-CA 3.31Å; Y111-D143 PolarHBondContact OH-O 3.14Å; L115-D143 HydrophobicContact CD2-CB 3.82Å; L115-D143 WeakPolarHBondContact CD2-OD2 3.32Å; Y121-D143 VanDerWaalsContact CE2-OD2 3.27Å; Y121-D143 WeakPolarHBondContact CE2-OD2 3.46Å; Y121-D143 PolarHBondContact OH-OD1 2.97Å; Y121-D143 PolarHBondContact OH-OD2 3.12Å; P141-D143 VanDerWaalsContact C-N 3.27Å; P141-D143 VanDerWaalsContact C-OD1 3.29Å; P141-D143 WeakPolarHBondContact CB-OD1 3.39Å; P141-D143 PolarHBondContact O-N 3.41Å; D143-I146 PolarHBondContact O-N 2.9Å; D143-A147 PolarHBondContact O-N 3.1Å |
| 144 | I | 93.6 | Very high | 91.4 | Very high | 0 Ų | 0 | 42.7 Ų | 42.7 | 0% | 0 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -68.7 | -41.7 | 174.4 | -64.8 | -178.1 | 0 | 0 | 0 | 110.9 | Y121 V140 P141 I146 A147 Y148 H195 I199 | Y121-I144 HydrophobicContact CE1-CD1 3.93Å; Y121-I144 HydrophobicContact CE2-CD1 4.13Å; Y121-I144 HydrophobicContact CE2-CG1 4.31Å; V140-I144 HydrophobicContact CG1-CB 4.08Å; V140-I144 HydrophobicContact CG1-CG2 3.86Å; P141-I144 HydrophobicContact CB-CB 4.43Å; P141-I144 HydrophobicContact CB-CD1 4.36Å; P141-I144 HydrophobicContact CB-CG1 4.34Å; P141-I144 HydrophobicContact CG-CD1 4.18Å; P141-I144 PolarHBondContact O-N 3.23Å; I144-I146 VanDerWaalsContact C-N 3.28Å; I144-I146 PolarHBondContact O-N 3.24Å; I144-A147 WeakPolarHBondContact O-CB 3.44Å; I144-A147 PolarHBondContact O-N 3.01Å; I144-A147 VanDerWaalsContact O-N 3.12Å; I144-Y148 HydrophobicContact CG2-CD2 3.84Å; I144-Y148 HydrophobicContact CG2-CE2 3.86Å; I144-Y148 WeakPolarHBondContact O-CD2 3.37Å; I144-Y148 PolarHBondContact O-N 3.37Å; I144-H195 HydrophobicContact CG2-CB 3.75Å; I144-I199 HydrophobicContact CG1-CG1 4.33Å; I144-I199 HydrophobicContact CG2-CD1 4.08Å; I144-I199 HydrophobicContact CG2-CG1 3.92Å |
| 145 | A | 94.1 | Very high | 91.9 | Very high | 35 Ų | 35 | 40.6 Ų | 40.6 | 29% | 0.289 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -60.1 | -38 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | V140 P141 T142 Y148 L149 | V140-A145 HydrophobicContact CG1-CB 4.08Å; P141-A145 PolarHBondContact O-N 3.46Å; T142-A145 PolarHBondContact O-N 2.84Å; A145-Y148 PolarHBondContact O-N 3.35Å; A145-L149 WeakPolarHBondContact O-CB 3.3Å; A145-L149 PolarHBondContact O-N 3.12Å |
| 146 | I | 95.1 | Very high | 92.6 | Very high | 76 Ų | 76 | 34.4 Ų | 34.4 | 39% | 0.39 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -63 | -45.3 | 173.9 | -71.2 | 163.9 | 0 | 0 | 0 | 110.9 | Y111 T142 D143 I144 Y148 L149 I150 | Y111-I146 HydrophobicContact CE1-CB 4.47Å; Y111-I146 HydrophobicContact CE1-CG2 4.12Å; T142-I146 HydrophobicContact CG2-CD1 4.15Å; T142-I146 VanDerWaalsContact O-CG1 3.25Å; T142-I146 WeakPolarHBondContact O-CG1 3.43Å; T142-I146 PolarHBondContact O-N 3.06Å; D143-I146 PolarHBondContact O-N 2.9Å; I144-I146 VanDerWaalsContact C-N 3.28Å; I144-I146 PolarHBondContact O-N 3.24Å; I146-Y148 VanDerWaalsContact C-N 3.31Å; I146-Y148 PolarHBondContact O-N 2.91Å; I146-L149 PolarHBondContact O-N 3.34Å; I146-I150 HydrophobicContact CG2-CD1 3.65Å; I146-I150 HydrophobicContact CG2-CG1 4.36Å; I146-I150 WeakPolarHBondContact O-CB 3.37Å; I146-I150 WeakPolarHBondContact O-CG1 3.29Å; I146-I150 PolarHBondContact O-N 2.94Å |
| 147 | A | 95.7 | Very high | 93.3 | Very high | 3 Ų | 3 | 32.4 Ų | 32.4 | 3% | 0.025 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -58.4 | -45.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | Y111 L115 D143 I144 Q151 I199 | Y111-A147 HydrophobicContact CD1-CB 3.86Å; Y111-A147 HydrophobicContact CE1-CB 3.68Å; L115-A147 HydrophobicContact CD1-CB 4.08Å; D143-A147 PolarHBondContact O-N 3.1Å; I144-A147 WeakPolarHBondContact O-CB 3.44Å; I144-A147 PolarHBondContact O-N 3.01Å; I144-A147 VanDerWaalsContact O-N 3.12Å; A147-Q151 VanDerWaalsContact O-CB 3.23Å; A147-Q151 WeakPolarHBondContact O-CB 3.23Å; A147-Q151 PolarHBondContact O-N 3.46Å; A147-I199 HydrophobicContact CB-CD1 3.7Å |
| 148 | Y | 95.4 | Very high | 94 | Very high | 12 Ų | 12 | 31.3 Ų | 31.3 | 5% | 0.047 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -63.4 | -45.5 | 178.4 | -91.7 | -109.8 | 0 | 0 | 0 | 112.7 | I144 A145 I146 G152 I186 S189 D190 H195 G198 I199 | I144-Y148 HydrophobicContact CG2-CD2 3.84Å; I144-Y148 HydrophobicContact CG2-CE2 3.86Å; I144-Y148 WeakPolarHBondContact O-CD2 3.37Å; I144-Y148 PolarHBondContact O-N 3.37Å; A145-Y148 PolarHBondContact O-N 3.35Å; I146-Y148 VanDerWaalsContact C-N 3.31Å; I146-Y148 PolarHBondContact O-N 2.91Å; Y148-G152 WeakPolarHBondContact O-CA 3.48Å; Y148-G152 PolarHBondContact O-N 3Å; Y148-I186 HydrophobicContact CD1-CG2 3.76Å; Y148-I186 HydrophobicContact CE1-CG2 4.2Å; Y148-S189 PolarHBondContact OH-OG 2.66Å; Y148-D190 HydrophobicContact CD1-CB 3.87Å; Y148-D190 HydrophobicContact CE1-CB 4.15Å; Y148-H195 HydrophobicContact CE2-CB 4.11Å; Y148-H195 WeakPolarHBondContact OH-CA 3.25Å; Y148-H195 PolarHBondContact OH-O 3.11Å; Y148-G198 WeakPolarHBondContact OH-CA 3.1Å; Y148-G198 PolarHBondContact OH-N 3.07Å; Y148-I199 HydrophobicContact CD2-CD1 4.04Å; Y148-I199 HydrophobicContact CE2-CD1 3.78Å; Y148-I199 HydrophobicContact CE2-CG1 4.07Å |
| 149 | L | 96.2 | Very high | 94.4 | Very high | 50 Ų | 50 | 30.6 Ų | 30.6 | 26% | 0.262 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -63.8 | -46.9 | 178.9 | 178.5 | 62.6 | 0 | 0 | 0 | 111.2 | L58 F59 A145 I146 S153 | L58-L149 HydrophobicContact CB-CD1 3.94Å; L58-L149 HydrophobicContact CB-CD2 4.18Å; L58-L149 HydrophobicContact CD1-CD2 4.47Å; F59-L149 HydrophobicContact CB-CD1 4.42Å; A145-L149 WeakPolarHBondContact O-CB 3.3Å; A145-L149 PolarHBondContact O-N 3.12Å; I146-L149 PolarHBondContact O-N 3.34Å; L149-S153 WeakPolarHBondContact O-CB 3.39Å; L149-S153 PolarHBondContact O-N 3.36Å; L149-S153 PolarHBondContact O-OG 3.07Å |
| 150 | I | 96.1 | Very high | 94.8 | Very high | 48 Ų | 48 | 30.4 Ų | 30.4 | 25% | 0.246 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -60.8 | -50.9 | 178.6 | -73.9 | 173.7 | 0 | 0 | 0 | 110.4 | W66 F104 M107 I146 S153 F154 | W66-I150 HydrophobicContact CZ2-CG2 4.01Å; F104-I150 HydrophobicContact CE2-CG2 3.86Å; F104-I150 HydrophobicContact CZ-CG2 4.18Å; M107-I150 HydrophobicContact CE-CG2 4.03Å; I146-I150 HydrophobicContact CG2-CD1 3.65Å; I146-I150 HydrophobicContact CG2-CG1 4.36Å; I146-I150 WeakPolarHBondContact O-CB 3.37Å; I146-I150 WeakPolarHBondContact O-CG1 3.29Å; I146-I150 PolarHBondContact O-N 2.94Å; I150-S153 PolarHBondContact O-OG 2.9Å; I150-S153 VanDerWaalsContact O-OG 3.12Å; I150-F154 WeakPolarHBondContact O-CB 3.44Å; I150-F154 PolarHBondContact O-N 2.7Å; I150-F154 VanDerWaalsContact O-N 3.09Å |
| 151 | Q | 96.3 | Very high | 95 | Very high | 0 Ų | 0 | 29.3 Ų | 29.3 | 0% | 0 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -68.2 | -51 | -176.6 | -162.2 | 78.1 | -10.5 | 0 | 0 | 111.5 | F104 S108 A147 S153 F154 Y155 I186 L202 D206 | F104-Q151 VanDerWaalsContact CZ-OE1 3.3Å; S108-Q151 PolarHBondContact OG-OE1 3.03Å; A147-Q151 VanDerWaalsContact O-CB 3.23Å; A147-Q151 WeakPolarHBondContact O-CB 3.23Å; A147-Q151 PolarHBondContact O-N 3.46Å; Q151-S153 PolarHBondContact O-N 3.39Å; Q151-F154 PolarHBondContact O-N 3.32Å; Q151-Y155 HydrophobicContact CG-CD2 3.96Å; Q151-Y155 HydrophobicContact CG-CE2 3.8Å; Q151-Y155 VanDerWaalsContact O-CD2 3.32Å; Q151-Y155 WeakPolarHBondContact O-CD2 3.41Å; Q151-Y155 PolarHBondContact O-N 2.8Å; Q151-I186 HydrophobicContact CB-CD1 4.41Å; Q151-I186 HydrophobicContact CG-CD1 4Å; Q151-L202 HydrophobicContact CB-CD1 3.89Å; Q151-L202 HydrophobicContact CG-CD1 3.77Å; Q151-L202 HydrophobicContact CG-CD2 3.59Å; Q151-L202 HydrophobicContact CG-CG 4.26Å; Q151-D206 VanDerWaalsContact NE2-CG 3.3Å; Q151-D206 PolarHBondContact NE2-OD1 3.49Å; Q151-D206 PolarHBondContact NE2-OD2 2.91Å |
| 152 | G | 96.6 | Very high | 95.1 | Very high | 1 Ų | 1 | 27.7 Ų | 27.7 | 1% | 0.01 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -56.3 | -51.2 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | F59 Y148 F154 Y155 G156 | F59-G152 WeakPolarHBondContact CE2-O 3.39Å; Y148-G152 WeakPolarHBondContact O-CA 3.48Å; Y148-G152 PolarHBondContact O-N 3Å; G152-F154 VanDerWaalsContact C-N 3.28Å; G152-F154 PolarHBondContact O-N 2.93Å; G152-Y155 PolarHBondContact O-N 3.33Å; G152-Y155 VanDerWaalsContact O-N 3.16Å; G152-G156 PolarHBondContact O-N 3.12Å |
| 153 | S | 97.4 | Very high | 95.1 | Very high | 0 Ų | 0 | 25.8 Ų | 25.8 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -63.6 | -33.1 | -179.9 | 62.9 | 0 | 0 | 0 | 0 | 112.8 | F59 C62 A63 W66 L149 I150 Q151 G156 H157 | F59-S153 WeakPolarHBondContact O-CB 3.44Å; C62-S153 VanDerWaalsContact CB-CB 3.47Å; C62-S153 WeakPolarHBondContact CB-OG 3.11Å; A63-S153 WeakPolarHBondContact CB-O 3.46Å; W66-S153 PolarHBondContact NE1-OG 3.12Å; L149-S153 WeakPolarHBondContact O-CB 3.39Å; L149-S153 PolarHBondContact O-N 3.36Å; L149-S153 PolarHBondContact O-OG 3.07Å; I150-S153 PolarHBondContact O-OG 2.9Å; I150-S153 VanDerWaalsContact O-OG 3.12Å; Q151-S153 PolarHBondContact O-N 3.39Å; S153-G156 PolarHBondContact O-N 3.36Å; S153-H157 PolarHBondContact O-N 3.34Å |
| 154 | F | 97.1 | Very high | 95 | Very high | 1 Ų | 1 | 28.7 Ų | 28.7 | 0% | 0.004 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -68.2 | -39.7 | 173.6 | -179.7 | -95.7 | 0 | 0 | 0 | 112.7 | W66 W100 F104 Y105 I150 Q151 G152 G156 H157 S158 | W66-F154 HydrophobicContact CD2-CD2 4.48Å; W66-F154 HydrophobicContact CG-CD2 4.46Å; W100-F154 AromaticContact CE2-CE2 3.86Å; W100-F154 HydrophobicContact CZ2-CD2 4.38Å; W100-F154 AromaticContact CZ2-CE2 3.92Å; W100-F154 HydrophobicContact CZ2-CE2 3.92Å; W100-F154 AromaticContact NE1-CE2 3.46Å; W100-F154 AromaticContact NE1-CZ 3.99Å; F104-F154 HydrophobicContact CB-CD2 4.21Å; F104-F154 HydrophobicContact CB-CE2 3.59Å; F104-F154 HydrophobicContact CB-CZ 3.79Å; F104-F154 AromaticContact CD1-CD1 3.41Å; F104-F154 HydrophobicContact CD1-CD1 3.41Å; F104-F154 VanDerWaalsContact CD1-CD1 3.41Å; F104-F154 AromaticContact CD1-CD2 3.78Å; F104-F154 HydrophobicContact CD1-CD2 3.78Å; F104-F154 AromaticContact CD1-CE1 3.3Å; F104-F154 HydrophobicContact CD1-CE1 3.3Å; F104-F154 AromaticContact CD1-CE2 3.66Å; F104-F154 HydrophobicContact CD1-CE2 3.66Å; F104-F154 AromaticContact CD1-CG 3.65Å; F104-F154 HydrophobicContact CD1-CG 3.65Å; F104-F154 AromaticContact CD1-CZ 3.42Å; F104-F154 HydrophobicContact CD1-CZ 3.42Å; F104-F154 VanDerWaalsContact CD1-CZ 3.42Å; F104-F154 HydrophobicContact CD2-CB 4.12Å; F104-F154 HydrophobicContact CD2-CD1 4.29Å; F104-F154 AromaticContact CD2-CD2 3.24Å; F104-F154 HydrophobicContact CD2-CD2 3.24Å; F104-F154 AromaticContact CD2-CE2 3.56Å; F104-F154 HydrophobicContact CD2-CE2 3.56Å; F104-F154 AromaticContact CD2-CG 3.63Å; F104-F154 HydrophobicContact CD2-CG 3.63Å; F104-F154 HydrophobicContact CD2-CZ 4.23Å; F104-F154 HydrophobicContact CE1-CB 3.86Å; F104-F154 AromaticContact CE1-CD1 3.16Å; F104-F154 HydrophobicContact CE1-CD1 3.16Å; F104-F154 AromaticContact CE1-CD2 3.97Å; F104-F154 HydrophobicContact CE1-CD2 3.97Å; F104-F154 AromaticContact CE1-CE1 3.56Å; F104-F154 HydrophobicContact CE1-CE1 3.56Å; F104-F154 HydrophobicContact CE1-CE2 4.28Å; F104-F154 AromaticContact CE1-CG 3.38Å; F104-F154 HydrophobicContact CE1-CG 3.38Å; F104-F154 HydrophobicContact CE1-CZ 4.1Å; F104-F154 HydrophobicContact CE2-CB 3.35Å; F104-F154 HydrophobicContact CE2-CD1 4.07Å; F104-F154 AromaticContact CE2-CD2 3.44Å; F104-F154 HydrophobicContact CE2-CD2 3.44Å; F104-F154 VanDerWaalsContact CE2-CD2 3.44Å; F104-F154 HydrophobicContact CE2-CE2 4.19Å; F104-F154 AromaticContact CE2-CG 3.34Å; F104-F154 HydrophobicContact CE2-CG 3.34Å; F104-F154 AromaticContact CG-CD1 3.99Å; F104-F154 HydrophobicContact CG-CD1 3.99Å; F104-F154 AromaticContact CG-CD2 3.43Å; F104-F154 HydrophobicContact CG-CD2 3.43Å; F104-F154 VanDerWaalsContact CG-CD2 3.43Å; F104-F154 AromaticContact CG-CE1 3.87Å; F104-F154 HydrophobicContact CG-CE1 3.87Å; F104-F154 AromaticContact CG-CE2 3.26Å; F104-F154 HydrophobicContact CG-CE2 3.26Å; F104-F154 AromaticContact CG-CG 3.78Å; F104-F154 HydrophobicContact CG-CG 3.78Å; F104-F154 AromaticContact CG-CZ 3.5Å; F104-F154 HydrophobicContact CG-CZ 3.5Å; F104-F154 HydrophobicContact CZ-CB 3.21Å; F104-F154 AromaticContact CZ-CD1 3.53Å; F104-F154 HydrophobicContact CZ-CD1 3.53Å; F104-F154 AromaticContact CZ-CD2 3.81Å; F104-F154 HydrophobicContact CZ-CD2 3.81Å; F104-F154 HydrophobicContact CZ-CE1 4.3Å; F104-F154 AromaticContact CZ-CG 3.23Å; F104-F154 HydrophobicContact CZ-CG 3.23Å; Y105-F154 HydrophobicContact CE1-CE1 4.4Å; I150-F154 WeakPolarHBondContact O-CB 3.44Å; I150-F154 PolarHBondContact O-N 2.7Å; I150-F154 VanDerWaalsContact O-N 3.09Å; Q151-F154 PolarHBondContact O-N 3.32Å; G152-F154 VanDerWaalsContact C-N 3.28Å; G152-F154 PolarHBondContact O-N 2.93Å; F154-G156 VanDerWaalsContact C-N 3.34Å; F154-H157 PolarHBondContact O-N 3.17Å; F154-S158 VanDerWaalsContact CE1-OG 3.29Å; F154-S158 WeakPolarHBondContact CE1-OG 3.35Å; F154-S158 VanDerWaalsContact O-CB 3.32Å; F154-S158 WeakPolarHBondContact O-CB 3.22Å; F154-S158 PolarHBondContact O-N 3.29Å; F154-S158 PolarHBondContact O-OG 3.35Å |
| 155 | Y | 95.1 | Very high | 94.8 | Very high | 6 Ų | 6 | 32.1 Ų | 32.1 | 2% | 0.024 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -65.2 | -38.9 | 173.1 | -86.2 | -85.2 | 0 | 0 | 0 | 111.3 | Q151 G152 S158 I159 H179 T182 I186 | Q151-Y155 HydrophobicContact CG-CD2 3.96Å; Q151-Y155 HydrophobicContact CG-CE2 3.8Å; Q151-Y155 VanDerWaalsContact O-CD2 3.32Å; Q151-Y155 WeakPolarHBondContact O-CD2 3.41Å; Q151-Y155 PolarHBondContact O-N 2.8Å; G152-Y155 PolarHBondContact O-N 3.33Å; G152-Y155 VanDerWaalsContact O-N 3.16Å; Y155-S158 WeakPolarHBondContact O-CB 3.27Å; Y155-S158 PolarHBondContact O-N 3.16Å; Y155-S158 VanDerWaalsContact O-N 3.08Å; Y155-I159 PolarHBondContact O-N 3.06Å; Y155-H179 HydrophobicContact CD1-CB 4.33Å; Y155-H179 AromaticContact CD1-CD2 3.59Å; Y155-H179 AromaticContact CE1-CD2 3.71Å; Y155-T182 WeakPolarHBondContact CD1-OG1 3.47Å; Y155-T182 HydrophobicContact CE1-CG2 4.21Å; Y155-T182 WeakPolarHBondContact CE1-OG1 3.36Å; Y155-I186 HydrophobicContact CD2-CD1 4Å; Y155-I186 HydrophobicContact CE2-CD1 4.45Å |
| 156 | G | 95.8 | Very high | 94.6 | Very high | 17 Ų | 17 | 31.3 Ų | 31.3 | 18% | 0.175 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -57.3 | -48.9 | 171.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | G152 S153 F154 S158 I159 | G152-G156 PolarHBondContact O-N 3.12Å; S153-G156 PolarHBondContact O-N 3.36Å; F154-G156 VanDerWaalsContact C-N 3.34Å; G156-S158 VanDerWaalsContact C-N 3.31Å; G156-S158 PolarHBondContact O-N 2.95Å; G156-I159 PolarHBondContact O-N 3.17Å |
| 157 | H | 95.8 | Very high | 94.2 | Very high | 3 Ų | 3 | 32.8 Ų | 32.8 | 1% | 0.014 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -59.1 | -41.2 | 170.8 | 156.4 | -96.4 | 0 | 0 | 0 | 112.2 | W66 T67 R70 W100 S153 F154 I159 Y160 A161 | W66-H157 HydrophobicContact CB-CB 3.87Å; T67-H157 PolarHBondContact OG1-CD2 2.92Å; T67-H157 VanDerWaalsContact OG1-CD2 3.28Å; R70-H157 WeakPolarHBondContact CD-NE2 3.38Å; W100-H157 AromaticContact NE1-CE1 3.46Å; W100-H157 PolarHBondContact NE1-CE1 3.08Å; S153-H157 PolarHBondContact O-N 3.34Å; F154-H157 PolarHBondContact O-N 3.17Å; H157-I159 VanDerWaalsContact C-N 3.31Å; H157-I159 PolarHBondContact O-N 3.05Å; H157-Y160 WeakPolarHBondContact O-CB 3.28Å; H157-Y160 PolarHBondContact O-N 3.35Å; H157-Y160 VanDerWaalsContact O-N 3.17Å; H157-A161 VanDerWaalsContact O-CB 3.3Å; H157-A161 WeakPolarHBondContact O-CB 3.27Å; H157-A161 PolarHBondContact O-N 2.82Å |
| 158 | S | 94.6 | Very high | 93.8 | Very high | 8 Ų | 8 | 39.2 Ų | 39.2 | 6% | 0.056 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -64.8 | -33.1 | -176.5 | -63.5 | 0 | 0 | 0 | 0 | 112.6 | F154 Y155 G156 A161 T162 | F154-S158 VanDerWaalsContact CE1-OG 3.29Å; F154-S158 WeakPolarHBondContact CE1-OG 3.35Å; F154-S158 VanDerWaalsContact O-CB 3.32Å; F154-S158 WeakPolarHBondContact O-CB 3.22Å; F154-S158 PolarHBondContact O-N 3.29Å; F154-S158 PolarHBondContact O-OG 3.35Å; Y155-S158 WeakPolarHBondContact O-CB 3.27Å; Y155-S158 PolarHBondContact O-N 3.16Å; Y155-S158 VanDerWaalsContact O-N 3.08Å; G156-S158 VanDerWaalsContact C-N 3.31Å; G156-S158 PolarHBondContact O-N 2.95Å; S158-A161 PolarHBondContact O-N 3.11Å; S158-T162 WeakPolarHBondContact O-CB 3.3Å; S158-T162 PolarHBondContact O-N 3.48Å; S158-T162 PolarHBondContact O-OG1 2.88Å |
| 159 | I | 94.9 | Very high | 93.4 | Very high | 43 Ų | 43 | 43.3 Ų | 43.3 | 22% | 0.221 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -60.7 | -53.9 | 170.4 | -65.2 | 169.9 | 0 | 0 | 0 | 110.3 | Y155 G156 H157 A161 T162 V163 H179 I180 L183 | Y155-I159 PolarHBondContact O-N 3.06Å; G156-I159 PolarHBondContact O-N 3.17Å; H157-I159 VanDerWaalsContact C-N 3.31Å; H157-I159 PolarHBondContact O-N 3.05Å; I159-A161 VanDerWaalsContact C-N 3.29Å; I159-A161 PolarHBondContact O-N 2.84Å; I159-T162 PolarHBondContact O-N 2.86Å; I159-V163 WeakPolarHBondContact O-CG2 3.48Å; I159-V163 PolarHBondContact O-N 2.88Å; I159-V163 VanDerWaalsContact O-N 3.12Å; I159-H179 HydrophobicContact CD1-CB 4.1Å; I159-H179 HydrophobicContact CG1-CB 3.44Å; I159-H179 VanDerWaalsContact CG1-CB 3.44Å; I159-I180 HydrophobicContact CD1-CG1 4.3Å; I159-L183 HydrophobicContact CD1-CD2 4.06Å |
| 160 | Y | 95 | Very high | 92.8 | Very high | 119 Ų | 119 | 51.1 Ų | 51.1 | 47% | 0.467 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -58 | -44.3 | 178.7 | 168.6 | -96.4 | 0 | 0 | 0 | 111.7 | T67 H157 V163 N164 M165 | T67-Y160 HydrophobicContact CG2-CD1 4.24Å; T67-Y160 HydrophobicContact CG2-CE1 3.82Å; H157-Y160 WeakPolarHBondContact O-CB 3.28Å; H157-Y160 PolarHBondContact O-N 3.35Å; H157-Y160 VanDerWaalsContact O-N 3.17Å; Y160-V163 PolarHBondContact O-N 3.48Å; Y160-N164 WeakPolarHBondContact CD2-ND2 3.4Å; Y160-N164 HydrophobicContact CE2-CB 4.13Å; Y160-N164 WeakPolarHBondContact CE2-ND2 3.39Å; Y160-N164 WeakPolarHBondContact O-CB 3.44Å; Y160-N164 PolarHBondContact O-N 3.03Å; Y160-N164 PolarHBondContact O-ND2 3.09Å; Y160-M165 HydrophobicContact CD1-SD 4.15Å; Y160-M165 HydrophobicContact CE1-CG 4.09Å; Y160-M165 HydrophobicContact CE1-SD 3.78Å |
| 161 | A | 93.8 | Very high | 92.4 | Very high | 1 Ų | 1 | 51.7 Ų | 51.7 | 1% | 0.008 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -60.3 | -48.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | H157 S158 I159 V163 N164 M165 D166 | H157-A161 VanDerWaalsContact O-CB 3.3Å; H157-A161 WeakPolarHBondContact O-CB 3.27Å; H157-A161 PolarHBondContact O-N 2.82Å; S158-A161 PolarHBondContact O-N 3.11Å; I159-A161 VanDerWaalsContact C-N 3.29Å; I159-A161 PolarHBondContact O-N 2.84Å; A161-V163 VanDerWaalsContact C-N 3.27Å; A161-V163 PolarHBondContact O-N 2.91Å; A161-N164 PolarHBondContact O-N 3.28Å; A161-M165 HydrophobicContact CB-CB 4.49Å; A161-M165 HydrophobicContact CB-SD 4.27Å; A161-M165 CarbonylContact O-C 3.51Å; A161-M165 WeakPolarHBondContact O-CA 3.49Å; A161-M165 WeakPolarHBondContact O-CB 3.45Å; A161-M165 PolarHBondContact O-N 3.14Å; A161-D166 PolarHBondContact O-N 3.49Å |
| 162 | T | 92.4 | Very high | 92 | Very high | 8 Ų | 8 | 52.2 Ų | 52.2 | 5% | 0.049 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -63.5 | -34.8 | -180 | -62.2 | 0 | 0 | 0 | 0 | 112 | S158 I159 W168 V176 | S158-T162 WeakPolarHBondContact O-CB 3.3Å; S158-T162 PolarHBondContact O-N 3.48Å; S158-T162 PolarHBondContact O-OG1 2.88Å; I159-T162 PolarHBondContact O-N 2.86Å; T162-W168 PolarHBondContact O-NE1 3.24Å; T162-W168 VanDerWaalsContact O-NE1 3.14Å; T162-V176 HydrophobicContact CG2-CG2 3.61Å |
| 163 | V | 92.6 | Very high | 91.9 | Very high | 68 Ų | 68 | 54.8 Ų | 54.8 | 41% | 0.412 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -76.3 | -43.2 | 179.4 | 176.7 | 0 | 0 | 0 | 0 | 112.1 | I159 Y160 A161 V176 | I159-V163 WeakPolarHBondContact O-CG2 3.48Å; I159-V163 PolarHBondContact O-N 2.88Å; I159-V163 VanDerWaalsContact O-N 3.12Å; Y160-V163 PolarHBondContact O-N 3.48Å; A161-V163 VanDerWaalsContact C-N 3.27Å; A161-V163 PolarHBondContact O-N 2.91Å; V163-V176 HydrophobicContact CG2-CG2 4.46Å |
| 164 | N | 91.8 | Very high | 91.7 | Very high | 104 Ų | 104 | 56.7 Ų | 56.7 | 56% | 0.556 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -115.1 | -21.3 | -166 | -61.3 | -59.2 | 0 | 0 | 0 | 115.6 | Y160 A161 | Y160-N164 WeakPolarHBondContact CD2-ND2 3.4Å; Y160-N164 HydrophobicContact CE2-CB 4.13Å; Y160-N164 WeakPolarHBondContact CE2-ND2 3.39Å; Y160-N164 WeakPolarHBondContact O-CB 3.44Å; Y160-N164 PolarHBondContact O-N 3.03Å; Y160-N164 PolarHBondContact O-ND2 3.09Å; A161-N164 PolarHBondContact O-N 3.28Å |
| 165 | M | 89.9 | Confident | 91.5 | Very high | 72 Ų | 72 | 58.9 Ų | 58.9 | 36% | 0.355 | 30% | 0.297 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -112.7 | -37.6 | -173.1 | -59.4 | 178.6 | 66.1 | 0 | 0 | 112.9 | T67 R70 Y160 A161 | T67-M165 HydrophobicContact CG2-SD 4.28Å; R70-M165 HydrophobicContact CG-CE 4.34Å; Y160-M165 HydrophobicContact CD1-SD 4.15Å; Y160-M165 HydrophobicContact CE1-CG 4.09Å; Y160-M165 HydrophobicContact CE1-SD 3.78Å; A161-M165 HydrophobicContact CB-CB 4.49Å; A161-M165 HydrophobicContact CB-SD 4.27Å; A161-M165 CarbonylContact O-C 3.51Å; A161-M165 WeakPolarHBondContact O-CA 3.49Å; A161-M165 WeakPolarHBondContact O-CB 3.45Å; A161-M165 PolarHBondContact O-N 3.14Å |
| 166 | D | 89.2 | Confident | 91.5 | Very high | 17 Ų | 17 | 59.9 Ų | 59.9 | 9% | 0.091 | 30% | 0.303 | C | S | . | . | S | Bend | trans | -86.3 | 149.8 | -174.3 | -58.5 | -13.9 | 0 | 0 | 0 | 110.9 | R70 A161 W168 | R70-D166 IonicContact CZ-OD1 3.79Å; R70-D166 VanDerWaalsContact CZ-OD1 3.25Å; R70-D166 IonicContact NH1-OD1 3Å; R70-D166 PolarHBondContact NH1-OD1 3.31Å; R70-D166 IonicContact NH2-OD1 4Å; R70-D166 PolarHBondContact NH2-OD1 3.15Å; A161-D166 PolarHBondContact O-N 3.49Å; D166-W168 PolarHBondContact O-N 3.06Å |
| 167 | T | 86.6 | Confident | 91.5 | Very high | 107 Ų | 107 | 62.7 Ų | 62.7 | 66% | 0.656 | 32% | 0.317 | S | S | * | . | P | Polyproline II helix | trans | -74.4 | 125.6 | 173 | -53.3 | 0 | 0 | 0 | 0 | 110 | ||
| 168 | W | 87.8 | Confident | 91.5 | Very high | 139 Ų | 139 | 62.9 Ų | 62.9 | 53% | 0.527 | 32% | 0.318 | S | S | . | . | P | Polyproline II helix | trans | -65.5 | 137.9 | 178 | -84.3 | 65.2 | 0 | 0 | 0 | 112.5 | T162 D166 S172 A173 | T162-W168 PolarHBondContact O-NE1 3.24Å; T162-W168 VanDerWaalsContact O-NE1 3.14Å; D166-W168 PolarHBondContact O-N 3.06Å; W168-S172 WeakPolarHBondContact CA-OG 3.38Å; W168-S172 VanDerWaalsContact CE3-CB 3.49Å; W168-A173 HydrophobicContact CZ3-CB 4.27Å |
| 169 | R | 86.3 | Confident | 91.6 | Very high | 97 Ų | 97 | 62.8 Ų | 62.8 | 37% | 0.366 | 32% | 0.317 | S | S | . | . | trans | -132.1 | 172.6 | -179.4 | -59.6 | 175.2 | -152.8 | 148.5 | 8.5 | 108.8 | E97 D171 S172 | E97-R169 IonicContact OE1-CZ 2.68Å; E97-R169 IonicContact OE1-NH1 3.6Å; E97-R169 IonicContact OE1-NH2 2.72Å; E97-R169 PolarHBondContact OE1-NH2 3.04Å; E97-R169 IonicContact OE2-CZ 3.34Å; E97-R169 IonicContact OE2-NH2 2.91Å; E97-R169 PolarHBondContact OE2-NH2 3.18Å; R169-D171 VanDerWaalsContact CB-OD1 3.27Å; R169-D171 WeakPolarHBondContact CB-OD1 3.39Å; R169-D171 PolarHBondContact O-N 2.92Å; R169-D171 VanDerWaalsContact O-N 3.1Å; R169-S172 PolarHBondContact N-OG 3.49Å; R169-S172 WeakPolarHBondContact O-CB 3.25Å; R169-S172 PolarHBondContact O-N 3.25Å; R169-S172 PolarHBondContact O-OG 3.45Å | ||
| 170 | K | 83.8 | Confident | 91.7 | Very high | 215 Ų | 215 | 65.3 Ų | 65.3 | 94% | 0.935 | 33% | 0.329 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.6 | -26.4 | -177.1 | -64.6 | -173.7 | 178.8 | -177.4 | 0 | 113.4 | ||
| 171 | D | 87.6 | Confident | 91.7 | Very high | 59 Ų | 59 | 60.9 Ų | 60.9 | 32% | 0.316 | 31% | 0.314 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.2 | -3.4 | 180 | 62.5 | -43.2 | 0 | 0 | 0 | 113.9 | R169 A173 V174 M175 | R169-D171 VanDerWaalsContact CB-OD1 3.27Å; R169-D171 WeakPolarHBondContact CB-OD1 3.39Å; R169-D171 PolarHBondContact O-N 2.92Å; R169-D171 VanDerWaalsContact O-N 3.1Å; D171-A173 VanDerWaalsContact C-N 3.33Å; D171-A173 PolarHBondContact O-N 3.08Å; D171-V174 WeakPolarHBondContact O-CB 3.36Å; D171-V174 PolarHBondContact O-N 2.77Å; D171-V174 VanDerWaalsContact O-N 3.08Å; D171-M175 PolarHBondContact O-N 3.41Å |
| 172 | S | 89.1 | Confident | 91.8 | Very high | 11 Ų | 11 | 61.3 Ų | 61.3 | 8% | 0.077 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -59.5 | -39.5 | -175.6 | -70.6 | 0 | 0 | 0 | 0 | 113.4 | W168 R169 V174 M175 V176 | W168-S172 WeakPolarHBondContact CA-OG 3.38Å; W168-S172 VanDerWaalsContact CE3-CB 3.49Å; R169-S172 PolarHBondContact N-OG 3.49Å; R169-S172 WeakPolarHBondContact O-CB 3.25Å; R169-S172 PolarHBondContact O-N 3.25Å; R169-S172 PolarHBondContact O-OG 3.45Å; S172-V174 VanDerWaalsContact C-N 3.34Å; S172-V174 PolarHBondContact O-N 3.35Å; S172-M175 PolarHBondContact O-N 2.93Å; S172-V176 WeakPolarHBondContact O-CG2 3.41Å; S172-V176 PolarHBondContact O-N 2.85Å |
| 173 | A | 92.8 | Very high | 92 | Very high | 55 Ų | 55 | 62.6 Ų | 62.6 | 46% | 0.455 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -62.6 | -42.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | W168 D171 M175 V176 V177 | W168-A173 HydrophobicContact CZ3-CB 4.27Å; D171-A173 VanDerWaalsContact C-N 3.33Å; D171-A173 PolarHBondContact O-N 3.08Å; A173-M175 VanDerWaalsContact C-N 3.32Å; A173-M175 PolarHBondContact O-N 2.75Å; A173-V176 PolarHBondContact O-N 2.91Å; A173-V177 WeakPolarHBondContact O-CG2 3.13Å; A173-V177 PolarHBondContact O-N 3.38Å |
| 174 | V | 94.5 | Very high | 92.2 | Very high | 40 Ų | 40 | 60.5 Ų | 60.5 | 24% | 0.242 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -65.2 | -38.5 | 176.9 | -177.5 | 0 | 0 | 0 | 0 | 110.3 | D171 S172 V177 H178 M290 Y293 W294 | D171-V174 WeakPolarHBondContact O-CB 3.36Å; D171-V174 PolarHBondContact O-N 2.77Å; D171-V174 VanDerWaalsContact O-N 3.08Å; S172-V174 VanDerWaalsContact C-N 3.34Å; S172-V174 PolarHBondContact O-N 3.35Å; V174-V177 PolarHBondContact O-N 2.87Å; V174-H178 WeakPolarHBondContact O-CB 3.43Å; V174-H178 PolarHBondContact O-N 2.94Å; V174-M290 HydrophobicContact CG1-CE 3.52Å; V174-M290 WeakPolarHBondContact O-CE 3.46Å; V174-Y293 HydrophobicContact CG1-CD1 4.36Å; V174-Y293 HydrophobicContact CG1-CE1 4.12Å; V174-Y293 HydrophobicContact CG2-CE1 4.41Å; V174-W294 HydrophobicContact CG1-CZ2 3.9Å |
| 175 | M | 93.1 | Very high | 92.4 | Very high | 48 Ų | 48 | 56.1 Ų | 56.1 | 24% | 0.236 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -64.7 | -36.3 | 173.9 | -72.1 | -58.9 | -56.5 | 0 | 0 | 113.3 | D171 S172 A173 H178 H179 W294 | D171-M175 PolarHBondContact O-N 3.41Å; S172-M175 PolarHBondContact O-N 2.93Å; A173-M175 VanDerWaalsContact C-N 3.32Å; A173-M175 PolarHBondContact O-N 2.75Å; M175-H178 WeakPolarHBondContact O-CB 3.29Å; M175-H178 PolarHBondContact O-N 3.17Å; M175-H179 VanDerWaalsContact O-CG 3.26Å; M175-H179 PolarHBondContact O-N 2.95Å; M175-H179 PolarHBondContact O-ND1 3.46Å; M175-W294 HydrophobicContact SD-CH2 4.05Å; M175-W294 HydrophobicContact SD-CZ2 3.47Å; M175-W294 WeakPolarHBondContact SD-CZ2 3.31Å |
| 176 | V | 95 | Very high | 92.7 | Very high | 26 Ų | 26 | 53.5 Ų | 53.5 | 16% | 0.158 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -66.2 | -45.6 | 173.7 | 173.3 | 0 | 0 | 0 | 0 | 110.7 | T162 V163 S172 A173 H178 H179 I180 | T162-V176 HydrophobicContact CG2-CG2 3.61Å; V163-V176 HydrophobicContact CG2-CG2 4.46Å; S172-V176 WeakPolarHBondContact O-CG2 3.41Å; S172-V176 PolarHBondContact O-N 2.85Å; A173-V176 PolarHBondContact O-N 2.91Å; V176-H178 VanDerWaalsContact C-N 3.26Å; V176-H178 PolarHBondContact O-N 2.84Å; V176-H179 PolarHBondContact O-N 3.2Å; V176-I180 HydrophobicContact CG1-CD1 4.02Å; V176-I180 WeakPolarHBondContact O-CG1 3.25Å; V176-I180 PolarHBondContact O-N 2.97Å |
| 177 | V | 96 | Very high | 92.9 | Very high | 76 Ų | 76 | 55.1 Ų | 55.1 | 46% | 0.461 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -58.6 | -41.6 | 174.7 | 172.4 | 0 | 0 | 0 | 0 | 110.8 | A173 V174 I180 I181 | A173-V177 WeakPolarHBondContact O-CG2 3.13Å; A173-V177 PolarHBondContact O-N 3.38Å; V174-V177 PolarHBondContact O-N 2.87Å; V177-I180 PolarHBondContact O-N 3.26Å; V177-I181 HydrophobicContact CG1-CD1 3.79Å; V177-I181 HydrophobicContact CG1-CG1 4.45Å; V177-I181 WeakPolarHBondContact O-CG1 3.49Å; V177-I181 PolarHBondContact O-N 3.39Å |
| 178 | H | 95.9 | Very high | 93.1 | Very high | 8 Ų | 8 | 52.4 Ų | 52.4 | 4% | 0.037 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -56.8 | -52.6 | 174.5 | 175.3 | 67 | 0 | 0 | 0 | 111.4 | V174 M175 V176 I180 I181 T182 M290 W294 | V174-H178 WeakPolarHBondContact O-CB 3.43Å; V174-H178 PolarHBondContact O-N 2.94Å; M175-H178 WeakPolarHBondContact O-CB 3.29Å; M175-H178 PolarHBondContact O-N 3.17Å; V176-H178 VanDerWaalsContact C-N 3.26Å; V176-H178 PolarHBondContact O-N 2.84Å; H178-I180 VanDerWaalsContact C-N 3.25Å; H178-I180 PolarHBondContact O-N 3.15Å; H178-I181 PolarHBondContact O-N 3.33Å; H178-I181 VanDerWaalsContact O-N 3.12Å; H178-T182 WeakPolarHBondContact CE1-CG2 3.24Å; H178-T182 WeakPolarHBondContact O-CG2 3.47Å; H178-T182 PolarHBondContact O-N 2.93Å; H178-T182 PolarHBondContact O-OG1 2.85Å; H178-T182 VanDerWaalsContact O-OG1 3.12Å; H178-M290 HydrophobicContact CB-CE 3.47Å; H178-M290 VanDerWaalsContact CB-CE 3.47Å; H178-M290 HydrophobicContact CB-SD 4.25Å; H178-W294 HydrophobicContact CB-CH2 3.77Å; H178-W294 HydrophobicContact CB-CZ2 4.4Å; H178-W294 AromaticContact CG-CH2 3.64Å; H178-W294 AromaticContact ND1-CH2 3.68Å; H178-W294 AromaticContact ND1-CZ3 3.98Å |
| 179 | H | 95.9 | Very high | 93.4 | Very high | 6 Ų | 6 | 45.9 Ų | 45.9 | 3% | 0.028 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -61 | -34.8 | -179.6 | -64.8 | 160.2 | 0 | 0 | 0 | 112.6 | Y155 I159 M175 V176 T182 L183 | Y155-H179 HydrophobicContact CD1-CB 4.33Å; Y155-H179 AromaticContact CD1-CD2 3.59Å; Y155-H179 AromaticContact CE1-CD2 3.71Å; I159-H179 HydrophobicContact CD1-CB 4.1Å; I159-H179 HydrophobicContact CG1-CB 3.44Å; I159-H179 VanDerWaalsContact CG1-CB 3.44Å; M175-H179 VanDerWaalsContact O-CG 3.26Å; M175-H179 PolarHBondContact O-N 2.95Å; M175-H179 PolarHBondContact O-ND1 3.46Å; V176-H179 PolarHBondContact O-N 3.2Å; H179-T182 WeakPolarHBondContact CA-OG1 3.32Å; H179-T182 PolarHBondContact O-OG1 2.93Å; H179-L183 WeakPolarHBondContact O-CB 3.43Å; H179-L183 PolarHBondContact O-N 3.27Å |
| 180 | I | 95.9 | Very high | 93.6 | Very high | 95 Ų | 95 | 42.4 Ų | 42.4 | 49% | 0.487 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -66.4 | -46.5 | 174.7 | -66.8 | 166.2 | 0 | 0 | 0 | 110.4 | I159 V176 V177 H178 A184 | I159-I180 HydrophobicContact CD1-CG1 4.3Å; V176-I180 HydrophobicContact CG1-CD1 4.02Å; V176-I180 WeakPolarHBondContact O-CG1 3.25Å; V176-I180 PolarHBondContact O-N 2.97Å; V177-I180 PolarHBondContact O-N 3.26Å; H178-I180 VanDerWaalsContact C-N 3.25Å; H178-I180 PolarHBondContact O-N 3.15Å; I180-A184 WeakPolarHBondContact O-CB 3.17Å; I180-A184 PolarHBondContact O-N 2.92Å |
| 181 | I | 96.6 | Very high | 93.9 | Very high | 26 Ų | 26 | 32.4 Ų | 32.4 | 13% | 0.133 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -64.2 | -45.3 | 178.7 | -70.1 | 169.3 | 0 | 0 | 0 | 111 | V177 H178 A184 L185 L283 A286 M290 | V177-I181 HydrophobicContact CG1-CD1 3.79Å; V177-I181 HydrophobicContact CG1-CG1 4.45Å; V177-I181 WeakPolarHBondContact O-CG1 3.49Å; V177-I181 PolarHBondContact O-N 3.39Å; H178-I181 PolarHBondContact O-N 3.33Å; H178-I181 VanDerWaalsContact O-N 3.12Å; I181-A184 PolarHBondContact O-N 3.45Å; I181-L185 HydrophobicContact CG2-CD1 4.1Å; I181-L185 WeakPolarHBondContact O-CG 3.47Å; I181-L185 PolarHBondContact O-N 3.41Å; I181-L283 HydrophobicContact CG2-CD2 4.35Å; I181-A286 HydrophobicContact CD1-CB 4.11Å; I181-M290 HydrophobicContact CD1-SD 3.86Å |
| 182 | T | 96.1 | Very high | 94 | Very high | 11 Ų | 11 | 29.8 Ų | 29.8 | 7% | 0.067 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -68.2 | -38.8 | 179.7 | 55.5 | 0 | 0 | 0 | 0 | 111.8 | Y155 H178 H179 A184 L185 I186 L287 | Y155-T182 WeakPolarHBondContact CD1-OG1 3.47Å; Y155-T182 HydrophobicContact CE1-CG2 4.21Å; Y155-T182 WeakPolarHBondContact CE1-OG1 3.36Å; H178-T182 WeakPolarHBondContact CE1-CG2 3.24Å; H178-T182 WeakPolarHBondContact O-CG2 3.47Å; H178-T182 PolarHBondContact O-N 2.93Å; H178-T182 PolarHBondContact O-OG1 2.85Å; H178-T182 VanDerWaalsContact O-OG1 3.12Å; H179-T182 WeakPolarHBondContact CA-OG1 3.32Å; H179-T182 PolarHBondContact O-OG1 2.93Å; T182-A184 VanDerWaalsContact C-N 3.34Å; T182-L185 PolarHBondContact O-N 3.08Å; T182-I186 VanDerWaalsContact O-CG1 3.3Å; T182-I186 WeakPolarHBondContact O-CG1 3.29Å; T182-I186 PolarHBondContact O-N 3.43Å; T182-L287 HydrophobicContact CG2-CD1 4.01Å |
| 183 | L | 96.1 | Very high | 94.1 | Very high | 34 Ų | 34 | 30.4 Ų | 30.4 | 18% | 0.178 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -63.8 | -41.6 | 173.8 | -175.1 | 61.1 | 0 | 0 | 0 | 111 | F59 I159 H179 I186 S187 | F59-L183 HydrophobicContact CE2-CD1 3.62Å; F59-L183 HydrophobicContact CZ-CD1 3.75Å; F59-L183 HydrophobicContact CZ-CD2 4.2Å; I159-L183 HydrophobicContact CD1-CD2 4.06Å; H179-L183 WeakPolarHBondContact O-CB 3.43Å; H179-L183 PolarHBondContact O-N 3.27Å; L183-I186 PolarHBondContact O-N 3.27Å; L183-S187 WeakPolarHBondContact O-CB 3.38Å; L183-S187 PolarHBondContact O-N 3.42Å; L183-S187 PolarHBondContact O-OG 3.49Å; L183-S187 VanDerWaalsContact O-OG 3.08Å |
| 184 | A | 95.4 | Very high | 94 | Very high | 25 Ų | 25 | 28.1 Ų | 28.1 | 21% | 0.207 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -60.9 | -45.1 | 172.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | I180 I181 T182 I186 S187 F188 L283 | I180-A184 WeakPolarHBondContact O-CB 3.17Å; I180-A184 PolarHBondContact O-N 2.92Å; I181-A184 PolarHBondContact O-N 3.45Å; T182-A184 VanDerWaalsContact C-N 3.34Å; A184-I186 PolarHBondContact O-N 3.05Å; A184-S187 PolarHBondContact O-N 2.87Å; A184-F188 WeakPolarHBondContact O-CB 3.44Å; A184-F188 WeakPolarHBondContact O-CD2 3.22Å; A184-F188 PolarHBondContact O-N 3.18Å; A184-L283 HydrophobicContact CB-CD1 4.01Å |
| 185 | L | 96.6 | Very high | 93.7 | Very high | 12 Ų | 12 | 26.3 Ų | 26.3 | 6% | 0.063 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -58.5 | -45.9 | 175.6 | -79.3 | 167.4 | 0 | 0 | 0 | 112 | I181 T182 S189 F280 L283 L284 L287 | I181-L185 HydrophobicContact CG2-CD1 4.1Å; I181-L185 WeakPolarHBondContact O-CG 3.47Å; I181-L185 PolarHBondContact O-N 3.41Å; T182-L185 PolarHBondContact O-N 3.08Å; L185-S189 WeakPolarHBondContact O-CB 3.07Å; L185-S189 PolarHBondContact O-N 2.92Å; L185-F280 HydrophobicContact CD2-CD2 4.02Å; L185-F280 HydrophobicContact CD2-CE2 3.72Å; L185-F280 HydrophobicContact CD2-CZ 4.15Å; L185-L283 HydrophobicContact CD1-CB 4.39Å; L185-L283 HydrophobicContact CD2-CB 3.49Å; L185-L283 VanDerWaalsContact CD2-CB 3.49Å; L185-L283 HydrophobicContact CD2-CD1 4.17Å; L185-L283 HydrophobicContact CG-CB 3.81Å; L185-L283 HydrophobicContact CG-CD1 4.26Å; L185-L284 HydrophobicContact CD1-CD2 4.16Å; L185-L284 HydrophobicContact CD2-CD2 3.74Å; L185-L284 HydrophobicContact CD2-CG 3.88Å; L185-L287 HydrophobicContact CD1-CB 4.32Å; L185-L287 HydrophobicContact CD1-CD2 3.83Å |
| 186 | I | 95.6 | Very high | 93.6 | Very high | 17 Ų | 17 | 25.3 Ų | 25.3 | 9% | 0.087 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -63.5 | -50.3 | 178.4 | -67.5 | 167.4 | 0 | 0 | 0 | 110.4 | Y148 Q151 Y155 T182 L183 A184 S189 D190 L202 | Y148-I186 HydrophobicContact CD1-CG2 3.76Å; Y148-I186 HydrophobicContact CE1-CG2 4.2Å; Q151-I186 HydrophobicContact CB-CD1 4.41Å; Q151-I186 HydrophobicContact CG-CD1 4Å; Y155-I186 HydrophobicContact CD2-CD1 4Å; Y155-I186 HydrophobicContact CE2-CD1 4.45Å; T182-I186 VanDerWaalsContact O-CG1 3.3Å; T182-I186 WeakPolarHBondContact O-CG1 3.29Å; T182-I186 PolarHBondContact O-N 3.43Å; L183-I186 PolarHBondContact O-N 3.27Å; A184-I186 PolarHBondContact O-N 3.05Å; I186-S189 PolarHBondContact O-N 3.47Å; I186-D190 WeakPolarHBondContact O-CB 3.13Å; I186-D190 PolarHBondContact O-N 3.39Å; I186-L202 HydrophobicContact CD1-CD2 4.39Å |
| 187 | S | 93.4 | Very high | 93.5 | Very high | 50 Ų | 50 | 24.1 Ų | 24.1 | 35% | 0.35 | 13% | 0.133 | S | C | . | . | H | α-helix | trans | -63.9 | -44.2 | -177.7 | -63.1 | 0 | 0 | 0 | 0 | 112.9 | L183 A184 D190 A191 | L183-S187 WeakPolarHBondContact O-CB 3.38Å; L183-S187 PolarHBondContact O-N 3.42Å; L183-S187 PolarHBondContact O-OG 3.49Å; L183-S187 VanDerWaalsContact O-OG 3.08Å; A184-S187 PolarHBondContact O-N 2.87Å; S187-D190 PolarHBondContact O-N 3.33Å; S187-A191 VanDerWaalsContact O-CB 3.29Å; S187-A191 WeakPolarHBondContact O-CB 3.3Å; S187-A191 PolarHBondContact O-N 3.28Å |
| 188 | F | 91.7 | Very high | 93.4 | Very high | 51 Ų | 51 | 20.9 Ų | 20.9 | 22% | 0.224 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -71.2 | -38 | 177.7 | -81.8 | -103.6 | 0 | 0 | 0 | 111.4 | L45 A184 D190 A191 F192 F276 F279 F280 | L45-F188 HydrophobicContact CD1-CE1 4.49Å; A184-F188 WeakPolarHBondContact O-CB 3.44Å; A184-F188 WeakPolarHBondContact O-CD2 3.22Å; A184-F188 PolarHBondContact O-N 3.18Å; F188-D190 VanDerWaalsContact C-N 3.29Å; F188-D190 PolarHBondContact O-N 3.42Å; F188-A191 PolarHBondContact O-N 2.89Å; F188-F192 HydrophobicContact CB-CD2 4.36Å; F188-F192 HydrophobicContact CD1-CD2 4.02Å; F188-F192 AromaticContact CD1-CE2 3.5Å; F188-F192 HydrophobicContact CD1-CE2 3.5Å; F188-F192 VanDerWaalsContact CD1-CE2 3.5Å; F188-F192 HydrophobicContact CE1-CE2 4.02Å; F188-F192 HydrophobicContact CG-CE2 4.41Å; F188-F192 VanDerWaalsContact O-CD2 3.26Å; F188-F192 WeakPolarHBondContact O-CD2 3.08Å; F188-F192 PolarHBondContact O-N 3.02Å; F188-F276 HydrophobicContact CE1-CD1 4.39Å; F188-F279 AromaticContact CD1-CD1 3.85Å; F188-F279 HydrophobicContact CD1-CD1 3.85Å; F188-F279 AromaticContact CD1-CE1 3.61Å; F188-F279 HydrophobicContact CD1-CE1 3.61Å; F188-F279 AromaticContact CD2-CE1 3.9Å; F188-F279 HydrophobicContact CD2-CE1 3.9Å; F188-F279 AromaticContact CE1-CD1 3.86Å; F188-F279 HydrophobicContact CE1-CD1 3.86Å; F188-F279 AromaticContact CE1-CE1 3.49Å; F188-F279 HydrophobicContact CE1-CE1 3.49Å; F188-F279 VanDerWaalsContact CE1-CE1 3.49Å; F188-F279 HydrophobicContact CE1-CZ 4.38Å; F188-F279 AromaticContact CE2-CE1 3.74Å; F188-F279 HydrophobicContact CE2-CE1 3.74Å; F188-F279 HydrophobicContact CE2-CZ 4.19Å; F188-F279 HydrophobicContact CG-CD1 4.39Å; F188-F279 AromaticContact CG-CE1 3.85Å; F188-F279 HydrophobicContact CG-CE1 3.85Å; F188-F279 HydrophobicContact CZ-CD1 4.36Å; F188-F279 AromaticContact CZ-CE1 3.55Å; F188-F279 HydrophobicContact CZ-CE1 3.55Å; F188-F279 HydrophobicContact CZ-CZ 4.05Å; F188-F280 HydrophobicContact CB-CD2 4.45Å |
| 189 | S | 93.8 | Very high | 93.4 | Very high | 1 Ų | 1 | 20.6 Ų | 20.6 | 1% | 0.007 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -59.8 | -41.5 | 174.2 | -178.8 | 0 | 0 | 0 | 0 | 111.5 | Y148 L185 I186 R193 Y194 | Y148-S189 PolarHBondContact OH-OG 2.66Å; L185-S189 WeakPolarHBondContact O-CB 3.07Å; L185-S189 PolarHBondContact O-N 2.92Å; I186-S189 PolarHBondContact O-N 3.47Å; S189-R193 CarbonylContact O-C 3.53Å; S189-R193 WeakPolarHBondContact O-CA 3.21Å; S189-R193 PolarHBondContact O-N 2.91Å; S189-Y194 PolarHBondContact O-N 3.18Å; S189-Y194 PolarHBondContact OG-O 2.96Å |
| 190 | D | 91.6 | Very high | 93.3 | Very high | 25 Ų | 25 | 20.3 Ų | 20.3 | 13% | 0.134 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -69.1 | -47.6 | 176.3 | -172.3 | 39.9 | 0 | 0 | 0 | 112.2 | Y148 I186 S187 F188 F192 R193 | Y148-D190 HydrophobicContact CD1-CB 3.87Å; Y148-D190 HydrophobicContact CE1-CB 4.15Å; I186-D190 WeakPolarHBondContact O-CB 3.13Å; I186-D190 PolarHBondContact O-N 3.39Å; S187-D190 PolarHBondContact O-N 3.33Å; F188-D190 VanDerWaalsContact C-N 3.29Å; F188-D190 PolarHBondContact O-N 3.42Å; D190-F192 VanDerWaalsContact C-N 3.34Å; D190-F192 PolarHBondContact O-N 2.99Å; D190-R193 WeakPolarHBondContact O-CD 3.45Å; D190-R193 PolarHBondContact O-N 2.83Å; D190-R193 PolarHBondContact O-NH1 3.47Å; D190-R193 IonicContact OD1-NH1 3.69Å; D190-R193 PolarHBondContact OD1-NH1 3.05Å; D190-R193 VanDerWaalsContact OD1-NH1 3.16Å |
| 191 | A | 90.1 | Very high | 93.3 | Very high | 5 Ų | 5 | 16.6 Ų | 16.6 | 4% | 0.041 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -57.4 | -44.1 | -178.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | N48 A49 Y50 I51 S187 F188 | N48-A191 VanDerWaalsContact O-O 3.11Å; A49-A191 HydrophobicContact CB-CB 4.14Å; Y50-A191 PolarHBondContact N-O 2.91Å; I51-A191 HydrophobicContact CD1-CB 3.79Å; I51-A191 HydrophobicContact CG1-CB 3.91Å; S187-A191 VanDerWaalsContact O-CB 3.29Å; S187-A191 WeakPolarHBondContact O-CB 3.3Å; S187-A191 PolarHBondContact O-N 3.28Å; F188-A191 PolarHBondContact O-N 2.89Å |
| 192 | F | 89 | Confident | 93.3 | Very high | 4 Ų | 4 | 16 Ų | 16 | 2% | 0.018 | 9% | 0.091 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -97.2 | 7.7 | -177.9 | -63.7 | -71.6 | 0 | 0 | 0 | 113.4 | L45 N48 A49 W134 F188 D190 Y194 P275 F276 | L45-F192 HydrophobicContact CD1-CZ 4.16Å; N48-F192 HydrophobicContact CB-CD1 3.82Å; N48-F192 HydrophobicContact CB-CE1 3.79Å; A49-F192 HydrophobicContact CB-CE1 4.36Å; A49-F192 HydrophobicContact CB-CZ 4.22Å; W134-F192 WeakPolarHBondContact CZ2-O 3.45Å; W134-F192 PolarHBondContact NE1-O 3.35Å; F188-F192 HydrophobicContact CB-CD2 4.36Å; F188-F192 HydrophobicContact CD1-CD2 4.02Å; F188-F192 AromaticContact CD1-CE2 3.5Å; F188-F192 HydrophobicContact CD1-CE2 3.5Å; F188-F192 VanDerWaalsContact CD1-CE2 3.5Å; F188-F192 HydrophobicContact CE1-CE2 4.02Å; F188-F192 HydrophobicContact CG-CE2 4.41Å; F188-F192 VanDerWaalsContact O-CD2 3.26Å; F188-F192 WeakPolarHBondContact O-CD2 3.08Å; F188-F192 PolarHBondContact O-N 3.02Å; D190-F192 VanDerWaalsContact C-N 3.34Å; D190-F192 PolarHBondContact O-N 2.99Å; F192-Y194 VanDerWaalsContact C-N 3.35Å; F192-Y194 HydrophobicContact CB-CD2 4.09Å; F192-Y194 HydrophobicContact CB-CE1 4.31Å; F192-Y194 HydrophobicContact CB-CE2 3.64Å; F192-Y194 HydrophobicContact CG-CE2 4.44Å; F192-Y194 PolarHBondContact O-N 3.47Å; F192-P275 HydrophobicContact CB-CG 4.36Å; F192-P275 HydrophobicContact CD1-CB 3.69Å; F192-P275 HydrophobicContact CD1-CG 3.48Å; F192-P275 VanDerWaalsContact CD1-CG 3.48Å; F192-P275 HydrophobicContact CE1-CB 3.83Å; F192-P275 HydrophobicContact CE1-CG 4.14Å; F192-P275 HydrophobicContact CG-CG 4.2Å; F192-F276 AromaticContact CE1-CD2 3.62Å; F192-F276 HydrophobicContact CE1-CD2 3.62Å; F192-F276 HydrophobicContact CE1-CE2 4.04Å; F192-F276 HydrophobicContact CE2-CB 4.36Å; F192-F276 AromaticContact CE2-CD2 3.72Å; F192-F276 HydrophobicContact CE2-CD2 3.72Å; F192-F276 HydrophobicContact CE2-CE2 4.26Å; F192-F276 HydrophobicContact CE2-CG 4.14Å; F192-F276 AromaticContact CZ-CD2 3.14Å; F192-F276 HydrophobicContact CZ-CD2 3.14Å; F192-F276 AromaticContact CZ-CE2 3.44Å; F192-F276 HydrophobicContact CZ-CE2 3.44Å; F192-F276 VanDerWaalsContact CZ-CE2 3.44Å; F192-F276 HydrophobicContact CZ-CG 4.01Å; F192-F276 HydrophobicContact CZ-CZ 4.48Å |
| 193 | R | 90.6 | Very high | 93.3 | Very high | 24 Ų | 24 | 15.8 Ų | 15.8 | 9% | 0.091 | 9% | 0.089 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 60.6 | 37.1 | 176.7 | -49.6 | -61.4 | -179.1 | -153.5 | 7.4 | 114 | Y50 W134 M138 V140 S189 D190 H195 | Y50-R193 VanDerWaalsContact CB-NH2 3.33Å; Y50-R193 PolarHBondContact O-NH2 3.02Å; W134-R193 PolarHBondContact NE1-O 3.33Å; M138-R193 HydrophobicContact CG-CB 3.75Å; M138-R193 HydrophobicContact CG-CG 4.07Å; M138-R193 VanDerWaalsContact O-CD 3.26Å; M138-R193 WeakPolarHBondContact O-CD 3.35Å; M138-R193 PolarHBondContact O-NE 3.42Å; M138-R193 HydrophobicContact SD-CB 4.46Å; V140-R193 VanDerWaalsContact CG2-CD 3.45Å; S189-R193 CarbonylContact O-C 3.53Å; S189-R193 WeakPolarHBondContact O-CA 3.21Å; S189-R193 PolarHBondContact O-N 2.91Å; D190-R193 WeakPolarHBondContact O-CD 3.45Å; D190-R193 PolarHBondContact O-N 2.83Å; D190-R193 PolarHBondContact O-NH1 3.47Å; D190-R193 IonicContact OD1-NH1 3.69Å; D190-R193 PolarHBondContact OD1-NH1 3.05Å; D190-R193 VanDerWaalsContact OD1-NH1 3.16Å; R193-H195 PolarHBondContact O-N 3.33Å; R193-H195 PolarHBondContact O-ND1 3.12Å |
| 194 | Y | 90.2 | Very high | 93.3 | Very high | 6 Ų | 6 | 14.1 Ų | 14.1 | 2% | 0.024 | 8% | 0.081 | C | C | . | . | trans | -84.5 | 28.3 | 167.6 | -54 | -34.1 | 0 | 0 | 0 | 112.9 | F131 W134 S189 F192 N196 V197 G198 I274 P275 F280 | F131-Y194 AromaticContact CE1-CD1 3.79Å; F131-Y194 HydrophobicContact CE1-CD1 3.79Å; F131-Y194 HydrophobicContact CE1-CE1 4.05Å; F131-Y194 HydrophobicContact CE1-CG 4.46Å; W134-Y194 HydrophobicContact CD2-CE1 4.44Å; W134-Y194 AromaticContact CE2-CE1 3.62Å; W134-Y194 AromaticContact CZ2-CE1 3.84Å; W134-Y194 HydrophobicContact CZ2-CE1 3.84Å; W134-Y194 AromaticContact NE1-CD1 3.55Å; W134-Y194 AromaticContact NE1-CE1 3.41Å; S189-Y194 PolarHBondContact O-N 3.18Å; S189-Y194 PolarHBondContact OG-O 2.96Å; F192-Y194 VanDerWaalsContact C-N 3.35Å; F192-Y194 HydrophobicContact CB-CD2 4.09Å; F192-Y194 HydrophobicContact CB-CE1 4.31Å; F192-Y194 HydrophobicContact CB-CE2 3.64Å; F192-Y194 HydrophobicContact CG-CE2 4.44Å; F192-Y194 PolarHBondContact O-N 3.47Å; Y194-N196 VanDerWaalsContact C-N 3.26Å; Y194-N196 PolarHBondContact O-N 2.61Å; Y194-N196 VanDerWaalsContact O-N 3.14Å; Y194-V197 WeakPolarHBondContact O-CB 3.5Å; Y194-V197 PolarHBondContact O-N 3.17Å; Y194-G198 PolarHBondContact O-N 2.9Å; Y194-G198 VanDerWaalsContact O-N 3.14Å; Y194-I274 HydrophobicContact CE1-CG2 3.9Å; Y194-I274 WeakPolarHBondContact OH-CG2 3.33Å; Y194-P275 WeakPolarHBondContact OH-CD 3.19Å; Y194-P275 VanDerWaalsContact OH-CG 3.31Å; Y194-P275 WeakPolarHBondContact OH-CG 3.1Å; Y194-P275 PolarHBondContact OH-O 3.24Å; Y194-F280 HydrophobicContact CD2-CD1 4.25Å; Y194-F280 HydrophobicContact CD2-CD2 4.29Å; Y194-F280 HydrophobicContact CD2-CE1 4.28Å; Y194-F280 HydrophobicContact CD2-CE2 4.34Å; Y194-F280 HydrophobicContact CD2-CG 4.25Å; Y194-F280 HydrophobicContact CD2-CZ 4.33Å | ||
| 195 | H | 89.9 | Confident | 93.3 | Very high | 3 Ų | 3 | 13.3 Ų | 13.3 | 1% | 0.014 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -58.9 | -37.5 | -165.3 | 53 | -88.7 | 0 | 0 | 0 | 112.9 | V140 I144 Y148 R193 G198 I199 | V140-H195 HydrophobicContact CG1-CB 4.22Å; I144-H195 HydrophobicContact CG2-CB 3.75Å; Y148-H195 HydrophobicContact CE2-CB 4.11Å; Y148-H195 WeakPolarHBondContact OH-CA 3.25Å; Y148-H195 PolarHBondContact OH-O 3.11Å; R193-H195 PolarHBondContact O-N 3.33Å; R193-H195 PolarHBondContact O-ND1 3.12Å; H195-G198 PolarHBondContact O-N 2.73Å; H195-I199 PolarHBondContact O-N 2.88Å |
| 196 | N | 90.9 | Very high | 93.3 | Very high | 26 Ų | 26 | 12.7 Ų | 12.7 | 14% | 0.139 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -59 | -46.3 | 174.6 | -63.8 | -24.1 | 0 | 0 | 0 | 112.9 | F123 V130 Y194 G198 I199 L200 | F123-N196 HydrophobicContact CD1-CB 3.99Å; F123-N196 HydrophobicContact CE1-CB 3.98Å; F123-N196 WeakPolarHBondContact CE2-O 3.18Å; F123-N196 HydrophobicContact CG-CB 4.31Å; F123-N196 HydrophobicContact CZ-CB 4.3Å; V130-N196 HydrophobicContact CB-CB 4.13Å; V130-N196 HydrophobicContact CG1-CB 4.27Å; Y194-N196 VanDerWaalsContact C-N 3.26Å; Y194-N196 PolarHBondContact O-N 2.61Å; Y194-N196 VanDerWaalsContact O-N 3.14Å; N196-G198 VanDerWaalsContact C-N 3.34Å; N196-G198 PolarHBondContact O-N 3.33Å; N196-I199 PolarHBondContact O-N 3.41Å; N196-L200 PolarHBondContact O-N 3.44Å |
| 197 | V | 92.2 | Very high | 93.3 | Very high | 2 Ų | 2 | 12.8 Ų | 12.8 | 1% | 0.012 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -61.3 | -46.6 | 176.4 | 180 | 0 | 0 | 0 | 0 | 109.7 | V130 F131 Y194 I199 L200 V201 V259 T263 F280 | V130-V197 HydrophobicContact CB-CG2 3.64Å; V130-V197 HydrophobicContact CG1-CG2 4.21Å; V130-V197 HydrophobicContact CG2-CG2 3.54Å; F131-V197 HydrophobicContact CE1-CG2 4.42Å; F131-V197 HydrophobicContact CE2-CG2 3.92Å; F131-V197 HydrophobicContact CZ-CG2 3.77Å; Y194-V197 WeakPolarHBondContact O-CB 3.5Å; Y194-V197 PolarHBondContact O-N 3.17Å; V197-I199 PolarHBondContact O-N 3.46Å; V197-L200 WeakPolarHBondContact O-CB 3.19Å; V197-L200 PolarHBondContact O-N 3.45Å; V197-L200 VanDerWaalsContact O-N 3.15Å; V197-V201 WeakPolarHBondContact O-CG2 3.24Å; V197-V201 PolarHBondContact O-N 3.05Å; V197-V259 HydrophobicContact CG1-CG1 3.77Å; V197-T263 HydrophobicContact CG1-CG2 3.62Å; V197-T263 HydrophobicContact CG2-CG2 4.28Å; V197-F280 HydrophobicContact CG1-CE1 4.29Å |
| 198 | G | 94.2 | Very high | 93.5 | Very high | 8 Ų | 8 | 10.4 Ų | 10.4 | 8% | 0.082 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -67.6 | -33.6 | -177.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | Y148 Y194 H195 N196 L200 V201 L202 | Y148-G198 WeakPolarHBondContact OH-CA 3.1Å; Y148-G198 PolarHBondContact OH-N 3.07Å; Y194-G198 PolarHBondContact O-N 2.9Å; Y194-G198 VanDerWaalsContact O-N 3.14Å; H195-G198 PolarHBondContact O-N 2.73Å; N196-G198 VanDerWaalsContact C-N 3.34Å; N196-G198 PolarHBondContact O-N 3.33Å; G198-L200 VanDerWaalsContact C-N 3.26Å; G198-L200 PolarHBondContact O-N 3.48Å; G198-V201 WeakPolarHBondContact O-CA 3Å; G198-V201 WeakPolarHBondContact O-CB 3.08Å; G198-V201 PolarHBondContact O-N 3.45Å; G198-V201 VanDerWaalsContact O-N 3.08Å; G198-L202 VanDerWaalsContact O-CG 3.32Å; G198-L202 WeakPolarHBondContact O-CG 3.45Å; G198-L202 PolarHBondContact O-N 3.15Å |
| 199 | I | 94.8 | Very high | 93.6 | Very high | 1 Ų | 1 | 8.9 Ų | 8.9 | 1% | 0.005 | 5% | 0.048 | C | C | . | . | H | α-helix | trans | -58.5 | -41.4 | 171.2 | -67.6 | -56.6 | 0 | 0 | 0 | 111.1 | L115 L116 F123 I144 A147 Y148 H195 N196 V197 V201 L202 F203 | L115-I199 HydrophobicContact CD1-CD1 4.12Å; L116-I199 HydrophobicContact CD2-CG2 3.95Å; L116-I199 HydrophobicContact CG-CG2 4.15Å; F123-I199 HydrophobicContact CE2-CB 4.14Å; F123-I199 HydrophobicContact CE2-CG2 4.07Å; F123-I199 HydrophobicContact CZ-CB 4.17Å; F123-I199 HydrophobicContact CZ-CG2 4.13Å; I144-I199 HydrophobicContact CG1-CG1 4.33Å; I144-I199 HydrophobicContact CG2-CD1 4.08Å; I144-I199 HydrophobicContact CG2-CG1 3.92Å; A147-I199 HydrophobicContact CB-CD1 3.7Å; Y148-I199 HydrophobicContact CD2-CD1 4.04Å; Y148-I199 HydrophobicContact CE2-CD1 3.78Å; Y148-I199 HydrophobicContact CE2-CG1 4.07Å; H195-I199 PolarHBondContact O-N 2.88Å; N196-I199 PolarHBondContact O-N 3.41Å; V197-I199 PolarHBondContact O-N 3.46Å; I199-V201 VanDerWaalsContact C-N 3.34Å; I199-V201 PolarHBondContact O-N 2.89Å; I199-L202 HydrophobicContact CD1-CD1 4.48Å; I199-L202 PolarHBondContact O-N 2.5Å; I199-F203 WeakPolarHBondContact O-CB 3.37Å; I199-F203 PolarHBondContact O-N 3.35Å |
| 200 | L | 94.3 | Very high | 93.8 | Very high | 1 Ų | 1 | 9.9 Ų | 9.9 | 1% | 0.005 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -63 | -41.8 | 175.3 | -174 | 61.9 | 0 | 0 | 0 | 111.4 | F124 N196 V197 G198 L204 K258 V259 | F124-L200 HydrophobicContact CD2-CD1 3.6Å; F124-L200 HydrophobicContact CE2-CD1 4.19Å; N196-L200 PolarHBondContact O-N 3.44Å; V197-L200 WeakPolarHBondContact O-CB 3.19Å; V197-L200 PolarHBondContact O-N 3.45Å; V197-L200 VanDerWaalsContact O-N 3.15Å; G198-L200 VanDerWaalsContact C-N 3.26Å; G198-L200 PolarHBondContact O-N 3.48Å; L200-L204 HydrophobicContact CD1-CD1 4.16Å; L200-L204 HydrophobicContact CD1-CG 4.29Å; L200-L204 HydrophobicContact CG-CD1 4.01Å; L200-L204 WeakPolarHBondContact O-CB 3.26Å; L200-L204 WeakPolarHBondContact O-CG 3.27Å; L200-L204 PolarHBondContact O-N 2.85Å; L200-K258 HydrophobicContact CD2-CB 3.9Å; L200-V259 HydrophobicContact CB-CG2 4.34Å; L200-V259 HydrophobicContact CD2-CG2 3.7Å; L200-V259 HydrophobicContact CG-CG2 3.77Å |
| 201 | V | 96.1 | Very high | 94 | Very high | 16 Ų | 16 | 10.4 Ų | 10.4 | 10% | 0.097 | 6% | 0.056 | C | C | . | . | H | α-helix | trans | -59.9 | -48 | 174 | 178.9 | 0 | 0 | 0 | 0 | 111.2 | V197 G198 I199 L204 H205 F255 V259 L284 L287 | V197-V201 WeakPolarHBondContact O-CG2 3.24Å; V197-V201 PolarHBondContact O-N 3.05Å; G198-V201 WeakPolarHBondContact O-CA 3Å; G198-V201 WeakPolarHBondContact O-CB 3.08Å; G198-V201 PolarHBondContact O-N 3.45Å; G198-V201 VanDerWaalsContact O-N 3.08Å; I199-V201 VanDerWaalsContact C-N 3.34Å; I199-V201 PolarHBondContact O-N 2.89Å; V201-L204 PolarHBondContact O-N 3.4Å; V201-H205 PolarHBondContact O-N 3.4Å; V201-H205 VanDerWaalsContact O-N 3.08Å; V201-H205 PolarHBondContact O-ND1 3.01Å; V201-F255 HydrophobicContact CG1-CE2 4.35Å; V201-F255 HydrophobicContact CG2-CE2 4.04Å; V201-V259 HydrophobicContact CG2-CB 4.44Å; V201-V259 HydrophobicContact CG2-CG1 3.64Å; V201-V259 HydrophobicContact CG2-CG2 4.01Å; V201-L284 HydrophobicContact CG2-CD2 4.16Å; V201-L287 HydrophobicContact CG1-CD2 4.07Å |
| 202 | L | 95.9 | Very high | 94.3 | Very high | 13 Ų | 13 | 12.2 Ų | 12.2 | 7% | 0.068 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -60 | -50 | -179.7 | -64 | -172.9 | 0 | 0 | 0 | 111.6 | Q151 I186 G198 I199 L204 H205 D206 | Q151-L202 HydrophobicContact CB-CD1 3.89Å; Q151-L202 HydrophobicContact CG-CD1 3.77Å; Q151-L202 HydrophobicContact CG-CD2 3.59Å; Q151-L202 HydrophobicContact CG-CG 4.26Å; I186-L202 HydrophobicContact CD1-CD2 4.39Å; G198-L202 VanDerWaalsContact O-CG 3.32Å; G198-L202 WeakPolarHBondContact O-CG 3.45Å; G198-L202 PolarHBondContact O-N 3.15Å; I199-L202 HydrophobicContact CD1-CD1 4.48Å; I199-L202 PolarHBondContact O-N 2.5Å; L202-L204 VanDerWaalsContact C-N 3.33Å; L202-L204 PolarHBondContact O-N 2.97Å; L202-H205 PolarHBondContact O-N 3.28Å; L202-D206 WeakPolarHBondContact O-CB 3.37Å; L202-D206 PolarHBondContact O-N 3.41Å |
| 203 | F | 96.2 | Very high | 94.7 | Very high | 7 Ų | 7 | 12.4 Ų | 12.4 | 3% | 0.031 | 7% | 0.066 | C | C | . | . | H | α-helix | trans | -57.2 | -45.2 | 178 | 172.4 | -102.7 | 0 | 0 | 0 | 112.5 | W109 T113 L116 F117 F124 I199 H205 F250 | W109-F203 AromaticContact CD1-CD2 3.91Å; W109-F203 AromaticContact CE2-CE2 3.68Å; W109-F203 AromaticContact CZ2-CE2 3.81Å; W109-F203 HydrophobicContact CZ2-CE2 3.81Å; W109-F203 HydrophobicContact CZ2-CZ 4.33Å; W109-F203 AromaticContact NE1-CD2 3.35Å; W109-F203 VanDerWaalsContact NE1-CD2 3.35Å; W109-F203 AromaticContact NE1-CE2 3.25Å; W109-F203 PolarHBondContact NE1-O 2.88Å; T113-F203 WeakPolarHBondContact OG1-CE2 3.35Å; L116-F203 HydrophobicContact CD1-CB 3.47Å; L116-F203 VanDerWaalsContact CD1-CB 3.47Å; L116-F203 HydrophobicContact CD1-CD1 3.59Å; L116-F203 HydrophobicContact CD1-CD2 3.8Å; L116-F203 HydrophobicContact CD1-CE1 4.28Å; L116-F203 HydrophobicContact CD1-CE2 4.44Å; L116-F203 HydrophobicContact CD1-CG 3.31Å; F117-F203 HydrophobicContact CE2-CE1 4.34Å; F117-F203 AromaticContact CE2-CE2 3.91Å; F117-F203 HydrophobicContact CE2-CE2 3.91Å; F117-F203 AromaticContact CE2-CZ 3.68Å; F117-F203 HydrophobicContact CE2-CZ 3.68Å; F117-F203 HydrophobicContact CZ-CZ 4.17Å; F124-F203 HydrophobicContact CD2-CD1 4.28Å; F124-F203 HydrophobicContact CD2-CE1 4.16Å; F124-F203 AromaticContact CE2-CD1 3.95Å; F124-F203 HydrophobicContact CE2-CD1 3.95Å; F124-F203 AromaticContact CE2-CE1 3.52Å; F124-F203 HydrophobicContact CE2-CE1 3.52Å; F124-F203 HydrophobicContact CZ-CE1 4.16Å; I199-F203 WeakPolarHBondContact O-CB 3.37Å; I199-F203 PolarHBondContact O-N 3.35Å; F203-H205 VanDerWaalsContact C-N 3.32Å; F203-H205 PolarHBondContact O-N 3.28Å; F203-F250 HydrophobicContact CE1-CD1 4.45Å; F203-F250 AromaticContact CE1-CE1 3.9Å; F203-F250 HydrophobicContact CE1-CE1 3.9Å; F203-F250 HydrophobicContact CZ-CE1 4.09Å |
| 204 | L | 96.2 | Very high | 94.9 | Very high | 0 Ų | 0 | 15.2 Ų | 15.2 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -69.5 | -30.1 | -177.2 | -68.3 | 175.5 | 0 | 0 | 0 | 112.8 | F124 L200 V201 L202 F250 W254 F255 V259 | F124-L204 HydrophobicContact CE2-CD2 4.48Å; L200-L204 HydrophobicContact CD1-CD1 4.16Å; L200-L204 HydrophobicContact CD1-CG 4.29Å; L200-L204 HydrophobicContact CG-CD1 4.01Å; L200-L204 WeakPolarHBondContact O-CB 3.26Å; L200-L204 WeakPolarHBondContact O-CG 3.27Å; L200-L204 PolarHBondContact O-N 2.85Å; V201-L204 PolarHBondContact O-N 3.4Å; L202-L204 VanDerWaalsContact C-N 3.33Å; L202-L204 PolarHBondContact O-N 2.97Å; L204-F250 HydrophobicContact CD2-CB 4.46Å; L204-F250 HydrophobicContact CD2-CD1 3.75Å; L204-F250 HydrophobicContact CD2-CG 4.49Å; L204-F250 WeakPolarHBondContact O-CB 3.32Å; L204-W254 HydrophobicContact CD1-CB 4.36Å; L204-W254 HydrophobicContact CD2-CB 3.79Å; L204-W254 HydrophobicContact CD2-CD2 4.42Å; L204-W254 HydrophobicContact CD2-CE3 3.75Å; L204-F255 HydrophobicContact CD1-CB 4.09Å; L204-V259 HydrophobicContact CD1-CG2 3.92Å |
| 205 | H | 96.6 | Very high | 95.2 | Very high | 7 Ų | 7 | 15.4 Ų | 15.4 | 3% | 0.032 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -87.6 | -44.2 | -177.1 | -72.1 | 76.3 | 0 | 0 | 0 | 112.7 | V201 L202 F203 I207 N208 R251 F255 N291 | V201-H205 PolarHBondContact O-N 3.4Å; V201-H205 VanDerWaalsContact O-N 3.08Å; V201-H205 PolarHBondContact O-ND1 3.01Å; L202-H205 PolarHBondContact O-N 3.28Å; F203-H205 VanDerWaalsContact C-N 3.32Å; F203-H205 PolarHBondContact O-N 3.28Å; H205-I207 PolarHBondContact O-N 2.88Å; H205-N208 PolarHBondContact O-N 3.38Å; H205-R251 PolarHBondContact O-NE 3.37Å; H205-R251 PolarHBondContact O-NH2 2.98Å; H205-F255 AromaticContact CE1-CD2 3.52Å; H205-F255 AromaticContact CE1-CE2 3.69Å; H205-F255 AromaticContact CE1-CG 3.84Å; H205-N291 PolarHBondContact NE2-ND2 2.75Å |
| 206 | D | 96.1 | Very high | 95.4 | Very high | 0 Ų | 0 | 17.6 Ų | 17.6 | 0% | 0 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -67.8 | -30.4 | -166.6 | -75.1 | 8.8 | 0 | 0 | 0 | 113.9 | Y105 S108 W109 Q151 L202 N208 D209 V210 | Y105-D206 HydrophobicContact CD1-CB 4.32Å; S108-D206 PolarHBondContact OG-OD2 3.4Å; W109-D206 HydrophobicContact CB-CB 4.01Å; Q151-D206 VanDerWaalsContact NE2-CG 3.3Å; Q151-D206 PolarHBondContact NE2-OD1 3.49Å; Q151-D206 PolarHBondContact NE2-OD2 2.91Å; L202-D206 WeakPolarHBondContact O-CB 3.37Å; L202-D206 PolarHBondContact O-N 3.41Å; D206-N208 PolarHBondContact O-N 3.18Å; D206-D209 PolarHBondContact O-N 3.42Å; D206-V210 PolarHBondContact O-N 2.85Å; D206-V210 VanDerWaalsContact O-N 3.12Å |
| 207 | I | 96.3 | Very high | 95.6 | Very high | 19 Ų | 19 | 17.5 Ų | 17.5 | 10% | 0.097 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -57.3 | -35.1 | 179.1 | -171.8 | 51.3 | 0 | 0 | 0 | 112.8 | W109 H205 D209 V210 L211 F250 | W109-I207 HydrophobicContact CD2-CB 4.39Å; W109-I207 HydrophobicContact CD2-CD1 3.8Å; W109-I207 HydrophobicContact CE3-CD1 4.06Å; W109-I207 HydrophobicContact CG-CB 4.32Å; W109-I207 HydrophobicContact CG-CD1 4.44Å; W109-I207 HydrophobicContact CH2-CD1 3.88Å; W109-I207 HydrophobicContact CZ2-CB 4.42Å; W109-I207 HydrophobicContact CZ2-CD1 3.63Å; W109-I207 HydrophobicContact CZ2-CG1 4.09Å; W109-I207 HydrophobicContact CZ3-CD1 4.1Å; H205-I207 PolarHBondContact O-N 2.88Å; I207-D209 VanDerWaalsContact C-N 3.32Å; I207-V210 WeakPolarHBondContact O-CB 3.42Å; I207-V210 PolarHBondContact O-N 3.42Å; I207-L211 PolarHBondContact O-N 3.3Å; I207-L211 VanDerWaalsContact O-N 3.15Å; I207-F250 HydrophobicContact CG2-CB 4.27Å; I207-F250 HydrophobicContact CG2-CD1 3.63Å; I207-F250 HydrophobicContact CG2-CD2 4.18Å; I207-F250 HydrophobicContact CG2-CE1 3.89Å; I207-F250 HydrophobicContact CG2-CE2 4.43Å; I207-F250 HydrophobicContact CG2-CG 3.78Å; I207-F250 HydrophobicContact CG2-CZ 4.29Å |
| 208 | N | 96 | Very high | 95.8 | Very high | 0 Ų | 0 | 17.8 Ų | 17.8 | 0% | 0 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -71.2 | -33.4 | -178.8 | -74.3 | -62.6 | 0 | 0 | 0 | 111.2 | H205 D206 L211 L212 F243 T246 W247 | H205-N208 PolarHBondContact O-N 3.38Å; D206-N208 PolarHBondContact O-N 3.18Å; N208-L211 PolarHBondContact O-N 2.97Å; N208-L212 VanDerWaalsContact O-CB 3.25Å; N208-L212 WeakPolarHBondContact O-CB 3.38Å; N208-L212 PolarHBondContact O-N 3.47Å; N208-F243 HydrophobicContact CB-CE2 4.34Å; N208-F243 WeakPolarHBondContact O-CD2 3.24Å; N208-F243 WeakPolarHBondContact O-CE2 3.24Å; N208-T246 PolarHBondContact ND2-O 3.19Å; N208-T246 VanDerWaalsContact OD1-CB 3.26Å; N208-T246 WeakPolarHBondContact OD1-CB 3.47Å; N208-T246 PolarHBondContact OD1-O 2.92Å; N208-T246 PolarHBondContact OD1-OG1 3.44Å; N208-W247 HydrophobicContact CB-CE3 4.03Å; N208-W247 HydrophobicContact CB-CZ3 4.46Å; N208-W247 VanDerWaalsContact OD1-CA 3.23Å; N208-W247 WeakPolarHBondContact OD1-CA 3.15Å; N208-W247 PolarHBondContact OD1-N 3.3Å |
| 209 | D | 95.5 | Very high | 95.7 | Very high | 19 Ų | 19 | 20.3 Ų | 20.3 | 10% | 0.102 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -74.3 | -33.4 | 177.7 | -60.3 | -47.6 | 0 | 0 | 0 | 111 | Y105 D206 I207 L212 E213 R251 | Y105-D209 HydrophobicContact CD1-CB 4.02Å; Y105-D209 HydrophobicContact CD2-CB 3.49Å; Y105-D209 VanDerWaalsContact CD2-CB 3.49Å; Y105-D209 HydrophobicContact CE1-CB 4.17Å; Y105-D209 HydrophobicContact CE2-CB 3.69Å; Y105-D209 HydrophobicContact CG-CB 3.68Å; D206-D209 PolarHBondContact O-N 3.42Å; I207-D209 VanDerWaalsContact C-N 3.32Å; D209-L212 PolarHBondContact O-N 3.47Å; D209-E213 WeakPolarHBondContact O-CB 3.39Å; D209-E213 VanDerWaalsContact O-CG 3.3Å; D209-E213 WeakPolarHBondContact O-CG 3.47Å; D209-E213 PolarHBondContact O-N 3.34Å; D209-R251 IonicContact OD1-NH2 3.16Å; D209-R251 PolarHBondContact OD1-NH2 2.85Å; D209-R251 IonicContact OD2-NH2 3.99Å; D209-R251 PolarHBondContact OD2-NH2 3.48Å |
| 210 | V | 97.2 | Very high | 95.6 | Very high | 22 Ų | 22 | 21.5 Ų | 21.5 | 13% | 0.133 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -57.2 | -53.3 | 168.8 | 177.8 | 0 | 0 | 0 | 0 | 110.7 | L102 Y105 W109 D206 I207 L212 F214 | L102-V210 HydrophobicContact CD1-CG1 3.97Å; L102-V210 WeakPolarHBondContact CD1-O 3.32Å; Y105-V210 VanDerWaalsContact C-CG2 3.44Å; Y105-V210 WeakPolarHBondContact O-CG2 3.49Å; W109-V210 HydrophobicContact CB-CG2 4.35Å; D206-V210 PolarHBondContact O-N 2.85Å; D206-V210 VanDerWaalsContact O-N 3.12Å; I207-V210 WeakPolarHBondContact O-CB 3.42Å; I207-V210 PolarHBondContact O-N 3.42Å; V210-L212 PolarHBondContact O-N 3.44Å; V210-F214 WeakPolarHBondContact O-CB 3.23Å; V210-F214 PolarHBondContact O-N 3.12Å |
| 211 | L | 96.7 | Very high | 95.5 | Very high | 36 Ų | 36 | 23.1 Ų | 23.1 | 19% | 0.188 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -65.4 | -38.7 | -178.7 | -71.1 | 174.1 | 0 | 0 | 0 | 112.4 | I207 N208 T215 F243 T246 | I207-L211 PolarHBondContact O-N 3.3Å; I207-L211 VanDerWaalsContact O-N 3.15Å; N208-L211 PolarHBondContact O-N 2.97Å; L211-T215 VanDerWaalsContact O-CB 3.27Å; L211-T215 WeakPolarHBondContact O-CB 3.35Å; L211-T215 PolarHBondContact O-N 2.95Å; L211-T215 PolarHBondContact O-OG1 3.16Å; L211-F243 HydrophobicContact CB-CB 4.25Å; L211-F243 HydrophobicContact CB-CD2 4.45Å; L211-T246 HydrophobicContact CD1-CG2 3.53Å; L211-T246 VanDerWaalsContact CD1-OG1 3.27Å; L211-T246 WeakPolarHBondContact CD1-OG1 3.39Å |
| 212 | L | 95.3 | Very high | 95.1 | Very high | 43 Ų | 43 | 25.2 Ų | 25.2 | 23% | 0.225 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -62 | -51.6 | 178 | -178.9 | 60.1 | 0 | 0 | 0 | 111.7 | N208 D209 V210 T215 K216 F243 | N208-L212 VanDerWaalsContact O-CB 3.25Å; N208-L212 WeakPolarHBondContact O-CB 3.38Å; N208-L212 PolarHBondContact O-N 3.47Å; D209-L212 PolarHBondContact O-N 3.47Å; V210-L212 PolarHBondContact O-N 3.44Å; L212-T215 PolarHBondContact O-N 3.08Å; L212-K216 HydrophobicContact CG-CD 4.5Å; L212-K216 WeakPolarHBondContact O-CG 3.17Å; L212-K216 PolarHBondContact O-N 2.03Å; L212-F243 HydrophobicContact CB-CD2 3.87Å; L212-F243 HydrophobicContact CB-CE2 3.64Å; L212-F243 HydrophobicContact CB-CZ 4.27Å; L212-F243 HydrophobicContact CD1-CD1 4.39Å; L212-F243 HydrophobicContact CD1-CD2 4.43Å; L212-F243 HydrophobicContact CD1-CE1 3.95Å; L212-F243 HydrophobicContact CD1-CE2 4.01Å; L212-F243 HydrophobicContact CD1-CZ 3.75Å; L212-F243 HydrophobicContact CD2-CE2 4.3Å; L212-F243 HydrophobicContact CD2-CZ 4.28Å; L212-F243 HydrophobicContact CG-CE2 4.18Å; L212-F243 HydrophobicContact CG-CZ 4.31Å |
| 213 | E | 96.8 | Very high | 94.6 | Very high | 7 Ų | 7 | 26.6 Ų | 26.6 | 3% | 0.033 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -72.3 | -35.9 | -176.6 | -61.4 | -56.5 | 148.3 | 0 | 0 | 111.6 | S98 K101 L102 D209 T215 K216 L217 | S98-E213 WeakPolarHBondContact CA-OE2 3.41Å; S98-E213 WeakPolarHBondContact CB-OE2 3.29Å; S98-E213 PolarHBondContact OG-OE2 2.78Å; K101-E213 HydrophobicContact CB-CG 3.73Å; L102-E213 HydrophobicContact CB-CB 3.87Å; L102-E213 HydrophobicContact CD1-CB 4.4Å; D209-E213 WeakPolarHBondContact O-CB 3.39Å; D209-E213 VanDerWaalsContact O-CG 3.3Å; D209-E213 WeakPolarHBondContact O-CG 3.47Å; D209-E213 PolarHBondContact O-N 3.34Å; E213-T215 VanDerWaalsContact C-N 3.34Å; E213-T215 PolarHBondContact O-N 3.17Å; E213-K216 PolarHBondContact O-N 3.1Å; E213-K216 IonicContact OE1-NZ 3.87Å; E213-K216 PolarHBondContact OE1-NZ 2.63Å; E213-K216 WeakPolarHBondContact OE2-CD 3.5Å; E213-K216 IonicContact OE2-NZ 2.75Å; E213-L217 WeakPolarHBondContact O-CG 3.48Å; E213-L217 PolarHBondContact O-N 3.09Å |
| 214 | F | 96.6 | Very high | 94.2 | Very high | 84 Ų | 84 | 29.3 Ų | 29.3 | 37% | 0.368 | 15% | 0.149 | S | C | . | . | H | α-helix | trans | -58.5 | -46.1 | 170.1 | 179.7 | -99.3 | 0 | 0 | 0 | 111.5 | L102 V210 L217 N218 | L102-F214 HydrophobicContact CD1-CB 4.01Å; L102-F214 HydrophobicContact CD2-CB 4.39Å; L102-F214 HydrophobicContact CD2-CD2 4.42Å; V210-F214 WeakPolarHBondContact O-CB 3.23Å; V210-F214 PolarHBondContact O-N 3.12Å; F214-L217 PolarHBondContact O-N 3.4Å; F214-N218 VanDerWaalsContact CE1-ND2 3.27Å; F214-N218 WeakPolarHBondContact CE1-ND2 3.36Å; F214-N218 VanDerWaalsContact CZ-ND2 3.28Å; F214-N218 WeakPolarHBondContact CZ-ND2 2.99Å; F214-N218 PolarHBondContact O-N 2.9Å; F214-N218 VanDerWaalsContact O-N 3.12Å; F214-N218 PolarHBondContact O-ND2 3.26Å |
| 215 | T | 95.6 | Very high | 93.5 | Very high | 10 Ų | 10 | 31.4 Ų | 31.4 | 6% | 0.061 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -62.4 | -46.6 | 178.7 | -60.4 | 0 | 0 | 0 | 0 | 111.3 | L211 L212 E213 L217 N218 V219 S236 G239 S240 | L211-T215 VanDerWaalsContact O-CB 3.27Å; L211-T215 WeakPolarHBondContact O-CB 3.35Å; L211-T215 PolarHBondContact O-N 2.95Å; L211-T215 PolarHBondContact O-OG1 3.16Å; L212-T215 PolarHBondContact O-N 3.08Å; E213-T215 VanDerWaalsContact C-N 3.34Å; E213-T215 PolarHBondContact O-N 3.17Å; T215-L217 VanDerWaalsContact C-N 3.33Å; T215-L217 PolarHBondContact O-N 2.89Å; T215-N218 PolarHBondContact O-N 3.01Å; T215-V219 WeakPolarHBondContact O-CG2 3.23Å; T215-V219 PolarHBondContact O-N 3.42Å; T215-S236 WeakPolarHBondContact CG2-O 3.22Å; T215-G239 VanDerWaalsContact OG1-CA 3.22Å; T215-G239 WeakPolarHBondContact OG1-CA 3.19Å; T215-G239 PolarHBondContact OG1-O 3.28Å; T215-S240 WeakPolarHBondContact CG2-OG 3.41Å |
| 216 | K | 94.3 | Very high | 92.6 | Very high | 49 Ų | 49 | 35.2 Ų | 35.2 | 21% | 0.213 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -57.6 | -44.1 | 177.1 | -74.9 | 172.3 | -173.6 | 166 | 0 | 112.3 | L212 E213 N218 V219 Y220 | L212-K216 HydrophobicContact CG-CD 4.5Å; L212-K216 WeakPolarHBondContact O-CG 3.17Å; L212-K216 PolarHBondContact O-N 2.03Å; E213-K216 PolarHBondContact O-N 3.1Å; E213-K216 IonicContact OE1-NZ 3.87Å; E213-K216 PolarHBondContact OE1-NZ 2.63Å; E213-K216 WeakPolarHBondContact OE2-CD 3.5Å; E213-K216 IonicContact OE2-NZ 2.75Å; K216-N218 VanDerWaalsContact C-N 3.35Å; K216-N218 PolarHBondContact O-N 2.93Å; K216-V219 WeakPolarHBondContact O-CB 3.38Å; K216-V219 PolarHBondContact O-N 3.21Å; K216-Y220 HydrophobicContact CB-CE2 4.13Å; K216-Y220 WeakPolarHBondContact O-CD1 3.49Å; K216-Y220 VanDerWaalsContact O-CD2 3.31Å; K216-Y220 WeakPolarHBondContact O-CD2 3.48Å; K216-Y220 PolarHBondContact O-N 2.8Å |
| 217 | L | 95.3 | Very high | 92 | Very high | 23 Ų | 23 | 36.9 Ų | 36.9 | 12% | 0.12 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -61.5 | -42.7 | 177.3 | -70 | 179.8 | 0 | 0 | 0 | 111.9 | M95 A99 L102 E213 F214 T215 V219 Y220 L221 | M95-L217 HydrophobicContact CB-CD2 4.47Å; M95-L217 HydrophobicContact CG-CD2 3.7Å; A99-L217 HydrophobicContact CB-CD1 4.33Å; A99-L217 HydrophobicContact CB-CD2 4.26Å; L102-L217 HydrophobicContact CB-CD1 4.45Å; L102-L217 HydrophobicContact CD2-CD1 3.48Å; L102-L217 VanDerWaalsContact CD2-CD1 3.48Å; E213-L217 WeakPolarHBondContact O-CG 3.48Å; E213-L217 PolarHBondContact O-N 3.09Å; F214-L217 PolarHBondContact O-N 3.4Å; T215-L217 VanDerWaalsContact C-N 3.33Å; T215-L217 PolarHBondContact O-N 2.89Å; L217-V219 VanDerWaalsContact C-N 3.32Å; L217-V219 PolarHBondContact O-N 3.45Å; L217-Y220 HydrophobicContact CD2-CD2 4.13Å; L217-Y220 HydrophobicContact CD2-CE2 4.48Å; L217-Y220 PolarHBondContact O-N 3.48Å; L217-Y220 VanDerWaalsContact O-N 3.16Å; L217-L221 WeakPolarHBondContact O-CB 3.01Å; L217-L221 VanDerWaalsContact O-CG 3.23Å; L217-L221 WeakPolarHBondContact O-CG 3.16Å; L217-L221 PolarHBondContact O-N 3.35Å |
| 218 | N | 95.1 | Very high | 91.5 | Very high | 9 Ų | 9 | 41.3 Ų | 41.3 | 5% | 0.048 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -64.3 | -37 | 175.3 | -76.4 | -82.5 | 0 | 0 | 0 | 111.9 | F214 T215 K216 Y220 L221 K222 N232 L235 | F214-N218 VanDerWaalsContact CE1-ND2 3.27Å; F214-N218 WeakPolarHBondContact CE1-ND2 3.36Å; F214-N218 VanDerWaalsContact CZ-ND2 3.28Å; F214-N218 WeakPolarHBondContact CZ-ND2 2.99Å; F214-N218 PolarHBondContact O-N 2.9Å; F214-N218 VanDerWaalsContact O-N 3.12Å; F214-N218 PolarHBondContact O-ND2 3.26Å; T215-N218 PolarHBondContact O-N 3.01Å; K216-N218 VanDerWaalsContact C-N 3.35Å; K216-N218 PolarHBondContact O-N 2.93Å; N218-Y220 VanDerWaalsContact C-N 3.32Å; N218-Y220 PolarHBondContact O-N 3.34Å; N218-L221 PolarHBondContact O-N 3.03Å; N218-K222 PolarHBondContact O-N 2.89Å; N218-N232 PolarHBondContact OD1-OD1 2.89Å; N218-L235 HydrophobicContact CB-CB 4.28Å; N218-L235 WeakPolarHBondContact OD1-CB 3.3Å; N218-L235 WeakPolarHBondContact OD1-CD1 3.32Å |
| 219 | V | 92.8 | Very high | 91.1 | Very high | 60 Ų | 60 | 44.5 Ų | 44.5 | 36% | 0.364 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -60.9 | -40.1 | 171.9 | 172.7 | 0 | 0 | 0 | 0 | 111.5 | T215 K216 L217 K222 | T215-V219 WeakPolarHBondContact O-CG2 3.23Å; T215-V219 PolarHBondContact O-N 3.42Å; K216-V219 WeakPolarHBondContact O-CB 3.38Å; K216-V219 PolarHBondContact O-N 3.21Å; L217-V219 VanDerWaalsContact C-N 3.32Å; L217-V219 PolarHBondContact O-N 3.45Å; V219-K222 WeakPolarHBondContact O-CG 3.46Å |
| 220 | Y | 92.2 | Very high | 90.8 | Very high | 26 Ų | 26 | 49.7 Ų | 49.7 | 10% | 0.102 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -68.2 | -38.6 | 176.4 | -54.7 | -27 | 0 | 0 | 0 | 111.6 | L87 D91 K94 M95 K216 L217 N218 K222 | L87-Y220 VanDerWaalsContact CD2-O 3.22Å; L87-Y220 WeakPolarHBondContact CD2-O 3.35Å; D91-Y220 HydrophobicContact CB-CD1 3.92Å; D91-Y220 HydrophobicContact CB-CG 4.08Å; K94-Y220 HydrophobicContact CB-CE2 4.16Å; M95-Y220 HydrophobicContact CB-CD2 3.95Å; M95-Y220 HydrophobicContact CB-CE2 4.47Å; M95-Y220 HydrophobicContact CG-CD2 4.42Å; K216-Y220 HydrophobicContact CB-CE2 4.13Å; K216-Y220 WeakPolarHBondContact O-CD1 3.49Å; K216-Y220 VanDerWaalsContact O-CD2 3.31Å; K216-Y220 WeakPolarHBondContact O-CD2 3.48Å; K216-Y220 PolarHBondContact O-N 2.8Å; L217-Y220 HydrophobicContact CD2-CD2 4.13Å; L217-Y220 HydrophobicContact CD2-CE2 4.48Å; L217-Y220 PolarHBondContact O-N 3.48Å; L217-Y220 VanDerWaalsContact O-N 3.16Å; N218-Y220 VanDerWaalsContact C-N 3.32Å; N218-Y220 PolarHBondContact O-N 3.34Å; Y220-K222 PolarHBondContact O-N 3.24Å |
| 221 | L | 92.3 | Very high | 90.5 | Very high | 35 Ų | 35 | 54.7 Ų | 54.7 | 18% | 0.183 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -78 | -15.3 | -176.3 | -69.2 | 167.7 | 0 | 0 | 0 | 114.1 | C85 L87 L217 N218 A223 R224 N232 | C85-L221 HydrophobicContact CB-CD2 4.43Å; L87-L221 HydrophobicContact CD2-CD2 4.18Å; L217-L221 WeakPolarHBondContact O-CB 3.01Å; L217-L221 VanDerWaalsContact O-CG 3.23Å; L217-L221 WeakPolarHBondContact O-CG 3.16Å; L217-L221 PolarHBondContact O-N 3.35Å; N218-L221 PolarHBondContact O-N 3.03Å; L221-A223 PolarHBondContact O-N 2.77Å; L221-R224 WeakPolarHBondContact O-CB 3.49Å; L221-R224 PolarHBondContact O-N 3.23Å; L221-N232 HydrophobicContact CB-CB 4.3Å |
| 222 | K | 89.1 | Confident | 90.2 | Very high | 60 Ų | 60 | 53.7 Ų | 53.7 | 26% | 0.261 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -69.7 | -32.4 | -177.3 | 82.2 | -172.3 | -167.5 | 161.1 | 0 | 114.3 | N218 V219 Y220 R224 H228 H229 N232 D233 | N218-K222 PolarHBondContact O-N 2.89Å; V219-K222 WeakPolarHBondContact O-CG 3.46Å; Y220-K222 PolarHBondContact O-N 3.24Å; K222-R224 VanDerWaalsContact C-N 3.35Å; K222-H228 CarbonylContact O-C 3.35Å; K222-H228 WeakPolarHBondContact O-CA 3.29Å; K222-H229 PolarHBondContact O-N 2.93Å; K222-N232 HydrophobicContact CB-CB 3.91Å; K222-D233 HydrophobicContact CB-CB 4.43Å; K222-D233 HydrophobicContact CD-CB 4.45Å; K222-D233 WeakPolarHBondContact CD-OD1 3.43Å; K222-D233 IonicContact NZ-OD1 2.79Å; K222-D233 PolarHBondContact NZ-OD1 2.81Å |
| 223 | A | 83.9 | Confident | 89.9 | Confident | 43 Ų | 43 | 53.3 Ų | 53.3 | 36% | 0.355 | 31% | 0.309 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99.9 | 27.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | L221 G227 | L221-A223 PolarHBondContact O-N 2.77Å; A223-G227 CarbonylContact C-O 3.52Å |
| 224 | R | 88.4 | Confident | 89.6 | Confident | 64 Ų | 64 | 56.7 Ų | 56.7 | 24% | 0.242 | 33% | 0.33 | C | S | . | . | G | 310 helix | trans | -75.8 | 134.6 | -168.9 | 180 | 176.9 | 61.8 | 167.7 | 2.8 | 112.7 | C85 L87 L221 K222 G226 G227 H229 | C85-R224 HydrophobicContact CB-CG 3.87Å; C85-R224 VanDerWaalsContact O-CD 3.27Å; C85-R224 WeakPolarHBondContact O-CD 3.44Å; C85-R224 WeakPolarHBondContact O-CG 3.49Å; C85-R224 VanDerWaalsContact SG-CD 3.55Å; C85-R224 PolarHBondContact SG-NH1 2.86Å; L87-R224 HydrophobicContact CD2-CB 4.15Å; L87-R224 HydrophobicContact CD2-CG 4.09Å; L221-R224 WeakPolarHBondContact O-CB 3.49Å; L221-R224 PolarHBondContact O-N 3.23Å; K222-R224 VanDerWaalsContact C-N 3.35Å; R224-G226 VanDerWaalsContact C-N 3.27Å; R224-G226 PolarHBondContact O-N 3.15Å; R224-G227 PolarHBondContact N-O 2.96Å; R224-G227 PolarHBondContact O-N 3.07Å; R224-H229 PolarHBondContact O-CD2 3.06Å; R224-H229 PolarHBondContact O-NE2 2.61Å |
| 225 | G | 81.7 | Confident | 89.5 | Confident | 44 Ų | 44 | 55.4 Ų | 55.4 | 45% | 0.454 | 33% | 0.326 | S | S | . | . | G | 310 helix | trans | 70 | 21.7 | 174 | 0 | 0 | 0 | 0 | 0 | 114.7 | R86 G227 | R86-G225 PolarHBondContact O-N 3.34Å; R86-G225 VanDerWaalsContact O-N 3.1Å; G225-G227 PolarHBondContact O-N 3.17Å |
| 226 | G | 78.1 | Confident | 89.3 | Confident | 86 Ų | 86 | 55 Ų | 55 | 89% | 0.887 | 32% | 0.324 | S | S | * | . | G | 310 helix | trans | 78 | 3.6 | -178.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | R224 | R224-G226 VanDerWaalsContact C-N 3.27Å; R224-G226 PolarHBondContact O-N 3.15Å |
| 227 | G | 82.7 | Confident | 89.1 | Confident | 35 Ų | 35 | 56.5 Ų | 56.5 | 36% | 0.361 | 34% | 0.335 | S | S | . | . | S | Bend | trans | -118.5 | 157.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | A223 R224 G225 H229 | A223-G227 CarbonylContact C-O 3.52Å; R224-G227 PolarHBondContact N-O 2.96Å; R224-G227 PolarHBondContact O-N 3.07Å; G225-G227 PolarHBondContact O-N 3.17Å; G227-H229 PolarHBondContact O-CD2 3.37Å |
| 228 | H | 85.2 | Confident | 89 | Confident | 112 Ų | 112 | 61.2 Ų | 61.2 | 52% | 0.519 | 36% | 0.357 | S | S | . | . | trans | -89.4 | 124.8 | 173.9 | -171.7 | 66.5 | 0 | 0 | 0 | 110.5 | K222 D233 | K222-H228 CarbonylContact O-C 3.35Å; K222-H228 WeakPolarHBondContact O-CA 3.29Å; H228-D233 IonicContact CE1-OD1 3.81Å; H228-D233 IonicContact CE1-OD2 2.98Å; H228-D233 IonicContact NE2-OD2 2.67Å; H228-D233 PolarHBondContact NE2-OD2 2.92Å | ||
| 229 | H | 89.4 | Confident | 88.9 | Confident | 67 Ų | 67 | 61 Ų | 61 | 31% | 0.31 | 36% | 0.358 | S | S | . | . | trans | -103.7 | 102.9 | -179.1 | -65.7 | -99.9 | 0 | 0 | 0 | 110.1 | K222 R224 G227 L231 N232 D233 | K222-H229 PolarHBondContact O-N 2.93Å; R224-H229 PolarHBondContact O-CD2 3.06Å; R224-H229 PolarHBondContact O-NE2 2.61Å; G227-H229 PolarHBondContact O-CD2 3.37Å; H229-L231 VanDerWaalsContact C-N 3.29Å; H229-L231 PolarHBondContact O-N 2.91Å; H229-N232 HydrophobicContact CB-CB 4.32Å; H229-N232 WeakPolarHBondContact CB-ND2 3.43Å; H229-N232 PolarHBondContact O-N 3.19Å; H229-N232 VanDerWaalsContact O-N 3.13Å; H229-D233 PolarHBondContact O-N 2.85Å; H229-D233 VanDerWaalsContact O-N 3.11Å | ||
| 230 | L | 88.2 | Confident | 88.8 | Confident | 129 Ų | 129 | 59 Ų | 59 | 68% | 0.675 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -54.6 | -40.9 | -176.5 | -68.7 | 174.5 | 0 | 0 | 0 | 113.4 | N232 D233 V234 | L230-N232 PolarHBondContact O-N 3.37Å; L230-D233 PolarHBondContact O-N 3.5Å; L230-V234 WeakPolarHBondContact O-CG2 3.3Å; L230-V234 PolarHBondContact O-N 3.46Å |
| 231 | L | 90.6 | Very high | 88.9 | Confident | 126 Ų | 126 | 62.3 Ų | 62.3 | 66% | 0.66 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -60.1 | -45.6 | 179.2 | -176.3 | 124.6 | 0 | 0 | 0 | 112.1 | H229 D233 V234 L235 | H229-L231 VanDerWaalsContact C-N 3.29Å; H229-L231 PolarHBondContact O-N 2.91Å; L231-D233 VanDerWaalsContact C-N 3.31Å; L231-D233 PolarHBondContact O-N 3.37Å; L231-V234 PolarHBondContact O-N 3.35Å; L231-L235 HydrophobicContact CD2-CD1 3.67Å; L231-L235 HydrophobicContact CG-CD1 4.17Å; L231-L235 WeakPolarHBondContact O-CB 3.45Å; L231-L235 VanDerWaalsContact O-CG 3.25Å; L231-L235 WeakPolarHBondContact O-CG 3.28Å; L231-L235 PolarHBondContact O-N 2.69Å |
| 232 | N | 90.8 | Very high | 89 | Confident | 16 Ų | 16 | 62.7 Ų | 62.7 | 9% | 0.086 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -68.6 | -33 | 178.1 | -68.8 | -68.6 | 0 | 0 | 0 | 111.7 | N218 L221 K222 H229 L230 S236 | N218-N232 PolarHBondContact OD1-OD1 2.89Å; L221-N232 HydrophobicContact CB-CB 4.3Å; K222-N232 HydrophobicContact CB-CB 3.91Å; H229-N232 HydrophobicContact CB-CB 4.32Å; H229-N232 WeakPolarHBondContact CB-ND2 3.43Å; H229-N232 PolarHBondContact O-N 3.19Å; H229-N232 VanDerWaalsContact O-N 3.13Å; L230-N232 PolarHBondContact O-N 3.37Å; N232-S236 VanDerWaalsContact O-CB 3.23Å; N232-S236 WeakPolarHBondContact O-CB 3.41Å; N232-S236 PolarHBondContact O-N 3.15Å; N232-S236 PolarHBondContact O-OG 2.78Å |
| 233 | D | 89.7 | Confident | 89.2 | Confident | 34 Ų | 34 | 60.8 Ų | 60.8 | 18% | 0.182 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -66.5 | -48.1 | 175.6 | -164.3 | 47.1 | 0 | 0 | 0 | 111.1 | K222 H228 H229 L230 L231 L235 S236 N237 | K222-D233 HydrophobicContact CB-CB 4.43Å; K222-D233 HydrophobicContact CD-CB 4.45Å; K222-D233 WeakPolarHBondContact CD-OD1 3.43Å; K222-D233 IonicContact NZ-OD1 2.79Å; K222-D233 PolarHBondContact NZ-OD1 2.81Å; H228-D233 IonicContact CE1-OD1 3.81Å; H228-D233 IonicContact CE1-OD2 2.98Å; H228-D233 IonicContact NE2-OD2 2.67Å; H228-D233 PolarHBondContact NE2-OD2 2.92Å; H229-D233 PolarHBondContact O-N 2.85Å; H229-D233 VanDerWaalsContact O-N 3.11Å; L230-D233 PolarHBondContact O-N 3.5Å; L231-D233 VanDerWaalsContact C-N 3.31Å; L231-D233 PolarHBondContact O-N 3.37Å; D233-L235 PolarHBondContact O-N 2.85Å; D233-S236 PolarHBondContact O-N 3.13Å; D233-S236 PolarHBondContact O-OG 3.08Å; D233-N237 PolarHBondContact O-N 3.46Å; D233-N237 PolarHBondContact O-ND2 2.94Å |
| 234 | V | 90 | Very high | 89.7 | Confident | 79 Ų | 79 | 59.6 Ų | 59.6 | 48% | 0.479 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -58.7 | -48.4 | 173.7 | 174.3 | 0 | 0 | 0 | 0 | 111.1 | L230 L231 S236 N237 M238 | L230-V234 WeakPolarHBondContact O-CG2 3.3Å; L230-V234 PolarHBondContact O-N 3.46Å; L231-V234 PolarHBondContact O-N 3.35Å; V234-S236 VanDerWaalsContact C-N 3.3Å; V234-S236 PolarHBondContact O-N 3.2Å; V234-N237 PolarHBondContact O-N 3.25Å; V234-M238 HydrophobicContact CG1-CG 4.25Å; V234-M238 HydrophobicContact CG1-SD 3.76Å; V234-M238 WeakPolarHBondContact O-CB 3.2Å; V234-M238 WeakPolarHBondContact O-CG 3.34Å; V234-M238 PolarHBondContact O-N 3.32Å |
| 235 | L | 93.8 | Very high | 90.1 | Very high | 56 Ų | 56 | 60.8 Ų | 60.8 | 29% | 0.293 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -61 | -38.2 | 177.5 | -72.9 | 175.6 | 0 | 0 | 0 | 112.3 | N218 L231 D233 G239 | N218-L235 HydrophobicContact CB-CB 4.28Å; N218-L235 WeakPolarHBondContact OD1-CB 3.3Å; N218-L235 WeakPolarHBondContact OD1-CD1 3.32Å; L231-L235 HydrophobicContact CD2-CD1 3.67Å; L231-L235 HydrophobicContact CG-CD1 4.17Å; L231-L235 WeakPolarHBondContact O-CB 3.45Å; L231-L235 VanDerWaalsContact O-CG 3.25Å; L231-L235 WeakPolarHBondContact O-CG 3.28Å; L231-L235 PolarHBondContact O-N 2.69Å; D233-L235 PolarHBondContact O-N 2.85Å; L235-G239 WeakPolarHBondContact O-CA 3.28Å; L235-G239 PolarHBondContact O-N 2.99Å |
| 236 | S | 92.3 | Very high | 90.8 | Very high | 2 Ų | 2 | 59.9 Ų | 59.9 | 1% | 0.014 | 36% | 0.355 | C | S | . | . | H | α-helix | trans | -68.5 | -37.7 | 177.1 | 74.4 | 0 | 0 | 0 | 0 | 112.8 | T215 N232 D233 V234 S240 | T215-S236 WeakPolarHBondContact CG2-O 3.22Å; N232-S236 VanDerWaalsContact O-CB 3.23Å; N232-S236 WeakPolarHBondContact O-CB 3.41Å; N232-S236 PolarHBondContact O-N 3.15Å; N232-S236 PolarHBondContact O-OG 2.78Å; D233-S236 PolarHBondContact O-N 3.13Å; D233-S236 PolarHBondContact O-OG 3.08Å; V234-S236 VanDerWaalsContact C-N 3.3Å; V234-S236 PolarHBondContact O-N 3.2Å; S236-S240 WeakPolarHBondContact O-CB 3.49Å; S236-S240 PolarHBondContact O-N 3.23Å; S236-S240 PolarHBondContact O-OG 2.87Å |
| 237 | N | 90.3 | Very high | 91.7 | Very high | 81 Ų | 81 | 56.3 Ų | 56.3 | 43% | 0.433 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -70.2 | -48.7 | 177.2 | -71.5 | -27.3 | 0 | 0 | 0 | 110.8 | D233 V234 G239 S240 V241 | D233-N237 PolarHBondContact O-N 3.46Å; D233-N237 PolarHBondContact O-ND2 2.94Å; V234-N237 PolarHBondContact O-N 3.25Å; N237-G239 VanDerWaalsContact C-N 3.31Å; N237-G239 PolarHBondContact O-N 3.35Å; N237-S240 PolarHBondContact O-N 3.06Å; N237-V241 PolarHBondContact O-N 3.36Å; N237-V241 VanDerWaalsContact O-N 3.14Å |
| 238 | M | 92.3 | Very high | 92.4 | Very high | 122 Ų | 122 | 59 Ų | 59 | 60% | 0.601 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -59.6 | -43.4 | 174.7 | -71.1 | 179.7 | 66.6 | 0 | 0 | 111.5 | V234 S240 V241 S242 | V234-M238 HydrophobicContact CG1-CG 4.25Å; V234-M238 HydrophobicContact CG1-SD 3.76Å; V234-M238 WeakPolarHBondContact O-CB 3.2Å; V234-M238 WeakPolarHBondContact O-CG 3.34Å; V234-M238 PolarHBondContact O-N 3.32Å; M238-S240 PolarHBondContact O-N 2.85Å; M238-V241 PolarHBondContact O-N 3.44Å; M238-S242 WeakPolarHBondContact O-CB 3.23Å; M238-S242 PolarHBondContact O-N 3.05Å; M238-S242 PolarHBondContact O-OG 2.99Å |
| 239 | G | 93.2 | Very high | 92.9 | Very high | 5 Ų | 5 | 59 Ų | 59 | 5% | 0.052 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -61.4 | -39.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | T215 L235 N237 S242 F243 | T215-G239 VanDerWaalsContact OG1-CA 3.22Å; T215-G239 WeakPolarHBondContact OG1-CA 3.19Å; T215-G239 PolarHBondContact OG1-O 3.28Å; L235-G239 WeakPolarHBondContact O-CA 3.28Å; L235-G239 PolarHBondContact O-N 2.99Å; N237-G239 VanDerWaalsContact C-N 3.31Å; N237-G239 PolarHBondContact O-N 3.35Å; G239-S242 WeakPolarHBondContact CA-OG 3.4Å; G239-S242 PolarHBondContact O-OG 3.31Å; G239-S242 VanDerWaalsContact O-OG 3.06Å; G239-F243 WeakPolarHBondContact O-CB 3.13Å; G239-F243 PolarHBondContact O-N 3.3Å |
| 240 | S | 91.4 | Very high | 93.2 | Very high | 16 Ų | 16 | 57.1 Ų | 57.1 | 11% | 0.112 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -65.9 | -41.2 | 177.2 | -61 | 0 | 0 | 0 | 0 | 112.2 | T215 S236 N237 M238 S244 | T215-S240 WeakPolarHBondContact CG2-OG 3.41Å; S236-S240 WeakPolarHBondContact O-CB 3.49Å; S236-S240 PolarHBondContact O-N 3.23Å; S236-S240 PolarHBondContact O-OG 2.87Å; N237-S240 PolarHBondContact O-N 3.06Å; M238-S240 PolarHBondContact O-N 2.85Å; S240-S244 PolarHBondContact O-N 3.38Å; S240-S244 PolarHBondContact O-OG 3.44Å |
| 241 | V | 92.8 | Very high | 93.7 | Very high | 96 Ų | 96 | 51.1 Ų | 51.1 | 58% | 0.582 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -69 | -47.8 | 176.6 | 176.1 | 0 | 0 | 0 | 0 | 110.5 | N237 M238 F243 S244 V245 | N237-V241 PolarHBondContact O-N 3.36Å; N237-V241 VanDerWaalsContact O-N 3.14Å; M238-V241 PolarHBondContact O-N 3.44Å; V241-F243 PolarHBondContact O-N 3.23Å; V241-S244 WeakPolarHBondContact O-CB 3.16Å; V241-S244 PolarHBondContact O-N 3.47Å; V241-S244 VanDerWaalsContact O-N 3.16Å; V241-V245 WeakPolarHBondContact O-CG2 3.19Å; V241-V245 PolarHBondContact O-N 3.38Å; V241-V245 VanDerWaalsContact O-N 3.08Å |
| 242 | S | 94.3 | Very high | 93.9 | Very high | 43 Ų | 43 | 46 Ų | 46 | 30% | 0.301 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -62 | -45.4 | -179.7 | 66.8 | 0 | 0 | 0 | 0 | 111.4 | M238 G239 S244 V245 T246 | M238-S242 WeakPolarHBondContact O-CB 3.23Å; M238-S242 PolarHBondContact O-N 3.05Å; M238-S242 PolarHBondContact O-OG 2.99Å; G239-S242 WeakPolarHBondContact CA-OG 3.4Å; G239-S242 PolarHBondContact O-OG 3.31Å; G239-S242 VanDerWaalsContact O-OG 3.06Å; S242-S244 VanDerWaalsContact C-N 3.27Å; S242-S244 PolarHBondContact O-N 2.98Å; S242-V245 PolarHBondContact O-N 2.81Å; S242-V245 VanDerWaalsContact O-N 3.17Å; S242-T246 WeakPolarHBondContact O-CG2 3.44Å; S242-T246 PolarHBondContact O-N 3.01Å; S242-T246 PolarHBondContact O-OG1 2.9Å; S242-T246 VanDerWaalsContact O-OG1 3.05Å |
| 243 | F | 95.1 | Very high | 94.1 | Very high | 20 Ų | 20 | 48.5 Ų | 48.5 | 9% | 0.088 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -53.7 | -42.4 | 173.7 | 168.8 | -109.8 | 0 | 0 | 0 | 112.5 | N208 L211 L212 G239 V241 T246 W247 I298 | N208-F243 HydrophobicContact CB-CE2 4.34Å; N208-F243 WeakPolarHBondContact O-CD2 3.24Å; N208-F243 WeakPolarHBondContact O-CE2 3.24Å; L211-F243 HydrophobicContact CB-CB 4.25Å; L211-F243 HydrophobicContact CB-CD2 4.45Å; L212-F243 HydrophobicContact CB-CD2 3.87Å; L212-F243 HydrophobicContact CB-CE2 3.64Å; L212-F243 HydrophobicContact CB-CZ 4.27Å; L212-F243 HydrophobicContact CD1-CD1 4.39Å; L212-F243 HydrophobicContact CD1-CD2 4.43Å; L212-F243 HydrophobicContact CD1-CE1 3.95Å; L212-F243 HydrophobicContact CD1-CE2 4.01Å; L212-F243 HydrophobicContact CD1-CZ 3.75Å; L212-F243 HydrophobicContact CD2-CE2 4.3Å; L212-F243 HydrophobicContact CD2-CZ 4.28Å; L212-F243 HydrophobicContact CG-CE2 4.18Å; L212-F243 HydrophobicContact CG-CZ 4.31Å; G239-F243 WeakPolarHBondContact O-CB 3.13Å; G239-F243 PolarHBondContact O-N 3.3Å; V241-F243 PolarHBondContact O-N 3.23Å; F243-T246 WeakPolarHBondContact CA-OG1 3.49Å; F243-T246 PolarHBondContact O-OG1 2.82Å; F243-T246 VanDerWaalsContact O-OG1 3.11Å; F243-W247 HydrophobicContact CD2-CE3 4.46Å; F243-W247 HydrophobicContact CE1-CE3 4.48Å; F243-W247 AromaticContact CE2-CE3 3.43Å; F243-W247 HydrophobicContact CE2-CE3 3.43Å; F243-W247 VanDerWaalsContact CE2-CE3 3.43Å; F243-W247 AromaticContact CE2-CZ3 3.78Å; F243-W247 HydrophobicContact CE2-CZ3 3.78Å; F243-W247 HydrophobicContact CZ-CD2 4.44Å; F243-W247 AromaticContact CZ-CE3 3.44Å; F243-W247 HydrophobicContact CZ-CE3 3.44Å; F243-W247 VanDerWaalsContact CZ-CE3 3.44Å; F243-W247 AromaticContact CZ-CZ3 3.68Å; F243-W247 HydrophobicContact CZ-CZ3 3.68Å; F243-W247 VanDerWaalsContact O-CB 3.29Å; F243-W247 WeakPolarHBondContact O-CB 3.35Å; F243-W247 PolarHBondContact O-N 2.87Å; F243-I298 HydrophobicContact CD1-CD1 4.41Å; F243-I298 HydrophobicContact CE1-CD1 3.45Å; F243-I298 VanDerWaalsContact CE1-CD1 3.45Å; F243-I298 HydrophobicContact CE1-CG1 3.74Å; F243-I298 HydrophobicContact CE1-CG2 4.34Å; F243-I298 HydrophobicContact CZ-CD1 3.54Å; F243-I298 HydrophobicContact CZ-CG1 4.22Å |
| 244 | S | 94.6 | Very high | 94.4 | Very high | 19 Ų | 19 | 49.3 Ų | 49.3 | 13% | 0.133 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -66.9 | -42.4 | 179.9 | -56.4 | 0 | 0 | 0 | 0 | 112 | S240 V241 S242 F248 I298 V302 | S240-S244 PolarHBondContact O-N 3.38Å; S240-S244 PolarHBondContact O-OG 3.44Å; V241-S244 WeakPolarHBondContact O-CB 3.16Å; V241-S244 PolarHBondContact O-N 3.47Å; V241-S244 VanDerWaalsContact O-N 3.16Å; S242-S244 VanDerWaalsContact C-N 3.27Å; S242-S244 PolarHBondContact O-N 2.98Å; S244-F248 PolarHBondContact O-N 3.4Å; S244-I298 VanDerWaalsContact OG-CG2 3.28Å; S244-I298 WeakPolarHBondContact OG-CG2 3.31Å; S244-V302 VanDerWaalsContact OG-CG2 3.31Å; S244-V302 WeakPolarHBondContact OG-CG2 3.41Å |
| 245 | V | 95.8 | Very high | 94.7 | Very high | 89 Ų | 89 | 45.5 Ų | 45.5 | 54% | 0.539 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -67.9 | -46.3 | 177.8 | 173.5 | 0 | 0 | 0 | 0 | 111.1 | V241 S242 W247 F248 W249 | V241-V245 WeakPolarHBondContact O-CG2 3.19Å; V241-V245 PolarHBondContact O-N 3.38Å; V241-V245 VanDerWaalsContact O-N 3.08Å; S242-V245 PolarHBondContact O-N 2.81Å; S242-V245 VanDerWaalsContact O-N 3.17Å; V245-W247 VanDerWaalsContact C-N 3.28Å; V245-W247 PolarHBondContact O-N 2.91Å; V245-F248 PolarHBondContact O-N 2.95Å; V245-W249 WeakPolarHBondContact O-CB 3.37Å; V245-W249 PolarHBondContact O-N 3.33Å |
| 246 | T | 96.2 | Very high | 94.7 | Very high | 24 Ų | 24 | 42.9 Ų | 42.9 | 15% | 0.147 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -66.5 | -32.1 | 179.3 | 56.7 | 0 | 0 | 0 | 0 | 112 | N208 L211 S242 F243 W249 F250 | N208-T246 PolarHBondContact ND2-O 3.19Å; N208-T246 VanDerWaalsContact OD1-CB 3.26Å; N208-T246 WeakPolarHBondContact OD1-CB 3.47Å; N208-T246 PolarHBondContact OD1-O 2.92Å; N208-T246 PolarHBondContact OD1-OG1 3.44Å; L211-T246 HydrophobicContact CD1-CG2 3.53Å; L211-T246 VanDerWaalsContact CD1-OG1 3.27Å; L211-T246 WeakPolarHBondContact CD1-OG1 3.39Å; S242-T246 WeakPolarHBondContact O-CG2 3.44Å; S242-T246 PolarHBondContact O-N 3.01Å; S242-T246 PolarHBondContact O-OG1 2.9Å; S242-T246 VanDerWaalsContact O-OG1 3.05Å; F243-T246 WeakPolarHBondContact CA-OG1 3.49Å; F243-T246 PolarHBondContact O-OG1 2.82Å; F243-T246 VanDerWaalsContact O-OG1 3.11Å; T246-W249 PolarHBondContact O-N 3.3Å; T246-F250 HydrophobicContact CG2-CE2 4.4Å; T246-F250 WeakPolarHBondContact O-CB 3.25Å; T246-F250 WeakPolarHBondContact O-CD2 3.24Å; T246-F250 PolarHBondContact O-N 3.08Å |
| 247 | W | 97.4 | Very high | 94.7 | Very high | 11 Ų | 11 | 42.9 Ų | 42.9 | 4% | 0.042 | 22% | 0.217 | C | C | . | . | I | π-helix | trans | -62.3 | -49.4 | 176.7 | -170.1 | -72.8 | 0 | 0 | 0 | 110.6 | N208 F243 V245 R251 L252 N291 W294 F295 I298 | N208-W247 HydrophobicContact CB-CE3 4.03Å; N208-W247 HydrophobicContact CB-CZ3 4.46Å; N208-W247 VanDerWaalsContact OD1-CA 3.23Å; N208-W247 WeakPolarHBondContact OD1-CA 3.15Å; N208-W247 PolarHBondContact OD1-N 3.3Å; F243-W247 HydrophobicContact CD2-CE3 4.46Å; F243-W247 HydrophobicContact CE1-CE3 4.48Å; F243-W247 AromaticContact CE2-CE3 3.43Å; F243-W247 HydrophobicContact CE2-CE3 3.43Å; F243-W247 VanDerWaalsContact CE2-CE3 3.43Å; F243-W247 AromaticContact CE2-CZ3 3.78Å; F243-W247 HydrophobicContact CE2-CZ3 3.78Å; F243-W247 HydrophobicContact CZ-CD2 4.44Å; F243-W247 AromaticContact CZ-CE3 3.44Å; F243-W247 HydrophobicContact CZ-CE3 3.44Å; F243-W247 VanDerWaalsContact CZ-CE3 3.44Å; F243-W247 AromaticContact CZ-CZ3 3.68Å; F243-W247 HydrophobicContact CZ-CZ3 3.68Å; F243-W247 VanDerWaalsContact O-CB 3.29Å; F243-W247 WeakPolarHBondContact O-CB 3.35Å; F243-W247 PolarHBondContact O-N 2.87Å; V245-W247 VanDerWaalsContact C-N 3.28Å; V245-W247 PolarHBondContact O-N 2.91Å; W247-R251 WeakPolarHBondContact O-CB 3.39Å; W247-R251 PolarHBondContact O-N 2.91Å; W247-L252 PolarHBondContact O-N 3.43Å; W247-N291 PolarHBondContact NE1-O 2.75Å; W247-N291 VanDerWaalsContact NE1-O 3.07Å; W247-W294 HydrophobicContact CH2-CB 3.82Å; W247-W294 HydrophobicContact CH2-CD2 4.33Å; W247-W294 HydrophobicContact CH2-CE3 4.03Å; W247-W294 HydrophobicContact CH2-CG 4.3Å; W247-W294 HydrophobicContact CZ2-CB 3.43Å; W247-W294 VanDerWaalsContact CZ2-CB 3.43Å; W247-W294 HydrophobicContact CZ2-CD2 4.35Å; W247-W294 AromaticContact CZ2-CE3 3.92Å; W247-W294 HydrophobicContact CZ2-CE3 3.92Å; W247-W294 HydrophobicContact CZ2-CG 4.23Å; W247-F295 HydrophobicContact CB-CD2 4.46Å; W247-F295 AromaticContact CD1-CD2 3.43Å; W247-F295 VanDerWaalsContact CD1-CD2 3.43Å; W247-F295 AromaticContact CD1-CG 3.99Å; W247-F295 HydrophobicContact CG-CD2 4.13Å; W247-I298 HydrophobicContact CB-CD1 4.02Å; W247-I298 HydrophobicContact CD2-CD1 3.34Å; W247-I298 HydrophobicContact CE3-CD1 3.56Å; W247-I298 HydrophobicContact CG-CD1 3.55Å; W247-I298 HydrophobicContact CZ2-CD1 4.46Å; W247-I298 HydrophobicContact CZ3-CD1 4.18Å |
| 248 | F | 96.6 | Very high | 94.7 | Very high | 92 Ų | 92 | 39.8 Ų | 39.8 | 40% | 0.404 | 20% | 0.2 | S | C | . | . | I | π-helix | trans | -58.6 | -52.4 | 175.5 | 177.2 | -96.1 | 0 | 0 | 0 | 110.8 | S244 V245 L252 Y253 F295 | S244-F248 PolarHBondContact O-N 3.4Å; V245-F248 PolarHBondContact O-N 2.95Å; F248-L252 HydrophobicContact CD2-CB 4.31Å; F248-L252 HydrophobicContact CD2-CD1 4.11Å; F248-L252 CarbonylContact O-C 3.49Å; F248-L252 WeakPolarHBondContact O-CA 3.32Å; F248-L252 VanDerWaalsContact O-CB 3.3Å; F248-L252 WeakPolarHBondContact O-CB 3.39Å; F248-L252 PolarHBondContact O-N 3.1Å; F248-Y253 PolarHBondContact O-N 3.37Å; F248-F295 HydrophobicContact CB-CE2 3.9Å; F248-F295 HydrophobicContact CB-CZ 4.1Å; F248-F295 HydrophobicContact CD2-CE1 4.34Å; F248-F295 HydrophobicContact CD2-CE2 4.48Å; F248-F295 AromaticContact CD2-CZ 3.92Å; F248-F295 HydrophobicContact CD2-CZ 3.92Å; F248-F295 HydrophobicContact CG-CZ 4.45Å |
| 249 | W | 96.3 | Very high | 94.8 | Very high | 111 Ų | 111 | 34 Ų | 34 | 42% | 0.42 | 17% | 0.171 | S | C | . | . | I | π-helix | trans | -67.2 | -46.2 | -171.7 | -163.5 | -89.8 | 0 | 0 | 0 | 113.4 | V245 T246 Y253 W254 | V245-W249 WeakPolarHBondContact O-CB 3.37Å; V245-W249 PolarHBondContact O-N 3.33Å; T246-W249 PolarHBondContact O-N 3.3Å; W249-Y253 HydrophobicContact CD2-CD1 4.28Å; W249-Y253 HydrophobicContact CH2-CE1 4.31Å; W249-Y253 HydrophobicContact CZ2-CD1 4.29Å; W249-Y253 HydrophobicContact CZ2-CE1 4.14Å; W249-Y253 WeakPolarHBondContact O-CB 3.27Å; W249-W254 AromaticContact CD1-CD2 3.64Å; W249-W254 AromaticContact CD1-CE2 3.62Å; W249-W254 AromaticContact CD1-CE3 3.8Å; W249-W254 AromaticContact CD1-CH2 3.94Å; W249-W254 AromaticContact CD1-CZ2 3.8Å; W249-W254 AromaticContact CD1-CZ3 3.95Å; W249-W254 AromaticContact NE1-CD2 3.56Å; W249-W254 AromaticContact NE1-CE2 3.01Å; W249-W254 AromaticContact NE1-CH2 3.57Å; W249-W254 AromaticContact NE1-CZ2 3.03Å; W249-W254 AromaticContact NE1-NE1 3.38Å; W249-W254 PolarHBondContact O-N 2.73Å |
| 250 | F | 96.6 | Very high | 94.8 | Very high | 28 Ų | 28 | 33.8 Ų | 33.8 | 12% | 0.123 | 17% | 0.169 | C | C | . | . | I | π-helix | trans | -83.7 | -44.2 | -174.8 | -74.8 | -108 | 0 | 0 | 0 | 112.6 | F203 L204 I207 T246 W254 F255 | F203-F250 HydrophobicContact CE1-CD1 4.45Å; F203-F250 AromaticContact CE1-CE1 3.9Å; F203-F250 HydrophobicContact CE1-CE1 3.9Å; F203-F250 HydrophobicContact CZ-CE1 4.09Å; L204-F250 HydrophobicContact CD2-CB 4.46Å; L204-F250 HydrophobicContact CD2-CD1 3.75Å; L204-F250 HydrophobicContact CD2-CG 4.49Å; L204-F250 WeakPolarHBondContact O-CB 3.32Å; I207-F250 HydrophobicContact CG2-CB 4.27Å; I207-F250 HydrophobicContact CG2-CD1 3.63Å; I207-F250 HydrophobicContact CG2-CD2 4.18Å; I207-F250 HydrophobicContact CG2-CE1 3.89Å; I207-F250 HydrophobicContact CG2-CE2 4.43Å; I207-F250 HydrophobicContact CG2-CG 3.78Å; I207-F250 HydrophobicContact CG2-CZ 4.29Å; T246-F250 HydrophobicContact CG2-CE2 4.4Å; T246-F250 WeakPolarHBondContact O-CB 3.25Å; T246-F250 WeakPolarHBondContact O-CD2 3.24Å; T246-F250 PolarHBondContact O-N 3.08Å; F250-W254 AromaticContact CD1-CE3 3.74Å; F250-W254 HydrophobicContact CD1-CE3 3.74Å; F250-W254 AromaticContact CD1-CZ3 3.9Å; F250-W254 HydrophobicContact CD1-CZ3 3.9Å; F250-W254 HydrophobicContact CD2-CE3 4.42Å; F250-W254 HydrophobicContact CD2-CZ3 4.45Å; F250-W254 AromaticContact CE1-CE3 3.81Å; F250-W254 HydrophobicContact CE1-CE3 3.81Å; F250-W254 AromaticContact CE1-CZ3 3.46Å; F250-W254 HydrophobicContact CE1-CZ3 3.46Å; F250-W254 VanDerWaalsContact CE1-CZ3 3.46Å; F250-W254 HydrophobicContact CE2-CE3 4.46Å; F250-W254 HydrophobicContact CE2-CZ3 4.04Å; F250-W254 HydrophobicContact CG-CE3 4.07Å; F250-W254 HydrophobicContact CG-CZ3 4.39Å; F250-W254 HydrophobicContact CZ-CE3 4.17Å; F250-W254 HydrophobicContact CZ-CH2 4.42Å; F250-W254 AromaticContact CZ-CZ3 3.53Å; F250-W254 HydrophobicContact CZ-CZ3 3.53Å; F250-F255 VanDerWaalsContact O-CB 3.32Å; F250-F255 WeakPolarHBondContact O-CB 3.45Å; F250-F255 PolarHBondContact O-N 3.34Å |
| 251 | R | 97.2 | Very high | 94.7 | Very high | 4 Ų | 4 | 33.3 Ų | 33.3 | 2% | 0.015 | 17% | 0.165 | C | C | . | . | I | π-helix | trans | -93.9 | -27.8 | -172.3 | -66.7 | 174.5 | 172.9 | -149.5 | 13.5 | 113.6 | H205 D209 W247 N291 | H205-R251 PolarHBondContact O-NE 3.37Å; H205-R251 PolarHBondContact O-NH2 2.98Å; D209-R251 IonicContact OD1-NH2 3.16Å; D209-R251 PolarHBondContact OD1-NH2 2.85Å; D209-R251 IonicContact OD2-NH2 3.99Å; D209-R251 PolarHBondContact OD2-NH2 3.48Å; W247-R251 WeakPolarHBondContact O-CB 3.39Å; W247-R251 PolarHBondContact O-N 2.91Å; R251-N291 HydrophobicContact CB-CB 4.28Å; R251-N291 WeakPolarHBondContact CD-OD1 3.32Å; R251-N291 PolarHBondContact NH1-OD1 3.49Å; R251-N291 VanDerWaalsContact NH1-OD1 3.12Å |
| 252 | L | 96.6 | Very high | 94.5 | Very high | 17 Ų | 17 | 28.8 Ų | 28.8 | 9% | 0.089 | 14% | 0.137 | C | C | . | . | I | π-helix | trans | -99.9 | -39 | 177.5 | -59.1 | -177.3 | 0 | 0 | 0 | 112.3 | Y15 W247 F248 P256 L288 N291 I292 F295 | Y15-L252 VanDerWaalsContact OH-C 3.26Å; Y15-L252 PolarHBondContact OH-O 2.92Å; W247-L252 PolarHBondContact O-N 3.43Å; F248-L252 HydrophobicContact CD2-CB 4.31Å; F248-L252 HydrophobicContact CD2-CD1 4.11Å; F248-L252 CarbonylContact O-C 3.49Å; F248-L252 WeakPolarHBondContact O-CA 3.32Å; F248-L252 VanDerWaalsContact O-CB 3.3Å; F248-L252 WeakPolarHBondContact O-CB 3.39Å; F248-L252 PolarHBondContact O-N 3.1Å; L252-P256 WeakPolarHBondContact O-CD 3.46Å; L252-P256 WeakPolarHBondContact O-CG 3.49Å; L252-L288 HydrophobicContact CD2-CD1 4.13Å; L252-N291 HydrophobicContact CD2-CB 4.29Å; L252-I292 HydrophobicContact CD2-CG1 3.73Å; L252-F295 HydrophobicContact CD1-CB 3.89Å; L252-F295 HydrophobicContact CD1-CD1 3.42Å; L252-F295 VanDerWaalsContact CD1-CD1 3.42Å; L252-F295 HydrophobicContact CD1-CD2 3.99Å; L252-F295 HydrophobicContact CD1-CE1 3.86Å; L252-F295 HydrophobicContact CD1-CE2 4.37Å; L252-F295 HydrophobicContact CD1-CG 3.48Å; L252-F295 VanDerWaalsContact CD1-CG 3.48Å; L252-F295 HydrophobicContact CD1-CZ 4.31Å |
| 253 | Y | 94.7 | Very high | 94.3 | Very high | 69 Ų | 69 | 26.8 Ų | 26.8 | 27% | 0.271 | 12% | 0.124 | S | C | . | . | I | π-helix | trans | -90.8 | -64.3 | -178.2 | -176.3 | -111 | 0 | 0 | 0 | 113.1 | M12 Y15 F248 W249 L257 | M12-Y253 HydrophobicContact CE-CE1 3.58Å; M12-Y253 WeakPolarHBondContact CE-OH 3.38Å; Y15-Y253 HydrophobicContact CE2-CD2 4.12Å; F248-Y253 PolarHBondContact O-N 3.37Å; W249-Y253 HydrophobicContact CD2-CD1 4.28Å; W249-Y253 HydrophobicContact CH2-CE1 4.31Å; W249-Y253 HydrophobicContact CZ2-CD1 4.29Å; W249-Y253 HydrophobicContact CZ2-CE1 4.14Å; W249-Y253 WeakPolarHBondContact O-CB 3.27Å; Y253-L257 HydrophobicContact CD2-CD1 3.63Å; Y253-L257 HydrophobicContact CE1-CD1 4.44Å; Y253-L257 HydrophobicContact CE2-CD1 3.37Å; Y253-L257 HydrophobicContact CG-CD1 4.27Å; Y253-L257 WeakPolarHBondContact O-CB 3.2Å; Y253-L257 VanDerWaalsContact O-CG 3.24Å; Y253-L257 WeakPolarHBondContact O-CG 3.32Å; Y253-L257 PolarHBondContact O-N 3.31Å |
| 254 | W | 94.9 | Very high | 93.9 | Very high | 51 Ų | 51 | 25.9 Ų | 25.9 | 19% | 0.193 | 12% | 0.12 | C | C | . | . | I | π-helix | trans | -68.4 | -38.7 | -176.7 | -78.6 | -12.1 | 0 | 0 | 0 | 114.1 | F124 L204 W249 F250 L257 K258 | F124-W254 HydrophobicContact CZ-CE3 4.24Å; F124-W254 HydrophobicContact CZ-CH2 4.09Å; F124-W254 HydrophobicContact CZ-CZ2 4.5Å; F124-W254 AromaticContact CZ-CZ3 3.94Å; F124-W254 HydrophobicContact CZ-CZ3 3.94Å; L204-W254 HydrophobicContact CD1-CB 4.36Å; L204-W254 HydrophobicContact CD2-CB 3.79Å; L204-W254 HydrophobicContact CD2-CD2 4.42Å; L204-W254 HydrophobicContact CD2-CE3 3.75Å; W249-W254 AromaticContact CD1-CD2 3.64Å; W249-W254 AromaticContact CD1-CE2 3.62Å; W249-W254 AromaticContact CD1-CE3 3.8Å; W249-W254 AromaticContact CD1-CH2 3.94Å; W249-W254 AromaticContact CD1-CZ2 3.8Å; W249-W254 AromaticContact CD1-CZ3 3.95Å; W249-W254 AromaticContact NE1-CD2 3.56Å; W249-W254 AromaticContact NE1-CE2 3.01Å; W249-W254 AromaticContact NE1-CH2 3.57Å; W249-W254 AromaticContact NE1-CZ2 3.03Å; W249-W254 AromaticContact NE1-NE1 3.38Å; W249-W254 PolarHBondContact O-N 2.73Å; F250-W254 AromaticContact CD1-CE3 3.74Å; F250-W254 HydrophobicContact CD1-CE3 3.74Å; F250-W254 AromaticContact CD1-CZ3 3.9Å; F250-W254 HydrophobicContact CD1-CZ3 3.9Å; F250-W254 HydrophobicContact CD2-CE3 4.42Å; F250-W254 HydrophobicContact CD2-CZ3 4.45Å; F250-W254 AromaticContact CE1-CE3 3.81Å; F250-W254 HydrophobicContact CE1-CE3 3.81Å; F250-W254 AromaticContact CE1-CZ3 3.46Å; F250-W254 HydrophobicContact CE1-CZ3 3.46Å; F250-W254 VanDerWaalsContact CE1-CZ3 3.46Å; F250-W254 HydrophobicContact CE2-CE3 4.46Å; F250-W254 HydrophobicContact CE2-CZ3 4.04Å; F250-W254 HydrophobicContact CG-CE3 4.07Å; F250-W254 HydrophobicContact CG-CZ3 4.39Å; F250-W254 HydrophobicContact CZ-CE3 4.17Å; F250-W254 HydrophobicContact CZ-CH2 4.42Å; F250-W254 AromaticContact CZ-CZ3 3.53Å; F250-W254 HydrophobicContact CZ-CZ3 3.53Å; W254-L257 PolarHBondContact O-N 3.43Å; W254-K258 HydrophobicContact CB-CD 4.39Å; W254-K258 HydrophobicContact CG-CD 4.43Å; W254-K258 VanDerWaalsContact O-CB 3.25Å; W254-K258 WeakPolarHBondContact O-CB 3.24Å; W254-K258 PolarHBondContact O-N 3.19Å |
| 255 | F | 95.8 | Very high | 93.4 | Very high | 0 Ų | 0 | 25.3 Ų | 25.3 | 0% | 0 | 12% | 0.115 | C | C | . | . | I | π-helix | trans | -60.9 | -52.2 | -179.2 | 169 | -109.2 | 0 | 0 | 0 | 112.6 | V201 L204 H205 F250 L257 V259 L260 L284 L287 L288 | V201-F255 HydrophobicContact CG1-CE2 4.35Å; V201-F255 HydrophobicContact CG2-CE2 4.04Å; L204-F255 HydrophobicContact CD1-CB 4.09Å; H205-F255 AromaticContact CE1-CD2 3.52Å; H205-F255 AromaticContact CE1-CE2 3.69Å; H205-F255 AromaticContact CE1-CG 3.84Å; F250-F255 VanDerWaalsContact O-CB 3.32Å; F250-F255 WeakPolarHBondContact O-CB 3.45Å; F250-F255 PolarHBondContact O-N 3.34Å; F255-L257 PolarHBondContact O-N 3.01Å; F255-V259 HydrophobicContact CD2-CB 3.76Å; F255-V259 HydrophobicContact CD2-CG1 4.22Å; F255-V259 HydrophobicContact CD2-CG2 3.75Å; F255-V259 HydrophobicContact CE2-CB 3.91Å; F255-V259 HydrophobicContact CE2-CG1 3.85Å; F255-V259 HydrophobicContact CE2-CG2 4.21Å; F255-V259 WeakPolarHBondContact O-CA 3.43Å; F255-V259 WeakPolarHBondContact O-CB 3.45Å; F255-V259 PolarHBondContact O-N 3.13Å; F255-L260 HydrophobicContact CE1-CD1 4.45Å; F255-L260 PolarHBondContact O-N 3.42Å; F255-L284 HydrophobicContact CE2-CD2 4.11Å; F255-L284 HydrophobicContact CZ-CB 4.39Å; F255-L284 HydrophobicContact CZ-CD2 4.08Å; F255-L287 HydrophobicContact CE2-CD2 4.41Å; F255-L287 HydrophobicContact CZ-CD2 4.07Å; F255-L287 HydrophobicContact CZ-CG 4.47Å; F255-L288 HydrophobicContact CD1-CD1 4.23Å; F255-L288 HydrophobicContact CE1-CB 3.97Å; F255-L288 HydrophobicContact CE1-CD1 4.42Å |
| 256 | P | 94.8 | Very high | 92.7 | Very high | 1 Ų | 1 | 21.2 Ų | 21.2 | 1% | 0.006 | 9% | 0.09 | C | C | . | . | I | π-helix | trans | -63.1 | -42.5 | 175.6 | -28.4 | 40.6 | 0 | 0 | 0 | 113.8 | Y15 L18 L252 L260 Y261 L288 | Y15-P256 HydrophobicContact CE1-CB 4.1Å; Y15-P256 HydrophobicContact CE1-CG 4.41Å; L18-P256 HydrophobicContact CD2-CB 3.74Å; L252-P256 WeakPolarHBondContact O-CD 3.46Å; L252-P256 WeakPolarHBondContact O-CG 3.49Å; P256-L260 HydrophobicContact CB-CD1 4.1Å; P256-L260 HydrophobicContact CG-CD1 4.38Å; P256-L260 WeakPolarHBondContact O-CB 3.39Å; P256-L260 PolarHBondContact O-N 3.38Å; P256-Y261 PolarHBondContact O-N 3.35Å; P256-L288 HydrophobicContact CG-CD1 3.72Å; P256-L288 HydrophobicContact CG-CD2 4.09Å |
| 257 | L | 91.8 | Very high | 91.9 | Very high | 1 Ų | 1 | 20.1 Ų | 20.1 | 1% | 0.005 | 8% | 0.084 | C | C | . | . | I | π-helix | trans | -78.2 | -28.9 | -172.6 | -59.4 | -179.1 | 0 | 0 | 0 | 113.5 | M12 P13 Y15 L18 Y253 W254 F255 Y261 | M12-L257 HydrophobicContact CE-CD1 4.32Å; M12-L257 HydrophobicContact CG-CB 4.48Å; P13-L257 WeakPolarHBondContact CG-O 3.28Å; P13-L257 WeakPolarHBondContact O-CD1 3.47Å; P13-L257 WeakPolarHBondContact O-CD2 3.4Å; Y15-L257 HydrophobicContact CD1-CD2 4.31Å; Y15-L257 HydrophobicContact CD2-CD2 4.41Å; Y15-L257 HydrophobicContact CG-CD2 4.22Å; L18-L257 HydrophobicContact CB-CD2 4.45Å; L18-L257 HydrophobicContact CD2-CD2 4.37Å; Y253-L257 HydrophobicContact CD2-CD1 3.63Å; Y253-L257 HydrophobicContact CE1-CD1 4.44Å; Y253-L257 HydrophobicContact CE2-CD1 3.37Å; Y253-L257 HydrophobicContact CG-CD1 4.27Å; Y253-L257 WeakPolarHBondContact O-CB 3.2Å; Y253-L257 VanDerWaalsContact O-CG 3.24Å; Y253-L257 WeakPolarHBondContact O-CG 3.32Å; Y253-L257 PolarHBondContact O-N 3.31Å; W254-L257 PolarHBondContact O-N 3.43Å; F255-L257 PolarHBondContact O-N 3.01Å; L257-Y261 WeakPolarHBondContact O-CB 3.43Å |
| 258 | K | 91.4 | Very high | 90.9 | Very high | 16 Ų | 16 | 22.5 Ų | 22.5 | 7% | 0.07 | 10% | 0.097 | C | C | . | . | I | π-helix | trans | -97.2 | -44.7 | 177.3 | -60.9 | -176.3 | 168.3 | -75.7 | 0 | 112.5 | M12 F124 P127 L200 W254 A262 | M12-K258 HydrophobicContact SD-CG 4.46Å; F124-K258 HydrophobicContact CE2-CD 4.47Å; F124-K258 PolarHBondContact O-NZ 2.87Å; P127-K258 HydrophobicContact CB-CB 4.09Å; P127-K258 HydrophobicContact CB-CG 4.49Å; P127-K258 HydrophobicContact CG-CB 3.98Å; P127-K258 HydrophobicContact CG-CD 4.35Å; P127-K258 HydrophobicContact CG-CG 3.83Å; L200-K258 HydrophobicContact CD2-CB 3.9Å; W254-K258 HydrophobicContact CB-CD 4.39Å; W254-K258 HydrophobicContact CG-CD 4.43Å; W254-K258 VanDerWaalsContact O-CB 3.25Å; W254-K258 WeakPolarHBondContact O-CB 3.24Å; W254-K258 PolarHBondContact O-N 3.19Å; K258-A262 WeakPolarHBondContact O-CB 3.36Å |
| 259 | V | 93.7 | Very high | 89.8 | Confident | 1 Ų | 1 | 23.8 Ų | 23.8 | 1% | 0.006 | 10% | 0.104 | C | C | . | . | I | π-helix | trans | -86.3 | -62 | -176.2 | -177.7 | 0 | 0 | 0 | 0 | 110.7 | V197 L200 V201 L204 F255 Y261 A262 T263 L284 | V197-V259 HydrophobicContact CG1-CG1 3.77Å; L200-V259 HydrophobicContact CB-CG2 4.34Å; L200-V259 HydrophobicContact CD2-CG2 3.7Å; L200-V259 HydrophobicContact CG-CG2 3.77Å; V201-V259 HydrophobicContact CG2-CB 4.44Å; V201-V259 HydrophobicContact CG2-CG1 3.64Å; V201-V259 HydrophobicContact CG2-CG2 4.01Å; L204-V259 HydrophobicContact CD1-CG2 3.92Å; F255-V259 HydrophobicContact CD2-CB 3.76Å; F255-V259 HydrophobicContact CD2-CG1 4.22Å; F255-V259 HydrophobicContact CD2-CG2 3.75Å; F255-V259 HydrophobicContact CE2-CB 3.91Å; F255-V259 HydrophobicContact CE2-CG1 3.85Å; F255-V259 HydrophobicContact CE2-CG2 4.21Å; F255-V259 WeakPolarHBondContact O-CA 3.43Å; F255-V259 WeakPolarHBondContact O-CB 3.45Å; F255-V259 PolarHBondContact O-N 3.13Å; V259-Y261 VanDerWaalsContact C-N 3.29Å; V259-Y261 PolarHBondContact O-N 2.82Å; V259-A262 PolarHBondContact O-N 2.79Å; V259-A262 VanDerWaalsContact O-N 3.16Å; V259-T263 HydrophobicContact CG1-CG2 4.33Å; V259-T263 WeakPolarHBondContact O-CG2 3.29Å; V259-T263 PolarHBondContact O-N 2.91Å; V259-T263 PolarHBondContact O-OG1 3.45Å; V259-L284 HydrophobicContact CG1-CD1 4.1Å; V259-L284 HydrophobicContact CG1-CD2 4.24Å |
| 260 | L | 92.4 | Very high | 88.4 | Confident | 0 Ų | 0 | 21.1 Ų | 21.1 | 0% | 0 | 10% | 0.103 | C | C | . | . | I | π-helix | trans | -62.6 | -37.9 | -174.5 | -73 | 173.1 | 0 | 0 | 0 | 112 | L18 F255 P256 T263 C264 L284 F285 L288 | L18-L260 HydrophobicContact CD1-CB 4.24Å; F255-L260 HydrophobicContact CE1-CD1 4.45Å; F255-L260 PolarHBondContact O-N 3.42Å; P256-L260 HydrophobicContact CB-CD1 4.1Å; P256-L260 HydrophobicContact CG-CD1 4.38Å; P256-L260 WeakPolarHBondContact O-CB 3.39Å; P256-L260 PolarHBondContact O-N 3.38Å; L260-T263 WeakPolarHBondContact CA-OG1 3.41Å; L260-T263 PolarHBondContact O-N 2.93Å; L260-T263 PolarHBondContact O-OG1 2.9Å; L260-C264 WeakPolarHBondContact O-CB 3.26Å; L260-C264 PolarHBondContact O-N 2.76Å; L260-C264 PolarHBondContact O-SG 3Å; L260-L284 HydrophobicContact CD2-CB 3.51Å; L260-L284 HydrophobicContact CD2-CD1 4.31Å; L260-F285 HydrophobicContact CD1-CD1 4.02Å; L260-F285 HydrophobicContact CD1-CE1 3.87Å; L260-F285 HydrophobicContact CD2-CD1 4.26Å; L260-F285 HydrophobicContact CD2-CD2 4.47Å; L260-F285 HydrophobicContact CD2-CE1 4.2Å; L260-F285 HydrophobicContact CD2-CE2 4.4Å; L260-F285 HydrophobicContact CD2-CG 4.39Å; L260-F285 HydrophobicContact CD2-CZ 4.27Å; L260-L288 HydrophobicContact CD1-CB 4.37Å; L260-L288 HydrophobicContact CD1-CD2 3.61Å |
| 261 | Y | 90.1 | Very high | 86.8 | Confident | 6 Ų | 6 | 21 Ų | 21 | 2% | 0.024 | 11% | 0.108 | C | C | . | . | H | α-helix | trans | -60.9 | -49.8 | 174.7 | -176.7 | -98 | 0 | 0 | 0 | 112 | P13 E17 L18 R21 P256 L257 V259 T263 C264 V265 | P13-Y261 HydrophobicContact CB-CD1 4.37Å; P13-Y261 HydrophobicContact CB-CD2 3.77Å; P13-Y261 HydrophobicContact CB-CE1 4.33Å; P13-Y261 HydrophobicContact CB-CE2 3.74Å; P13-Y261 HydrophobicContact CB-CG 4.09Å; P13-Y261 HydrophobicContact CG-CD1 3.67Å; P13-Y261 HydrophobicContact CG-CD2 3.71Å; P13-Y261 HydrophobicContact CG-CE1 4.02Å; P13-Y261 HydrophobicContact CG-CE2 4.07Å; P13-Y261 HydrophobicContact CG-CG 3.49Å; P13-Y261 VanDerWaalsContact CG-CG 3.49Å; E17-Y261 HydrophobicContact CG-CE2 4.16Å; L18-Y261 HydrophobicContact CB-CD2 4.47Å; L18-Y261 HydrophobicContact CD1-CD2 4.2Å; R21-Y261 PolarHBondContact NH1-OH 2.89Å; P256-Y261 PolarHBondContact O-N 3.35Å; L257-Y261 WeakPolarHBondContact O-CB 3.43Å; V259-Y261 VanDerWaalsContact C-N 3.29Å; V259-Y261 PolarHBondContact O-N 2.82Å; Y261-T263 VanDerWaalsContact C-N 3.31Å; Y261-T263 PolarHBondContact O-N 3.38Å; Y261-C264 PolarHBondContact O-N 3.03Å; Y261-V265 HydrophobicContact CD2-CB 4.5Å; Y261-V265 HydrophobicContact CD2-CG2 3.99Å; Y261-V265 HydrophobicContact CE2-CB 4.23Å; Y261-V265 HydrophobicContact CE2-CG1 4.44Å; Y261-V265 HydrophobicContact CE2-CG2 3.84Å; Y261-V265 WeakPolarHBondContact O-CB 3.47Å; Y261-V265 PolarHBondContact O-N 3.42Å |
| 262 | A | 88.7 | Confident | 84.8 | Confident | 1 Ų | 1 | 26.7 Ų | 26.7 | 1% | 0.008 | 15% | 0.146 | C | C | . | . | I | π-helix | trans | -61.8 | -41.3 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | V130 F131 K258 V259 S266 S267 | V130-A262 HydrophobicContact CG2-CB 3.81Å; F131-A262 VanDerWaalsContact CE2-O 3.32Å; F131-A262 WeakPolarHBondContact CE2-O 3.3Å; K258-A262 WeakPolarHBondContact O-CB 3.36Å; V259-A262 PolarHBondContact O-N 2.79Å; V259-A262 VanDerWaalsContact O-N 3.16Å; A262-S266 WeakPolarHBondContact O-CB 3.33Å; A262-S266 PolarHBondContact O-N 3.43Å; A262-S266 VanDerWaalsContact O-N 3.14Å; A262-S267 PolarHBondContact O-N 2.87Å |
| 263 | T | 89.4 | Confident | 83.4 | Confident | 2 Ų | 2 | 32.4 Ų | 32.4 | 1% | 0.012 | 18% | 0.177 | C | C | . | . | I | π-helix | trans | -76.7 | -27.6 | -179.3 | 62.4 | 0 | 0 | 0 | 0 | 113.7 | F131 V197 V259 L260 Y261 S267 Y277 F280 N281 L284 | F131-T263 HydrophobicContact CE2-CG2 4.12Å; F131-T263 HydrophobicContact CZ-CG2 4.09Å; V197-T263 HydrophobicContact CG1-CG2 3.62Å; V197-T263 HydrophobicContact CG2-CG2 4.28Å; V259-T263 HydrophobicContact CG1-CG2 4.33Å; V259-T263 WeakPolarHBondContact O-CG2 3.29Å; V259-T263 PolarHBondContact O-N 2.91Å; V259-T263 PolarHBondContact O-OG1 3.45Å; L260-T263 WeakPolarHBondContact CA-OG1 3.41Å; L260-T263 PolarHBondContact O-N 2.93Å; L260-T263 PolarHBondContact O-OG1 2.9Å; Y261-T263 VanDerWaalsContact C-N 3.31Å; Y261-T263 PolarHBondContact O-N 3.38Å; T263-S267 WeakPolarHBondContact O-CB 3.4Å; T263-S267 PolarHBondContact O-OG 2.95Å; T263-Y277 WeakPolarHBondContact O-CE2 3.07Å; T263-F280 HydrophobicContact CG2-CE1 4.22Å; T263-N281 VanDerWaalsContact CB-OD1 3.23Å; T263-N281 WeakPolarHBondContact CB-OD1 3.4Å; T263-N281 PolarHBondContact O-ND2 3.08Å; T263-N281 VanDerWaalsContact O-ND2 3.15Å; T263-N281 PolarHBondContact OG1-OD1 3.35Å; T263-L284 HydrophobicContact CG2-CD1 3.78Å |
| 264 | C | 87.3 | Confident | 82.4 | Confident | 1 Ų | 1 | 30.1 Ų | 30.1 | 1% | 0.007 | 17% | 0.169 | C | C | . | . | I | π-helix | trans | -84.7 | -39.7 | 177.7 | -68.2 | 0 | 0 | 0 | 0 | 112.4 | L260 Y261 Y277 N281 | L260-C264 WeakPolarHBondContact O-CB 3.26Å; L260-C264 PolarHBondContact O-N 2.76Å; L260-C264 PolarHBondContact O-SG 3Å; Y261-C264 PolarHBondContact O-N 3.03Å; C264-Y277 WeakPolarHBondContact CA-OH 3.32Å; C264-Y277 PolarHBondContact O-OH 2.89Å; C264-N281 PolarHBondContact SG-OD1 2.86Å; C264-N281 VanDerWaalsContact SG-OD1 3.35Å |
| 265 | V | 84 | Confident | 81.7 | Confident | 7 Ų | 7 | 28 Ų | 28 | 4% | 0.042 | 16% | 0.162 | C | C | . | . | I | π-helix | trans | -106.8 | -62.5 | -170.3 | -177.3 | 0 | 0 | 0 | 0 | 111.2 | R21 Y261 S267 I268 Q269 | R21-V265 HydrophobicContact CB-CG2 4.02Å; Y261-V265 HydrophobicContact CD2-CB 4.5Å; Y261-V265 HydrophobicContact CD2-CG2 3.99Å; Y261-V265 HydrophobicContact CE2-CB 4.23Å; Y261-V265 HydrophobicContact CE2-CG1 4.44Å; Y261-V265 HydrophobicContact CE2-CG2 3.84Å; Y261-V265 WeakPolarHBondContact O-CB 3.47Å; Y261-V265 PolarHBondContact O-N 3.42Å; V265-S267 PolarHBondContact O-N 3.38Å; V265-I268 PolarHBondContact O-N 3.35Å; V265-Q269 WeakPolarHBondContact O-CG 3.33Å; V265-Q269 PolarHBondContact O-N 2.9Å |
| 266 | S | 80.1 | Confident | 81 | Confident | 2 Ų | 2 | 30.1 Ų | 30.1 | 1% | 0.014 | 17% | 0.171 | C | C | . | . | I | π-helix | trans | -64.7 | -29.6 | -172.5 | -49.8 | 0 | 0 | 0 | 0 | 113.1 | A262 Q269 S270 | A262-S266 WeakPolarHBondContact O-CB 3.33Å; A262-S266 PolarHBondContact O-N 3.43Å; A262-S266 VanDerWaalsContact O-N 3.14Å; S266-Q269 PolarHBondContact O-N 3.42Å; S266-S270 WeakPolarHBondContact O-CB 3.34Å; S266-S270 PolarHBondContact O-N 2.98Å; S266-S270 PolarHBondContact O-OG 2.93Å |
| 267 | S | 81.1 | Confident | 80.5 | Confident | 1 Ų | 1 | 31 Ų | 31 | 1% | 0.007 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -60.6 | -52.6 | 176.1 | 77 | 0 | 0 | 0 | 0 | 111.1 | A262 T263 V265 Q269 S270 G271 I274 Y277 | A262-S267 PolarHBondContact O-N 2.87Å; T263-S267 WeakPolarHBondContact O-CB 3.4Å; T263-S267 PolarHBondContact O-OG 2.95Å; V265-S267 PolarHBondContact O-N 3.38Å; S267-Q269 VanDerWaalsContact C-N 3.26Å; S267-Q269 PolarHBondContact O-N 3.38Å; S267-S270 PolarHBondContact O-N 2.97Å; S267-S270 VanDerWaalsContact O-N 3.12Å; S267-G271 PolarHBondContact O-N 2.93Å; S267-I274 VanDerWaalsContact CA-CD1 3.44Å; S267-I274 VanDerWaalsContact CB-CD1 3.45Å; S267-I274 WeakPolarHBondContact O-CD1 3.38Å; S267-Y277 WeakPolarHBondContact OG-CD2 3.49Å; S267-Y277 WeakPolarHBondContact OG-CE2 3.38Å |
| 268 | I | 76.4 | Confident | 80.3 | Confident | 61 Ų | 61 | 34.3 Ų | 34.3 | 31% | 0.313 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -63.4 | -34.5 | 178.8 | -68.3 | 170.8 | 0 | 0 | 0 | 111.2 | A25 A29 V265 S270 Y277 | A25-I268 HydrophobicContact CB-CD1 4.01Å; A29-I268 HydrophobicContact CB-CD1 3.89Å; V265-I268 PolarHBondContact O-N 3.35Å; I268-S270 VanDerWaalsContact C-N 3.35Å; I268-Y277 HydrophobicContact CD1-CD2 4.47Å; I268-Y277 HydrophobicContact CD1-CE1 4.09Å; I268-Y277 HydrophobicContact CD1-CE2 3.67Å; I268-Y277 VanDerWaalsContact CD1-CZ 3.47Å; I268-Y277 WeakPolarHBondContact CD1-OH 3.4Å; I268-Y277 HydrophobicContact CG1-CD2 4.17Å; I268-Y277 HydrophobicContact CG1-CE2 3.68Å |
| 269 | Q | 73.4 | Confident | 80.2 | Confident | 119 Ų | 119 | 37.6 Ų | 37.6 | 56% | 0.556 | 20% | 0.204 | S | C | * | . | H | α-helix | trans | -70.2 | -29.9 | 177.3 | -67.8 | 177.7 | -37.7 | 0 | 0 | 113.1 | V265 S266 S267 | V265-Q269 WeakPolarHBondContact O-CG 3.33Å; V265-Q269 PolarHBondContact O-N 2.9Å; S266-Q269 PolarHBondContact O-N 3.42Å; S267-Q269 VanDerWaalsContact C-N 3.26Å; S267-Q269 PolarHBondContact O-N 3.38Å |
| 270 | S | 66.4 | Low | 80.1 | Confident | 56 Ų | 56 | 38 Ų | 38 | 39% | 0.392 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -79.7 | -19.4 | -177.5 | -59.9 | 0 | 0 | 0 | 0 | 113.2 | F131 S266 S267 I268 | F131-S270 WeakPolarHBondContact CB-OG 3.3Å; S266-S270 WeakPolarHBondContact O-CB 3.34Å; S266-S270 PolarHBondContact O-N 2.98Å; S266-S270 PolarHBondContact O-OG 2.93Å; S267-S270 PolarHBondContact O-N 2.97Å; S267-S270 VanDerWaalsContact O-N 3.12Å; I268-S270 VanDerWaalsContact C-N 3.35Å |
| 271 | G | 62.3 | Low | 80.1 | Confident | 24 Ų | 24 | 38 Ų | 38 | 25% | 0.247 | 21% | 0.206 | C | C | . | . | trans | 175.6 | 145 | 171.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | S267 N273 | S267-G271 PolarHBondContact O-N 2.93Å; G271-N273 PolarHBondContact O-N 3.49Å | ||
| 272 | P | 55.7 | Low | 80.3 | Confident | 124 Ų | 124 | 40.5 Ų | 40.5 | 81% | 0.805 | 23% | 0.227 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -70.9 | -3.6 | -170.2 | 25.8 | -33.7 | 0 | 0 | 0 | 115.7 | ||
| 273 | N | 66.3 | Low | 80.6 | Confident | 138 Ų | 138 | 41.6 Ų | 41.6 | 74% | 0.738 | 23% | 0.232 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -137.3 | 52.2 | -172.2 | -67.5 | -46.5 | 0 | 0 | 0 | 113 | G271 P275 | G271-N273 PolarHBondContact O-N 3.49Å; N273-P275 WeakPolarHBondContact O-CD 3.39Å |
| 274 | I | 75.3 | Confident | 81 | Confident | 20 Ų | 20 | 41.5 Ų | 41.5 | 10% | 0.103 | 23% | 0.232 | C | C | . | . | trans | -70.5 | 117.2 | 171 | -70.8 | -173.2 | 0 | 0 | 0 | 109.2 | F131 W134 Y194 S267 | F131-I274 HydrophobicContact CD1-CD1 3.93Å; F131-I274 HydrophobicContact CE1-CD1 4.12Å; W134-I274 HydrophobicContact CE3-CG1 4.43Å; W134-I274 HydrophobicContact CZ3-CG1 4.39Å; Y194-I274 HydrophobicContact CE1-CG2 3.9Å; Y194-I274 WeakPolarHBondContact OH-CG2 3.33Å; S267-I274 VanDerWaalsContact CA-CD1 3.44Å; S267-I274 VanDerWaalsContact CB-CD1 3.45Å; S267-I274 WeakPolarHBondContact O-CD1 3.38Å | ||
| 275 | P | 79.6 | Confident | 81.4 | Confident | 7 Ų | 7 | 45.4 Ų | 45.4 | 5% | 0.045 | 25% | 0.249 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -64.7 | 142.1 | -174.5 | 24.7 | -33.2 | 0 | 0 | 0 | 111.6 | T44 N48 W134 F192 Y194 N273 Y277 | T44-P275 HydrophobicContact CG2-CB 3.46Å; T44-P275 VanDerWaalsContact CG2-CB 3.46Å; N48-P275 HydrophobicContact CB-CB 4.13Å; N48-P275 HydrophobicContact CB-CG 4.01Å; W134-P275 HydrophobicContact CH2-CG 3.88Å; W134-P275 HydrophobicContact CZ2-CG 4.03Å; F192-P275 HydrophobicContact CB-CG 4.36Å; F192-P275 HydrophobicContact CD1-CB 3.69Å; F192-P275 HydrophobicContact CD1-CG 3.48Å; F192-P275 VanDerWaalsContact CD1-CG 3.48Å; F192-P275 HydrophobicContact CE1-CB 3.83Å; F192-P275 HydrophobicContact CE1-CG 4.14Å; F192-P275 HydrophobicContact CG-CG 4.2Å; Y194-P275 WeakPolarHBondContact OH-CD 3.19Å; Y194-P275 VanDerWaalsContact OH-CG 3.31Å; Y194-P275 WeakPolarHBondContact OH-CG 3.1Å; Y194-P275 PolarHBondContact OH-O 3.24Å; N273-P275 WeakPolarHBondContact O-CD 3.39Å; P275-Y277 PolarHBondContact O-N 3.14Å |
| 276 | F | 81.1 | Confident | 82 | Confident | 45 Ų | 45 | 46.6 Ų | 46.6 | 20% | 0.197 | 26% | 0.26 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 55.6 | 23.8 | 176.8 | -74.9 | -91.8 | 0 | 0 | 0 | 116 | S41 T44 L45 F188 F192 F278 F279 F280 | S41-F276 WeakPolarHBondContact O-CZ 3.32Å; T44-F276 HydrophobicContact CG2-CD2 3.89Å; T44-F276 HydrophobicContact CG2-CE2 3.86Å; L45-F276 HydrophobicContact CB-CE2 3.96Å; L45-F276 HydrophobicContact CB-CZ 4.04Å; L45-F276 HydrophobicContact CD1-CE2 4.13Å; L45-F276 HydrophobicContact CD1-CZ 3.99Å; F188-F276 HydrophobicContact CE1-CD1 4.39Å; F192-F276 AromaticContact CE1-CD2 3.62Å; F192-F276 HydrophobicContact CE1-CD2 3.62Å; F192-F276 HydrophobicContact CE1-CE2 4.04Å; F192-F276 HydrophobicContact CE2-CB 4.36Å; F192-F276 AromaticContact CE2-CD2 3.72Å; F192-F276 HydrophobicContact CE2-CD2 3.72Å; F192-F276 HydrophobicContact CE2-CE2 4.26Å; F192-F276 HydrophobicContact CE2-CG 4.14Å; F192-F276 AromaticContact CZ-CD2 3.14Å; F192-F276 HydrophobicContact CZ-CD2 3.14Å; F192-F276 AromaticContact CZ-CE2 3.44Å; F192-F276 HydrophobicContact CZ-CE2 3.44Å; F192-F276 VanDerWaalsContact CZ-CE2 3.44Å; F192-F276 HydrophobicContact CZ-CG 4.01Å; F192-F276 HydrophobicContact CZ-CZ 4.48Å; F276-F278 VanDerWaalsContact C-N 3.34Å; F276-F278 PolarHBondContact O-N 3.49Å; F276-F279 HydrophobicContact CB-CB 4.36Å; F276-F279 HydrophobicContact CD1-CB 3.96Å; F276-F279 HydrophobicContact CD1-CD1 4.23Å; F276-F279 HydrophobicContact CD1-CG 4.25Å; F276-F279 PolarHBondContact O-N 2.98Å; F276-F279 VanDerWaalsContact O-N 3.1Å; F276-F280 PolarHBondContact O-N 2.77Å |
| 277 | Y | 84.4 | Confident | 82.8 | Confident | 18 Ų | 18 | 46.6 Ų | 46.6 | 7% | 0.071 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -44.8 | -52.3 | 178.1 | 168.2 | -90.1 | 0 | 0 | 0 | 113.7 | M26 T263 C264 S267 I268 P275 N281 | M26-Y277 HydrophobicContact CG-CE1 4.18Å; M26-Y277 WeakPolarHBondContact CG-OH 3.35Å; T263-Y277 WeakPolarHBondContact O-CE2 3.07Å; C264-Y277 WeakPolarHBondContact CA-OH 3.32Å; C264-Y277 PolarHBondContact O-OH 2.89Å; S267-Y277 WeakPolarHBondContact OG-CD2 3.49Å; S267-Y277 WeakPolarHBondContact OG-CE2 3.38Å; I268-Y277 HydrophobicContact CD1-CD2 4.47Å; I268-Y277 HydrophobicContact CD1-CE1 4.09Å; I268-Y277 HydrophobicContact CD1-CE2 3.67Å; I268-Y277 VanDerWaalsContact CD1-CZ 3.47Å; I268-Y277 WeakPolarHBondContact CD1-OH 3.4Å; I268-Y277 HydrophobicContact CG1-CD2 4.17Å; I268-Y277 HydrophobicContact CG1-CE2 3.68Å; P275-Y277 PolarHBondContact O-N 3.14Å; Y277-N281 WeakPolarHBondContact CD2-ND2 3.19Å; Y277-N281 VanDerWaalsContact CE2-ND2 3.28Å; Y277-N281 WeakPolarHBondContact CE2-ND2 3.17Å; Y277-N281 WeakPolarHBondContact O-CB 3.42Å; Y277-N281 PolarHBondContact O-N 3.42Å; Y277-N281 PolarHBondContact O-ND2 2.99Å |
| 278 | F | 87.1 | Confident | 83.6 | Confident | 71 Ų | 71 | 47.8 Ų | 47.8 | 31% | 0.311 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -66.6 | -40.5 | -177.2 | -71.2 | -69.6 | 0 | 0 | 0 | 112.5 | A29 W30 F276 A282 | A29-F278 HydrophobicContact CB-CE1 4.47Å; A29-F278 HydrophobicContact CB-CE2 4.39Å; A29-F278 HydrophobicContact CB-CZ 3.71Å; W30-F278 HydrophobicContact CB-CE1 4.49Å; W30-F278 HydrophobicContact CB-CZ 4.2Å; W30-F278 HydrophobicContact CE3-CE1 4.31Å; W30-F278 HydrophobicContact CE3-CZ 4.28Å; F276-F278 VanDerWaalsContact C-N 3.34Å; F276-F278 PolarHBondContact O-N 3.49Å; F278-A282 WeakPolarHBondContact O-CB 3.47Å; F278-A282 PolarHBondContact O-N 2.9Å |
| 279 | F | 89.3 | Confident | 84.6 | Confident | 86 Ų | 86 | 50.7 Ų | 50.7 | 38% | 0.377 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -66.5 | -47 | -180 | 177.7 | -102.4 | 0 | 0 | 0 | 111 | F188 F276 A282 L283 | F188-F279 AromaticContact CD1-CD1 3.85Å; F188-F279 HydrophobicContact CD1-CD1 3.85Å; F188-F279 AromaticContact CD1-CE1 3.61Å; F188-F279 HydrophobicContact CD1-CE1 3.61Å; F188-F279 AromaticContact CD2-CE1 3.9Å; F188-F279 HydrophobicContact CD2-CE1 3.9Å; F188-F279 AromaticContact CE1-CD1 3.86Å; F188-F279 HydrophobicContact CE1-CD1 3.86Å; F188-F279 AromaticContact CE1-CE1 3.49Å; F188-F279 HydrophobicContact CE1-CE1 3.49Å; F188-F279 VanDerWaalsContact CE1-CE1 3.49Å; F188-F279 HydrophobicContact CE1-CZ 4.38Å; F188-F279 AromaticContact CE2-CE1 3.74Å; F188-F279 HydrophobicContact CE2-CE1 3.74Å; F188-F279 HydrophobicContact CE2-CZ 4.19Å; F188-F279 HydrophobicContact CG-CD1 4.39Å; F188-F279 AromaticContact CG-CE1 3.85Å; F188-F279 HydrophobicContact CG-CE1 3.85Å; F188-F279 HydrophobicContact CZ-CD1 4.36Å; F188-F279 AromaticContact CZ-CE1 3.55Å; F188-F279 HydrophobicContact CZ-CE1 3.55Å; F188-F279 HydrophobicContact CZ-CZ 4.05Å; F276-F279 HydrophobicContact CB-CB 4.36Å; F276-F279 HydrophobicContact CD1-CB 3.96Å; F276-F279 HydrophobicContact CD1-CD1 4.23Å; F276-F279 HydrophobicContact CD1-CG 4.25Å; F276-F279 PolarHBondContact O-N 2.98Å; F276-F279 VanDerWaalsContact O-N 3.1Å; F279-A282 PolarHBondContact O-N 3.22Å; F279-L283 HydrophobicContact CD1-CD1 4.13Å; F279-L283 HydrophobicContact CE1-CD1 3.52Å; F279-L283 HydrophobicContact CE1-CG 4.29Å; F279-L283 HydrophobicContact CZ-CD1 3.78Å; F279-L283 HydrophobicContact CZ-CD2 4.42Å; F279-L283 HydrophobicContact CZ-CG 4.24Å; F279-L283 WeakPolarHBondContact O-CG 3.36Å; F279-L283 PolarHBondContact O-N 3.48Å |
| 280 | F | 90.9 | Very high | 85.7 | Confident | 8 Ų | 8 | 46 Ų | 46 | 4% | 0.035 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -63.9 | -45.6 | 179.5 | -168.3 | -104.6 | 0 | 0 | 0 | 111.8 | L185 F188 Y194 V197 T263 F276 A282 L283 L284 | L185-F280 HydrophobicContact CD2-CD2 4.02Å; L185-F280 HydrophobicContact CD2-CE2 3.72Å; L185-F280 HydrophobicContact CD2-CZ 4.15Å; F188-F280 HydrophobicContact CB-CD2 4.45Å; Y194-F280 HydrophobicContact CD2-CD1 4.25Å; Y194-F280 HydrophobicContact CD2-CD2 4.29Å; Y194-F280 HydrophobicContact CD2-CE1 4.28Å; Y194-F280 HydrophobicContact CD2-CE2 4.34Å; Y194-F280 HydrophobicContact CD2-CG 4.25Å; Y194-F280 HydrophobicContact CD2-CZ 4.33Å; V197-F280 HydrophobicContact CG1-CE1 4.29Å; T263-F280 HydrophobicContact CG2-CE1 4.22Å; F276-F280 PolarHBondContact O-N 2.77Å; F280-A282 VanDerWaalsContact C-N 3.34Å; F280-A282 PolarHBondContact O-N 3.46Å; F280-L283 PolarHBondContact O-N 3Å; F280-L284 HydrophobicContact CD1-CD1 3.86Å; F280-L284 HydrophobicContact CD1-CG 4.44Å; F280-L284 HydrophobicContact CE1-CD1 3.66Å; F280-L284 HydrophobicContact CE1-CG 4.27Å; F280-L284 HydrophobicContact CZ-CD1 4.48Å; F280-L284 WeakPolarHBondContact O-CG 3.24Å; F280-L284 PolarHBondContact O-N 3.36Å; F280-L284 VanDerWaalsContact O-N 3.08Å |
| 281 | N | 92.7 | Very high | 87.1 | Confident | 2 Ų | 2 | 43.3 Ų | 43.3 | 1% | 0.011 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -63.7 | -38.2 | 175 | -79.4 | -69.6 | 0 | 0 | 0 | 112.1 | T263 C264 Y277 L283 L284 F285 | T263-N281 VanDerWaalsContact CB-OD1 3.23Å; T263-N281 WeakPolarHBondContact CB-OD1 3.4Å; T263-N281 PolarHBondContact O-ND2 3.08Å; T263-N281 VanDerWaalsContact O-ND2 3.15Å; T263-N281 PolarHBondContact OG1-OD1 3.35Å; C264-N281 PolarHBondContact SG-OD1 2.86Å; C264-N281 VanDerWaalsContact SG-OD1 3.35Å; Y277-N281 WeakPolarHBondContact CD2-ND2 3.19Å; Y277-N281 VanDerWaalsContact CE2-ND2 3.28Å; Y277-N281 WeakPolarHBondContact CE2-ND2 3.17Å; Y277-N281 WeakPolarHBondContact O-CB 3.42Å; Y277-N281 PolarHBondContact O-N 3.42Å; Y277-N281 PolarHBondContact O-ND2 2.99Å; N281-L283 VanDerWaalsContact C-N 3.33Å; N281-L283 PolarHBondContact O-N 3.41Å; N281-L284 PolarHBondContact O-N 2.83Å; N281-F285 HydrophobicContact CB-CD2 4.48Å; N281-F285 HydrophobicContact CB-CE2 4.42Å; N281-F285 WeakPolarHBondContact O-CD2 3.36Å; N281-F285 PolarHBondContact O-N 3.45Å |
| 282 | A | 93.9 | Very high | 88.8 | Confident | 57 Ų | 57 | 45.6 Ų | 45.6 | 47% | 0.471 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -60.6 | -41.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | F278 F279 F280 F285 A286 | F278-A282 WeakPolarHBondContact O-CB 3.47Å; F278-A282 PolarHBondContact O-N 2.9Å; F279-A282 PolarHBondContact O-N 3.22Å; F280-A282 VanDerWaalsContact C-N 3.34Å; F280-A282 PolarHBondContact O-N 3.46Å; A282-F285 PolarHBondContact O-N 3.08Å; A282-A286 WeakPolarHBondContact O-CB 3.36Å; A282-A286 PolarHBondContact O-N 2.9Å |
| 283 | L | 96.1 | Very high | 90.7 | Very high | 24 Ų | 24 | 43.9 Ų | 43.9 | 13% | 0.126 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -64.1 | -40.1 | 174 | -67.4 | 177.4 | 0 | 0 | 0 | 112.2 | I181 A184 L185 F279 F280 N281 A286 L287 | I181-L283 HydrophobicContact CG2-CD2 4.35Å; A184-L283 HydrophobicContact CB-CD1 4.01Å; L185-L283 HydrophobicContact CD1-CB 4.39Å; L185-L283 HydrophobicContact CD2-CB 3.49Å; L185-L283 VanDerWaalsContact CD2-CB 3.49Å; L185-L283 HydrophobicContact CD2-CD1 4.17Å; L185-L283 HydrophobicContact CG-CB 3.81Å; L185-L283 HydrophobicContact CG-CD1 4.26Å; F279-L283 HydrophobicContact CD1-CD1 4.13Å; F279-L283 HydrophobicContact CE1-CD1 3.52Å; F279-L283 HydrophobicContact CE1-CG 4.29Å; F279-L283 HydrophobicContact CZ-CD1 3.78Å; F279-L283 HydrophobicContact CZ-CD2 4.42Å; F279-L283 HydrophobicContact CZ-CG 4.24Å; F279-L283 WeakPolarHBondContact O-CG 3.36Å; F279-L283 PolarHBondContact O-N 3.48Å; F280-L283 PolarHBondContact O-N 3Å; N281-L283 VanDerWaalsContact C-N 3.33Å; N281-L283 PolarHBondContact O-N 3.41Å; L283-A286 PolarHBondContact O-N 3.45Å; L283-L287 PolarHBondContact O-N 2.62Å |
| 284 | L | 96.7 | Very high | 92 | Very high | 1 Ų | 1 | 38.6 Ų | 38.6 | 1% | 0.005 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -66.8 | -38.8 | 176 | -67.9 | 172.7 | 0 | 0 | 0 | 112.5 | L185 V201 F255 V259 L260 T263 F280 N281 L287 L288 | L185-L284 HydrophobicContact CD1-CD2 4.16Å; L185-L284 HydrophobicContact CD2-CD2 3.74Å; L185-L284 HydrophobicContact CD2-CG 3.88Å; V201-L284 HydrophobicContact CG2-CD2 4.16Å; F255-L284 HydrophobicContact CE2-CD2 4.11Å; F255-L284 HydrophobicContact CZ-CB 4.39Å; F255-L284 HydrophobicContact CZ-CD2 4.08Å; V259-L284 HydrophobicContact CG1-CD1 4.1Å; V259-L284 HydrophobicContact CG1-CD2 4.24Å; L260-L284 HydrophobicContact CD2-CB 3.51Å; L260-L284 HydrophobicContact CD2-CD1 4.31Å; T263-L284 HydrophobicContact CG2-CD1 3.78Å; F280-L284 HydrophobicContact CD1-CD1 3.86Å; F280-L284 HydrophobicContact CD1-CG 4.44Å; F280-L284 HydrophobicContact CE1-CD1 3.66Å; F280-L284 HydrophobicContact CE1-CG 4.27Å; F280-L284 HydrophobicContact CZ-CD1 4.48Å; F280-L284 WeakPolarHBondContact O-CG 3.24Å; F280-L284 PolarHBondContact O-N 3.36Å; F280-L284 VanDerWaalsContact O-N 3.08Å; N281-L284 PolarHBondContact O-N 2.83Å; L284-L287 WeakPolarHBondContact O-CB 3.2Å; L284-L287 PolarHBondContact O-N 3.49Å; L284-L288 PolarHBondContact O-N 2.94Å |
| 285 | F | 96.6 | Very high | 93 | Very high | 82 Ų | 82 | 39.7 Ų | 39.7 | 36% | 0.36 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -66.7 | -38.7 | 172.7 | -79.6 | -63.8 | 0 | 0 | 0 | 112 | M26 L260 N281 A282 L287 L288 L289 | M26-F285 HydrophobicContact CE-CE2 4.2Å; M26-F285 HydrophobicContact SD-CE2 3.95Å; M26-F285 HydrophobicContact SD-CZ 4.39Å; L260-F285 HydrophobicContact CD1-CD1 4.02Å; L260-F285 HydrophobicContact CD1-CE1 3.87Å; L260-F285 HydrophobicContact CD2-CD1 4.26Å; L260-F285 HydrophobicContact CD2-CD2 4.47Å; L260-F285 HydrophobicContact CD2-CE1 4.2Å; L260-F285 HydrophobicContact CD2-CE2 4.4Å; L260-F285 HydrophobicContact CD2-CG 4.39Å; L260-F285 HydrophobicContact CD2-CZ 4.27Å; N281-F285 HydrophobicContact CB-CD2 4.48Å; N281-F285 HydrophobicContact CB-CE2 4.42Å; N281-F285 WeakPolarHBondContact O-CD2 3.36Å; N281-F285 PolarHBondContact O-N 3.45Å; A282-F285 PolarHBondContact O-N 3.08Å; F285-L287 VanDerWaalsContact C-N 3.31Å; F285-L287 PolarHBondContact O-N 3.3Å; F285-L288 WeakPolarHBondContact O-CB 3.46Å; F285-L288 PolarHBondContact O-N 3.14Å; F285-L289 PolarHBondContact O-N 3.4Å |
| 286 | A | 97.3 | Very high | 93.8 | Very high | 33 Ų | 33 | 44 Ų | 44 | 27% | 0.273 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -60.8 | -43.5 | 172.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | I181 A282 L283 L288 L289 M290 | I181-A286 HydrophobicContact CD1-CB 4.11Å; A282-A286 WeakPolarHBondContact O-CB 3.36Å; A282-A286 PolarHBondContact O-N 2.9Å; L283-A286 PolarHBondContact O-N 3.45Å; A286-L288 PolarHBondContact O-N 3.4Å; A286-L289 PolarHBondContact O-N 3Å; A286-M290 VanDerWaalsContact O-CG 3.31Å; A286-M290 WeakPolarHBondContact O-CG 3.37Å; A286-M290 PolarHBondContact O-N 3.15Å |
| 287 | L | 97.2 | Very high | 94.3 | Very high | 2 Ų | 2 | 47 Ų | 47 | 1% | 0.01 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -60.4 | -42.7 | 174.1 | -172.5 | 63.7 | 0 | 0 | 0 | 111.9 | T182 L185 V201 F255 L283 L284 F285 M290 N291 | T182-L287 HydrophobicContact CG2-CD1 4.01Å; L185-L287 HydrophobicContact CD1-CB 4.32Å; L185-L287 HydrophobicContact CD1-CD2 3.83Å; V201-L287 HydrophobicContact CG1-CD2 4.07Å; F255-L287 HydrophobicContact CE2-CD2 4.41Å; F255-L287 HydrophobicContact CZ-CD2 4.07Å; F255-L287 HydrophobicContact CZ-CG 4.47Å; L283-L287 PolarHBondContact O-N 2.62Å; L284-L287 WeakPolarHBondContact O-CB 3.2Å; L284-L287 PolarHBondContact O-N 3.49Å; F285-L287 VanDerWaalsContact C-N 3.31Å; F285-L287 PolarHBondContact O-N 3.3Å; L287-M290 PolarHBondContact O-N 3.45Å; L287-N291 PolarHBondContact O-N 3.16Å; L287-N291 PolarHBondContact O-ND2 2.97Å; L287-N291 VanDerWaalsContact O-ND2 3.11Å |
| 288 | L | 97.5 | Very high | 94.7 | Very high | 25 Ų | 25 | 46.8 Ų | 46.8 | 13% | 0.131 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -59.6 | -46.2 | 173.9 | -179.6 | 57.4 | 0 | 0 | 0 | 111.9 | L252 F255 P256 L260 L284 F285 A286 M290 N291 I292 | L252-L288 HydrophobicContact CD2-CD1 4.13Å; F255-L288 HydrophobicContact CD1-CD1 4.23Å; F255-L288 HydrophobicContact CE1-CB 3.97Å; F255-L288 HydrophobicContact CE1-CD1 4.42Å; P256-L288 HydrophobicContact CG-CD1 3.72Å; P256-L288 HydrophobicContact CG-CD2 4.09Å; L260-L288 HydrophobicContact CD1-CB 4.37Å; L260-L288 HydrophobicContact CD1-CD2 3.61Å; L284-L288 PolarHBondContact O-N 2.94Å; F285-L288 WeakPolarHBondContact O-CB 3.46Å; F285-L288 PolarHBondContact O-N 3.14Å; A286-L288 PolarHBondContact O-N 3.4Å; L288-M290 VanDerWaalsContact C-N 3.28Å; L288-M290 PolarHBondContact O-N 3.02Å; L288-N291 WeakPolarHBondContact O-CB 3.2Å; L288-N291 PolarHBondContact O-N 2.89Å; L288-N291 VanDerWaalsContact O-N 3.1Å; L288-I292 HydrophobicContact CD1-CD1 4.34Å; L288-I292 HydrophobicContact CD1-CG1 4.38Å; L288-I292 HydrophobicContact CG-CD1 4.07Å; L288-I292 WeakPolarHBondContact O-CG1 3.22Å; L288-I292 PolarHBondContact O-N 2.85Å |
| 289 | L | 97.3 | Very high | 95 | Very high | 122 Ų | 122 | 46.4 Ų | 46.4 | 64% | 0.639 | 24% | 0.237 | S | C | * | . | H | α-helix | trans | -60 | -40.8 | -179.8 | -177.5 | 64.2 | 0 | 0 | 0 | 111.4 | F285 A286 I292 Y293 | F285-L289 PolarHBondContact O-N 3.4Å; A286-L289 PolarHBondContact O-N 3Å; L289-I292 PolarHBondContact O-N 3.39Å; L289-Y293 WeakPolarHBondContact O-CB 3.38Å; L289-Y293 PolarHBondContact O-N 3.35Å |
| 290 | M | 95.9 | Very high | 95.1 | Very high | 20 Ų | 20 | 46.4 Ų | 46.4 | 10% | 0.099 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -64.9 | -40.8 | 174.6 | -62.9 | -179.3 | 79.7 | 0 | 0 | 112 | V174 H178 I181 A286 L287 L288 I292 Y293 W294 | V174-M290 HydrophobicContact CG1-CE 3.52Å; V174-M290 WeakPolarHBondContact O-CE 3.46Å; H178-M290 HydrophobicContact CB-CE 3.47Å; H178-M290 VanDerWaalsContact CB-CE 3.47Å; H178-M290 HydrophobicContact CB-SD 4.25Å; I181-M290 HydrophobicContact CD1-SD 3.86Å; A286-M290 VanDerWaalsContact O-CG 3.31Å; A286-M290 WeakPolarHBondContact O-CG 3.37Å; A286-M290 PolarHBondContact O-N 3.15Å; L287-M290 PolarHBondContact O-N 3.45Å; L288-M290 VanDerWaalsContact C-N 3.28Å; L288-M290 PolarHBondContact O-N 3.02Å; M290-I292 VanDerWaalsContact C-N 3.32Å; M290-I292 PolarHBondContact O-N 2.73Å; M290-Y293 WeakPolarHBondContact O-CB 3.47Å; M290-Y293 PolarHBondContact O-N 2.68Å; M290-W294 HydrophobicContact CB-CE3 4.14Å; M290-W294 HydrophobicContact CB-CH2 4.16Å; M290-W294 HydrophobicContact CB-CZ3 3.76Å; M290-W294 HydrophobicContact CE-CH2 3.75Å; M290-W294 HydrophobicContact CE-CZ2 4.07Å; M290-W294 HydrophobicContact CE-CZ3 4.48Å; M290-W294 PolarHBondContact O-N 2.86Å |
| 291 | N | 96.8 | Very high | 95 | Very high | 0 Ų | 0 | 50.9 Ų | 50.9 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -62.6 | -37.4 | 175.1 | -74.9 | -44.2 | 0 | 0 | 0 | 112.6 | H205 W247 R251 L252 L287 L288 F295 | H205-N291 PolarHBondContact NE2-ND2 2.75Å; W247-N291 PolarHBondContact NE1-O 2.75Å; W247-N291 VanDerWaalsContact NE1-O 3.07Å; R251-N291 HydrophobicContact CB-CB 4.28Å; R251-N291 WeakPolarHBondContact CD-OD1 3.32Å; R251-N291 PolarHBondContact NH1-OD1 3.49Å; R251-N291 VanDerWaalsContact NH1-OD1 3.12Å; L252-N291 HydrophobicContact CD2-CB 4.29Å; L287-N291 PolarHBondContact O-N 3.16Å; L287-N291 PolarHBondContact O-ND2 2.97Å; L287-N291 VanDerWaalsContact O-ND2 3.11Å; L288-N291 WeakPolarHBondContact O-CB 3.2Å; L288-N291 PolarHBondContact O-N 2.89Å; L288-N291 VanDerWaalsContact O-N 3.1Å; N291-F295 VanDerWaalsContact O-CB 3.29Å; N291-F295 WeakPolarHBondContact O-CB 3.39Å; N291-F295 PolarHBondContact O-N 3.38Å |
| 292 | I | 96.9 | Very high | 94.9 | Very high | 72 Ų | 72 | 52.9 Ų | 52.9 | 37% | 0.369 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -65.7 | -48.1 | 172.4 | -66.1 | 167.1 | 0 | 0 | 0 | 110 | L252 L288 L289 M290 W294 F295 L296 | L252-I292 HydrophobicContact CD2-CG1 3.73Å; L288-I292 HydrophobicContact CD1-CD1 4.34Å; L288-I292 HydrophobicContact CD1-CG1 4.38Å; L288-I292 HydrophobicContact CG-CD1 4.07Å; L288-I292 WeakPolarHBondContact O-CG1 3.22Å; L288-I292 PolarHBondContact O-N 2.85Å; L289-I292 PolarHBondContact O-N 3.39Å; M290-I292 VanDerWaalsContact C-N 3.32Å; M290-I292 PolarHBondContact O-N 2.73Å; I292-W294 VanDerWaalsContact C-N 3.34Å; I292-W294 PolarHBondContact O-N 3.27Å; I292-F295 WeakPolarHBondContact O-CB 3.14Å; I292-F295 PolarHBondContact O-N 3.2Å; I292-F295 VanDerWaalsContact O-N 3.13Å; I292-L296 WeakPolarHBondContact O-CG 3.37Å; I292-L296 PolarHBondContact O-N 3.5Å |
| 293 | Y | 95.4 | Very high | 94.7 | Very high | 89 Ų | 89 | 53.4 Ų | 53.4 | 35% | 0.349 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -52.3 | -50.4 | 177.8 | 167.5 | -94.2 | 0 | 0 | 0 | 111.9 | V174 L289 M290 L296 F297 | V174-Y293 HydrophobicContact CG1-CD1 4.36Å; V174-Y293 HydrophobicContact CG1-CE1 4.12Å; V174-Y293 HydrophobicContact CG2-CE1 4.41Å; L289-Y293 WeakPolarHBondContact O-CB 3.38Å; L289-Y293 PolarHBondContact O-N 3.35Å; M290-Y293 WeakPolarHBondContact O-CB 3.47Å; M290-Y293 PolarHBondContact O-N 2.68Å; Y293-L296 PolarHBondContact O-N 2.73Å; Y293-F297 HydrophobicContact CD1-CD2 4.46Å; Y293-F297 HydrophobicContact CD1-CE2 4.15Å; Y293-F297 HydrophobicContact CD2-CE2 4.06Å; Y293-F297 HydrophobicContact CE1-CD2 4.17Å; Y293-F297 AromaticContact CE1-CE2 3.62Å; Y293-F297 HydrophobicContact CE1-CE2 3.62Å; Y293-F297 AromaticContact CE2-CE2 3.54Å; Y293-F297 HydrophobicContact CE2-CE2 3.54Å; Y293-F297 HydrophobicContact CE2-CZ 4.13Å; Y293-F297 HydrophobicContact CG-CE2 4.35Å; Y293-F297 AromaticContact CZ-CE2 3.28Å; Y293-F297 AromaticContact CZ-CZ 3.9Å; Y293-F297 VanDerWaalsContact O-CD2 3.25Å; Y293-F297 WeakPolarHBondContact O-CD2 3.13Å; Y293-F297 WeakPolarHBondContact OH-CE2 3.32Å |
| 294 | W | 95.3 | Very high | 94.2 | Very high | 26 Ų | 26 | 58.7 Ų | 58.7 | 10% | 0.098 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -69.3 | -36.4 | 177.6 | -70.5 | -52.8 | 0 | 0 | 0 | 113.2 | V174 M175 H178 W247 M290 I292 L296 F297 I298 | V174-W294 HydrophobicContact CG1-CZ2 3.9Å; M175-W294 HydrophobicContact SD-CH2 4.05Å; M175-W294 HydrophobicContact SD-CZ2 3.47Å; M175-W294 WeakPolarHBondContact SD-CZ2 3.31Å; H178-W294 HydrophobicContact CB-CH2 3.77Å; H178-W294 HydrophobicContact CB-CZ2 4.4Å; H178-W294 AromaticContact CG-CH2 3.64Å; H178-W294 AromaticContact ND1-CH2 3.68Å; H178-W294 AromaticContact ND1-CZ3 3.98Å; W247-W294 HydrophobicContact CH2-CB 3.82Å; W247-W294 HydrophobicContact CH2-CD2 4.33Å; W247-W294 HydrophobicContact CH2-CE3 4.03Å; W247-W294 HydrophobicContact CH2-CG 4.3Å; W247-W294 HydrophobicContact CZ2-CB 3.43Å; W247-W294 VanDerWaalsContact CZ2-CB 3.43Å; W247-W294 HydrophobicContact CZ2-CD2 4.35Å; W247-W294 AromaticContact CZ2-CE3 3.92Å; W247-W294 HydrophobicContact CZ2-CE3 3.92Å; W247-W294 HydrophobicContact CZ2-CG 4.23Å; M290-W294 HydrophobicContact CB-CE3 4.14Å; M290-W294 HydrophobicContact CB-CH2 4.16Å; M290-W294 HydrophobicContact CB-CZ3 3.76Å; M290-W294 HydrophobicContact CE-CH2 3.75Å; M290-W294 HydrophobicContact CE-CZ2 4.07Å; M290-W294 HydrophobicContact CE-CZ3 4.48Å; M290-W294 PolarHBondContact O-N 2.86Å; I292-W294 VanDerWaalsContact C-N 3.34Å; I292-W294 PolarHBondContact O-N 3.27Å; W294-L296 PolarHBondContact O-N 2.69Å; W294-F297 WeakPolarHBondContact O-CB 3.38Å; W294-F297 PolarHBondContact O-N 2.81Å; W294-I298 WeakPolarHBondContact O-CG1 2.99Å; W294-I298 PolarHBondContact O-N 2.88Å |
| 295 | F | 96 | Very high | 93.6 | Very high | 43 Ų | 43 | 62 Ų | 62 | 19% | 0.189 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -58.8 | -37.1 | 176 | -174.3 | -113.7 | 0 | 0 | 0 | 112.2 | W247 F248 L252 N291 I292 F297 I298 V299 | W247-F295 HydrophobicContact CB-CD2 4.46Å; W247-F295 AromaticContact CD1-CD2 3.43Å; W247-F295 VanDerWaalsContact CD1-CD2 3.43Å; W247-F295 AromaticContact CD1-CG 3.99Å; W247-F295 HydrophobicContact CG-CD2 4.13Å; F248-F295 HydrophobicContact CB-CE2 3.9Å; F248-F295 HydrophobicContact CB-CZ 4.1Å; F248-F295 HydrophobicContact CD2-CE1 4.34Å; F248-F295 HydrophobicContact CD2-CE2 4.48Å; F248-F295 AromaticContact CD2-CZ 3.92Å; F248-F295 HydrophobicContact CD2-CZ 3.92Å; F248-F295 HydrophobicContact CG-CZ 4.45Å; L252-F295 HydrophobicContact CD1-CB 3.89Å; L252-F295 HydrophobicContact CD1-CD1 3.42Å; L252-F295 VanDerWaalsContact CD1-CD1 3.42Å; L252-F295 HydrophobicContact CD1-CD2 3.99Å; L252-F295 HydrophobicContact CD1-CE1 3.86Å; L252-F295 HydrophobicContact CD1-CE2 4.37Å; L252-F295 HydrophobicContact CD1-CG 3.48Å; L252-F295 VanDerWaalsContact CD1-CG 3.48Å; L252-F295 HydrophobicContact CD1-CZ 4.31Å; N291-F295 VanDerWaalsContact O-CB 3.29Å; N291-F295 WeakPolarHBondContact O-CB 3.39Å; N291-F295 PolarHBondContact O-N 3.38Å; I292-F295 WeakPolarHBondContact O-CB 3.14Å; I292-F295 PolarHBondContact O-N 3.2Å; I292-F295 VanDerWaalsContact O-N 3.13Å; F295-F297 VanDerWaalsContact C-N 3.3Å; F295-F297 PolarHBondContact O-N 2.72Å; F295-I298 WeakPolarHBondContact O-CB 3.2Å; F295-I298 PolarHBondContact O-N 2.87Å; F295-I298 VanDerWaalsContact O-N 3.09Å; F295-V299 HydrophobicContact CD1-CG2 4.09Å; F295-V299 HydrophobicContact CE1-CG2 3.69Å; F295-V299 HydrophobicContact CE2-CG2 4.25Å; F295-V299 HydrophobicContact CZ-CG2 3.78Å; F295-V299 WeakPolarHBondContact O-CG2 3.23Å; F295-V299 PolarHBondContact O-N 3.49Å |
| 296 | L | 95.3 | Very high | 93 | Very high | 99 Ų | 99 | 63.4 Ų | 63.4 | 52% | 0.518 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -59.7 | -39.9 | 174.1 | -64.2 | 174.3 | 0 | 0 | 0 | 111.8 | I292 Y293 W294 V299 I300 | I292-L296 WeakPolarHBondContact O-CG 3.37Å; I292-L296 PolarHBondContact O-N 3.5Å; Y293-L296 PolarHBondContact O-N 2.73Å; W294-L296 PolarHBondContact O-N 2.69Å; L296-V299 PolarHBondContact O-N 3.14Å; L296-I300 WeakPolarHBondContact O-CB 3.34Å; L296-I300 WeakPolarHBondContact O-CD1 3.45Å; L296-I300 WeakPolarHBondContact O-CG1 3.41Å; L296-I300 PolarHBondContact O-N 3.1Å |
| 297 | F | 92.1 | Very high | 92.3 | Very high | 106 Ų | 106 | 68.1 Ų | 68.1 | 47% | 0.465 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -66.2 | -37.6 | 173.7 | -72.3 | -79.2 | 0 | 0 | 0 | 112.7 | Y293 W294 F295 I300 F301 | Y293-F297 HydrophobicContact CD1-CD2 4.46Å; Y293-F297 HydrophobicContact CD1-CE2 4.15Å; Y293-F297 HydrophobicContact CD2-CE2 4.06Å; Y293-F297 HydrophobicContact CE1-CD2 4.17Å; Y293-F297 AromaticContact CE1-CE2 3.62Å; Y293-F297 HydrophobicContact CE1-CE2 3.62Å; Y293-F297 AromaticContact CE2-CE2 3.54Å; Y293-F297 HydrophobicContact CE2-CE2 3.54Å; Y293-F297 HydrophobicContact CE2-CZ 4.13Å; Y293-F297 HydrophobicContact CG-CE2 4.35Å; Y293-F297 AromaticContact CZ-CE2 3.28Å; Y293-F297 AromaticContact CZ-CZ 3.9Å; Y293-F297 VanDerWaalsContact O-CD2 3.25Å; Y293-F297 WeakPolarHBondContact O-CD2 3.13Å; Y293-F297 WeakPolarHBondContact OH-CE2 3.32Å; W294-F297 WeakPolarHBondContact O-CB 3.38Å; W294-F297 PolarHBondContact O-N 2.81Å; F295-F297 VanDerWaalsContact C-N 3.3Å; F295-F297 PolarHBondContact O-N 2.72Å; F297-I300 PolarHBondContact O-N 3.04Å; F297-F301 VanDerWaalsContact O-CB 3.28Å; F297-F301 WeakPolarHBondContact O-CB 3.42Å; F297-F301 PolarHBondContact O-N 3.1Å |
| 298 | I | 92.9 | Very high | 91.5 | Very high | 14 Ų | 14 | 72 Ų | 72 | 7% | 0.072 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -62.3 | -47.6 | 176.6 | -62.6 | 172.7 | 0 | 0 | 0 | 109.9 | F243 S244 W247 W294 F295 I300 F301 V302 | F243-I298 HydrophobicContact CD1-CD1 4.41Å; F243-I298 HydrophobicContact CE1-CD1 3.45Å; F243-I298 VanDerWaalsContact CE1-CD1 3.45Å; F243-I298 HydrophobicContact CE1-CG1 3.74Å; F243-I298 HydrophobicContact CE1-CG2 4.34Å; F243-I298 HydrophobicContact CZ-CD1 3.54Å; F243-I298 HydrophobicContact CZ-CG1 4.22Å; S244-I298 VanDerWaalsContact OG-CG2 3.28Å; S244-I298 WeakPolarHBondContact OG-CG2 3.31Å; W247-I298 HydrophobicContact CB-CD1 4.02Å; W247-I298 HydrophobicContact CD2-CD1 3.34Å; W247-I298 HydrophobicContact CE3-CD1 3.56Å; W247-I298 HydrophobicContact CG-CD1 3.55Å; W247-I298 HydrophobicContact CZ2-CD1 4.46Å; W247-I298 HydrophobicContact CZ3-CD1 4.18Å; W294-I298 WeakPolarHBondContact O-CG1 2.99Å; W294-I298 PolarHBondContact O-N 2.88Å; F295-I298 WeakPolarHBondContact O-CB 3.2Å; F295-I298 PolarHBondContact O-N 2.87Å; F295-I298 VanDerWaalsContact O-N 3.09Å; I298-I300 PolarHBondContact O-N 3.48Å; I298-F301 WeakPolarHBondContact O-CB 3.39Å; I298-F301 PolarHBondContact O-N 3.16Å; I298-F301 VanDerWaalsContact O-N 3.16Å; I298-V302 HydrophobicContact CG2-CG2 4.42Å; I298-V302 WeakPolarHBondContact O-CG2 3.17Å; I298-V302 PolarHBondContact O-N 3.41Å |
| 299 | V | 93.3 | Very high | 90.4 | Very high | 64 Ų | 64 | 77 Ų | 77 | 39% | 0.388 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -60.3 | -47.1 | 176.7 | 172.8 | 0 | 0 | 0 | 0 | 111 | F295 L296 F301 V302 V303 | F295-V299 HydrophobicContact CD1-CG2 4.09Å; F295-V299 HydrophobicContact CE1-CG2 3.69Å; F295-V299 HydrophobicContact CE2-CG2 4.25Å; F295-V299 HydrophobicContact CZ-CG2 3.78Å; F295-V299 WeakPolarHBondContact O-CG2 3.23Å; F295-V299 PolarHBondContact O-N 3.49Å; L296-V299 PolarHBondContact O-N 3.14Å; V299-F301 VanDerWaalsContact C-N 3.26Å; V299-F301 PolarHBondContact O-N 2.98Å; V299-V302 PolarHBondContact O-N 2.76Å; V299-V303 HydrophobicContact CG1-CG2 4.41Å; V299-V303 WeakPolarHBondContact O-CG2 3Å; V299-V303 PolarHBondContact O-N 2.95Å |
| 300 | I | 91.9 | Very high | 89.3 | Confident | 86 Ų | 86 | 77.2 Ų | 77.2 | 44% | 0.441 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -58.9 | -40.8 | 176.6 | -69.5 | 165.3 | 0 | 0 | 0 | 111 | L296 F297 I298 K304 | L296-I300 WeakPolarHBondContact O-CB 3.34Å; L296-I300 WeakPolarHBondContact O-CD1 3.45Å; L296-I300 WeakPolarHBondContact O-CG1 3.41Å; L296-I300 PolarHBondContact O-N 3.1Å; F297-I300 PolarHBondContact O-N 3.04Å; I298-I300 PolarHBondContact O-N 3.48Å; I300-K304 HydrophobicContact CG2-CD 4.23Å; I300-K304 WeakPolarHBondContact O-CB 3.25Å; I300-K304 VanDerWaalsContact O-CG 3.29Å; I300-K304 WeakPolarHBondContact O-CG 3.41Å; I300-K304 PolarHBondContact O-N 3.06Å; I300-K304 VanDerWaalsContact O-N 3.09Å |
| 301 | F | 88.7 | Confident | 88 | Confident | 101 Ų | 101 | 79.4 Ų | 79.4 | 44% | 0.443 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -65.4 | -47.9 | 177.5 | 173 | -105.9 | 0 | 0 | 0 | 111.9 | F297 I298 V299 V303 K304 L305 | F297-F301 VanDerWaalsContact O-CB 3.28Å; F297-F301 WeakPolarHBondContact O-CB 3.42Å; F297-F301 PolarHBondContact O-N 3.1Å; I298-F301 WeakPolarHBondContact O-CB 3.39Å; I298-F301 PolarHBondContact O-N 3.16Å; I298-F301 VanDerWaalsContact O-N 3.16Å; V299-F301 VanDerWaalsContact C-N 3.26Å; V299-F301 PolarHBondContact O-N 2.98Å; F301-V303 PolarHBondContact O-N 3.24Å; F301-K304 WeakPolarHBondContact O-CB 2.96Å; F301-K304 PolarHBondContact O-N 3.04Å; F301-L305 HydrophobicContact CD1-CD1 3.98Å; F301-L305 HydrophobicContact CD1-CG 4.4Å; F301-L305 HydrophobicContact CD2-CG 4.44Å; F301-L305 HydrophobicContact CE1-CD1 3.32Å; F301-L305 HydrophobicContact CE1-CG 4.02Å; F301-L305 HydrophobicContact CE2-CD1 4.17Å; F301-L305 HydrophobicContact CE2-CD2 4.07Å; F301-L305 HydrophobicContact CE2-CG 4.05Å; F301-L305 HydrophobicContact CZ-CD1 3.44Å; F301-L305 VanDerWaalsContact CZ-CD1 3.44Å; F301-L305 HydrophobicContact CZ-CD2 4Å; F301-L305 HydrophobicContact CZ-CG 3.83Å; F301-L305 WeakPolarHBondContact O-CG 3.39Å; F301-L305 PolarHBondContact O-N 3.34Å |
| 302 | V | 89.4 | Confident | 86.5 | Confident | 44 Ų | 44 | 83.4 Ų | 83.4 | 27% | 0.267 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -60.8 | -45.4 | 178 | 171.3 | 0 | 0 | 0 | 0 | 111.1 | S244 I298 V299 K304 L305 L306 | S244-V302 VanDerWaalsContact OG-CG2 3.31Å; S244-V302 WeakPolarHBondContact OG-CG2 3.41Å; I298-V302 HydrophobicContact CG2-CG2 4.42Å; I298-V302 WeakPolarHBondContact O-CG2 3.17Å; I298-V302 PolarHBondContact O-N 3.41Å; V299-V302 PolarHBondContact O-N 2.76Å; V302-K304 VanDerWaalsContact C-N 3.28Å; V302-K304 PolarHBondContact O-N 3.34Å; V302-L305 PolarHBondContact O-N 2.92Å; V302-L305 VanDerWaalsContact O-N 3.14Å; V302-L306 HydrophobicContact CG1-CD1 4.14Å; V302-L306 HydrophobicContact CG1-CG 4.41Å; V302-L306 WeakPolarHBondContact O-CG 3.14Å; V302-L306 PolarHBondContact O-N 3.33Å |
| 303 | V | 89.6 | Confident | 85.3 | Confident | 69 Ų | 69 | 83 Ų | 83 | 42% | 0.418 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -60.1 | -40.3 | 176.6 | 171.3 | 0 | 0 | 0 | 0 | 111.2 | V299 F301 K307 | V299-V303 HydrophobicContact CG1-CG2 4.41Å; V299-V303 WeakPolarHBondContact O-CG2 3Å; V299-V303 PolarHBondContact O-N 2.95Å; F301-V303 PolarHBondContact O-N 3.24Å; V303-K307 HydrophobicContact CG1-CD 4.37Å; V303-K307 WeakPolarHBondContact O-CG 3.36Å; V303-K307 PolarHBondContact O-N 3.17Å; V303-K307 VanDerWaalsContact O-N 3.09Å |
| 304 | K | 87.1 | Confident | 83.9 | Confident | 135 Ų | 135 | 82.3 Ų | 82.3 | 59% | 0.587 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -64.9 | -42.3 | 174.9 | -76.3 | 174.9 | 179.2 | -179.9 | 0 | 112.1 | I300 F301 V302 K307 V308 | I300-K304 HydrophobicContact CG2-CD 4.23Å; I300-K304 WeakPolarHBondContact O-CB 3.25Å; I300-K304 VanDerWaalsContact O-CG 3.29Å; I300-K304 WeakPolarHBondContact O-CG 3.41Å; I300-K304 PolarHBondContact O-N 3.06Å; I300-K304 VanDerWaalsContact O-N 3.09Å; F301-K304 WeakPolarHBondContact O-CB 2.96Å; F301-K304 PolarHBondContact O-N 3.04Å; V302-K304 VanDerWaalsContact C-N 3.28Å; V302-K304 PolarHBondContact O-N 3.34Å; K304-K307 PolarHBondContact O-N 3.12Å; K304-V308 WeakPolarHBondContact O-CG2 3.45Å; K304-V308 PolarHBondContact O-N 3.22Å |
| 305 | L | 83.9 | Confident | 82.2 | Confident | 70 Ų | 70 | 88 Ų | 88 | 37% | 0.366 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -61.9 | -44.2 | 177.2 | -73.2 | -175.1 | 0 | 0 | 0 | 111.9 | F301 V302 V308 K309 | F301-L305 HydrophobicContact CD1-CD1 3.98Å; F301-L305 HydrophobicContact CD1-CG 4.4Å; F301-L305 HydrophobicContact CD2-CG 4.44Å; F301-L305 HydrophobicContact CE1-CD1 3.32Å; F301-L305 HydrophobicContact CE1-CG 4.02Å; F301-L305 HydrophobicContact CE2-CD1 4.17Å; F301-L305 HydrophobicContact CE2-CD2 4.07Å; F301-L305 HydrophobicContact CE2-CG 4.05Å; F301-L305 HydrophobicContact CZ-CD1 3.44Å; F301-L305 VanDerWaalsContact CZ-CD1 3.44Å; F301-L305 HydrophobicContact CZ-CD2 4Å; F301-L305 HydrophobicContact CZ-CG 3.83Å; F301-L305 WeakPolarHBondContact O-CG 3.39Å; F301-L305 PolarHBondContact O-N 3.34Å; V302-L305 PolarHBondContact O-N 2.92Å; V302-L305 VanDerWaalsContact O-N 3.14Å; L305-V308 PolarHBondContact O-N 3.19Å; L305-K309 WeakPolarHBondContact O-CB 3.43Å; L305-K309 PolarHBondContact O-N 3.47Å |
| 306 | L | 83.2 | Confident | 80.9 | Confident | 112 Ų | 112 | 92 Ų | 92 | 59% | 0.586 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -62.5 | -44.9 | 178.3 | -68.1 | 175.9 | 0 | 0 | 0 | 111.6 | V302 V308 K309 E310 | V302-L306 HydrophobicContact CG1-CD1 4.14Å; V302-L306 HydrophobicContact CG1-CG 4.41Å; V302-L306 WeakPolarHBondContact O-CG 3.14Å; V302-L306 PolarHBondContact O-N 3.33Å; L306-V308 PolarHBondContact O-N 3.23Å; L306-K309 PolarHBondContact O-N 2.87Å; L306-E310 WeakPolarHBondContact O-CB 3.41Å; L306-E310 PolarHBondContact O-N 3.06Å |
| 307 | K | 83.3 | Confident | 79.6 | Confident | 132 Ų | 132 | 95 Ų | 95 | 57% | 0.574 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -63.5 | -40.9 | 176.9 | -73.7 | -176.8 | 176.2 | -170.2 | 0 | 113.2 | V303 K304 V311 | V303-K307 HydrophobicContact CG1-CD 4.37Å; V303-K307 WeakPolarHBondContact O-CG 3.36Å; V303-K307 PolarHBondContact O-N 3.17Å; V303-K307 VanDerWaalsContact O-N 3.09Å; K304-K307 PolarHBondContact O-N 3.12Å; K307-V311 VanDerWaalsContact O-CG2 3.27Å; K307-V311 WeakPolarHBondContact O-CG2 3.38Å; K307-V311 PolarHBondContact O-N 3.43Å |
| 308 | V | 80 | Confident | 78.6 | Confident | 84 Ų | 84 | 96 Ų | 96 | 51% | 0.509 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -67.9 | -40 | 178 | 170.6 | 0 | 0 | 0 | 0 | 110.7 | K304 L305 L306 V311 N312 | K304-V308 WeakPolarHBondContact O-CG2 3.45Å; K304-V308 PolarHBondContact O-N 3.22Å; L305-V308 PolarHBondContact O-N 3.19Å; L306-V308 PolarHBondContact O-N 3.23Å; V308-V311 PolarHBondContact O-N 3.14Å; V308-N312 WeakPolarHBondContact O-CB 3.39Å; V308-N312 VanDerWaalsContact O-CG 3.3Å; V308-N312 PolarHBondContact O-N 3.25Å |
| 309 | K | 74.3 | Confident | 77.6 | Confident | 129 Ų | 129 | 100.8 Ų | 100.8 | 56% | 0.561 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -62.6 | -46.6 | 175.7 | -172.3 | 179 | 176.2 | -174.4 | 0 | 111 | L305 L306 V311 N312 D313 | L305-K309 WeakPolarHBondContact O-CB 3.43Å; L305-K309 PolarHBondContact O-N 3.47Å; L306-K309 PolarHBondContact O-N 2.87Å; K309-V311 VanDerWaalsContact C-N 3.35Å; K309-V311 PolarHBondContact O-N 3.12Å; K309-N312 PolarHBondContact O-N 3.3Å; K309-N312 VanDerWaalsContact O-N 3.16Å; K309-D313 WeakPolarHBondContact O-CB 3.5Å; K309-D313 PolarHBondContact O-N 2.98Å |
| 310 | E | 73.8 | Confident | 76.3 | Confident | 126 Ų | 126 | 102 Ų | 102 | 59% | 0.589 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -57.5 | -45.6 | 175.4 | -176.3 | -177.6 | -175 | 0 | 0 | 112.1 | L306 N312 D313 V314 | L306-E310 WeakPolarHBondContact O-CB 3.41Å; L306-E310 PolarHBondContact O-N 3.06Å; E310-N312 VanDerWaalsContact C-N 3.34Å; E310-N312 PolarHBondContact O-N 3.38Å; E310-D313 PolarHBondContact O-N 2.98Å; E310-V314 WeakPolarHBondContact O-CB 3.44Å; E310-V314 VanDerWaalsContact O-CG2 3.26Å; E310-V314 WeakPolarHBondContact O-CG2 3.35Å; E310-V314 PolarHBondContact O-N 3.43Å |
| 311 | V | 69.1 | Low | 75.3 | Confident | 67 Ų | 67 | 102.5 Ų | 102.5 | 41% | 0.406 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -64.6 | -37.7 | 177 | 170.7 | 0 | 0 | 0 | 0 | 112.1 | K307 V308 K309 R315 | K307-V311 VanDerWaalsContact O-CG2 3.27Å; K307-V311 WeakPolarHBondContact O-CG2 3.38Å; K307-V311 PolarHBondContact O-N 3.43Å; V308-V311 PolarHBondContact O-N 3.14Å; K309-V311 VanDerWaalsContact C-N 3.35Å; K309-V311 PolarHBondContact O-N 3.12Å; V311-R315 VanDerWaalsContact O-CG 3.26Å; V311-R315 WeakPolarHBondContact O-CG 3.31Å; V311-R315 PolarHBondContact O-N 2.97Å; V311-R315 VanDerWaalsContact O-N 3.15Å |
| 312 | N | 66.3 | Low | 74.3 | Confident | 83 Ų | 83 | 100.5 Ų | 100.5 | 44% | 0.444 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -70.2 | -42.6 | 176.6 | -73.7 | -11.2 | 0 | 0 | 0 | 111.6 | V308 K309 E310 R315 E316 | V308-N312 WeakPolarHBondContact O-CB 3.39Å; V308-N312 VanDerWaalsContact O-CG 3.3Å; V308-N312 PolarHBondContact O-N 3.25Å; K309-N312 PolarHBondContact O-N 3.3Å; K309-N312 VanDerWaalsContact O-N 3.16Å; E310-N312 VanDerWaalsContact C-N 3.34Å; E310-N312 PolarHBondContact O-N 3.38Å; N312-R315 PolarHBondContact O-N 3.25Å; N312-E316 WeakPolarHBondContact O-CB 3.42Å; N312-E316 PolarHBondContact O-N 3.05Å |
| 313 | D | 69.8 | Low | 73.4 | Confident | 64 Ų | 64 | 106 Ų | 106 | 34% | 0.342 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.1 | -46.2 | 177.7 | -67.4 | -7.8 | 0 | 0 | 0 | 109.6 | K309 E310 R315 E316 Y317 | K309-D313 WeakPolarHBondContact O-CB 3.5Å; K309-D313 PolarHBondContact O-N 2.98Å; E310-D313 PolarHBondContact O-N 2.98Å; D313-R315 PolarHBondContact O-N 2.76Å; D313-E316 PolarHBondContact O-N 3.27Å; D313-Y317 WeakPolarHBondContact O-CD2 3.46Å; D313-Y317 PolarHBondContact O-N 3.27Å |
| 314 | V | 67.5 | Low | 72.7 | Confident | 74 Ų | 74 | 107.6 Ų | 107.6 | 45% | 0.448 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -59.2 | -44 | 176.1 | 171.1 | 0 | 0 | 0 | 0 | 112 | E310 E316 Y317 E318 | E310-V314 WeakPolarHBondContact O-CB 3.44Å; E310-V314 VanDerWaalsContact O-CG2 3.26Å; E310-V314 WeakPolarHBondContact O-CG2 3.35Å; E310-V314 PolarHBondContact O-N 3.43Å; V314-E316 VanDerWaalsContact C-N 3.34Å; V314-E316 PolarHBondContact O-N 3Å; V314-Y317 PolarHBondContact O-N 3.31Å; V314-E318 PolarHBondContact O-N 3.46Å |
| 315 | R | 58.2 | Low | 72.2 | Confident | 145 Ų | 145 | 103.3 Ų | 103.3 | 55% | 0.547 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.9 | -37.2 | 176.8 | -74.3 | 173.2 | -177 | 176.6 | 0.7 | 112.5 | V311 N312 D313 Y317 E318 D319 | V311-R315 VanDerWaalsContact O-CG 3.26Å; V311-R315 WeakPolarHBondContact O-CG 3.31Å; V311-R315 PolarHBondContact O-N 2.97Å; V311-R315 VanDerWaalsContact O-N 3.15Å; N312-R315 PolarHBondContact O-N 3.25Å; D313-R315 PolarHBondContact O-N 2.76Å; R315-Y317 VanDerWaalsContact C-N 3.35Å; R315-E318 PolarHBondContact O-N 3.1Å; R315-D319 WeakPolarHBondContact O-CB 3.41Å; R315-D319 PolarHBondContact O-N 3.26Å |
| 316 | E | 69.6 | Low | 71.7 | Confident | 128 Ų | 128 | 102.2 Ų | 102.2 | 60% | 0.598 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -65.6 | -38.6 | 177.5 | -170.3 | 172.1 | 179.3 | 0 | 0 | 111.4 | N312 D313 V314 E320 | N312-E316 WeakPolarHBondContact O-CB 3.42Å; N312-E316 PolarHBondContact O-N 3.05Å; D313-E316 PolarHBondContact O-N 3.27Å; V314-E316 VanDerWaalsContact C-N 3.34Å; V314-E316 PolarHBondContact O-N 3Å; E316-E320 WeakPolarHBondContact O-CB 3.46Å; E316-E320 WeakPolarHBondContact O-CG 3.36Å; E316-E320 PolarHBondContact O-N 3.16Å |
| 317 | Y | 67.9 | Low | 71.4 | Confident | 163 Ų | 163 | 101 Ų | 101 | 64% | 0.639 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -65.2 | -42.5 | 171.8 | -72.3 | -68.4 | 0 | 0 | 0 | 112.6 | D313 V314 R315 E320 D321 | D313-Y317 WeakPolarHBondContact O-CD2 3.46Å; D313-Y317 PolarHBondContact O-N 3.27Å; V314-Y317 PolarHBondContact O-N 3.31Å; R315-Y317 VanDerWaalsContact C-N 3.35Å; Y317-E320 PolarHBondContact O-N 3.33Å; Y317-D321 WeakPolarHBondContact O-CB 3.26Å; Y317-D321 PolarHBondContact O-N 2.59Å |
| 318 | E | 70.2 | Confident | 71.1 | Confident | 126 Ų | 126 | 101.1 Ų | 101.1 | 59% | 0.589 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -62.8 | -42.4 | 176.4 | -73.4 | 180 | 165.4 | 0 | 0 | 112.3 | V314 R315 D321 A322 | V314-E318 PolarHBondContact O-N 3.46Å; R315-E318 PolarHBondContact O-N 3.1Å; E318-D321 PolarHBondContact O-N 3.09Å; E318-A322 WeakPolarHBondContact O-CB 3.41Å; E318-A322 PolarHBondContact O-N 3.26Å |
| 319 | D | 72.7 | Confident | 70.9 | Confident | 115 Ų | 115 | 103 Ų | 103 | 62% | 0.615 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -68.7 | -36.5 | 177.2 | -79.7 | -16.9 | 0 | 0 | 0 | 112.2 | R315 R323 | R315-D319 WeakPolarHBondContact O-CB 3.41Å; R315-D319 PolarHBondContact O-N 3.26Å; D319-R323 WeakPolarHBondContact O-CB 3.36Å; D319-R323 PolarHBondContact O-N 3Å |
| 320 | E | 66.9 | Low | 70.7 | Confident | 88 Ų | 88 | 102.4 Ų | 102.4 | 41% | 0.411 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63 | -45.7 | 172.3 | -88.1 | -109.4 | 150.1 | 0 | 0 | 112 | E316 Y317 R323 K324 | E316-E320 WeakPolarHBondContact O-CB 3.46Å; E316-E320 WeakPolarHBondContact O-CG 3.36Å; E316-E320 PolarHBondContact O-N 3.16Å; Y317-E320 PolarHBondContact O-N 3.33Å; E320-R323 PolarHBondContact O-N 2.92Å; E320-K324 WeakPolarHBondContact O-CG 3.45Å; E320-K324 PolarHBondContact O-N 3.16Å; E320-K324 IonicContact OE2-NZ 3.25Å; E320-K324 PolarHBondContact OE2-NZ 2.97Å |
| 321 | D | 70.9 | Confident | 70.7 | Confident | 97 Ų | 97 | 102.4 Ų | 102.4 | 52% | 0.519 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -68.5 | -38.2 | 179.6 | -73.4 | -17.9 | 0 | 0 | 0 | 111.3 | Y317 E318 K324 A325 | Y317-D321 WeakPolarHBondContact O-CB 3.26Å; Y317-D321 PolarHBondContact O-N 2.59Å; E318-D321 PolarHBondContact O-N 3.09Å; D321-K324 PolarHBondContact O-N 2.99Å; D321-A325 WeakPolarHBondContact O-CB 3.28Å; D321-A325 PolarHBondContact O-N 3.35Å |
| 322 | A | 67.6 | Low | 70.7 | Confident | 60 Ų | 60 | 103.8 Ų | 103.8 | 50% | 0.496 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -63.8 | -38.4 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | E318 A326 | E318-A322 WeakPolarHBondContact O-CB 3.41Å; E318-A322 PolarHBondContact O-N 3.26Å; A322-A326 WeakPolarHBondContact O-CB 2.96Å; A322-A326 PolarHBondContact O-N 3.36Å |
| 323 | R | 69.3 | Low | 70.6 | Confident | 158 Ų | 158 | 102.4 Ų | 102.4 | 60% | 0.596 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -66 | -43.6 | 172.7 | -97.9 | -174.8 | 76.5 | -150.1 | -0.4 | 112.4 | D319 E320 A326 E327 | D319-R323 WeakPolarHBondContact O-CB 3.36Å; D319-R323 PolarHBondContact O-N 3Å; E320-R323 PolarHBondContact O-N 2.92Å; R323-A326 PolarHBondContact O-N 3.31Å; R323-E327 IonicContact CZ-OE1 3.83Å; R323-E327 IonicContact NE-OE1 2.92Å; R323-E327 IonicContact NH2-OE1 2.89Å; R323-E327 PolarHBondContact NH2-OE1 3.24Å; R323-E327 WeakPolarHBondContact O-CB 3.26Å; R323-E327 WeakPolarHBondContact O-CG 3.3Å; R323-E327 PolarHBondContact O-N 3.14Å |
| 324 | K | 74.6 | Confident | 70.1 | Confident | 103 Ų | 103 | 106.5 Ų | 106.5 | 45% | 0.448 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.3 | -43.2 | 177.3 | -74.6 | 172 | -169.8 | 150.8 | 0 | 111.7 | E320 D321 A326 E327 E328 | E320-K324 WeakPolarHBondContact O-CG 3.45Å; E320-K324 PolarHBondContact O-N 3.16Å; E320-K324 IonicContact OE2-NZ 3.25Å; E320-K324 PolarHBondContact OE2-NZ 2.97Å; D321-K324 PolarHBondContact O-N 2.99Å; K324-A326 VanDerWaalsContact C-N 3.34Å; K324-A326 PolarHBondContact O-N 3.15Å; K324-E327 PolarHBondContact O-N 3.45Å; K324-E328 PolarHBondContact O-N 3.03Å |
| 325 | A | 77.4 | Confident | 69.5 | Low | 46 Ų | 46 | 108.4 Ų | 108.4 | 38% | 0.38 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -62.8 | -39.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | D321 E328 L329 | D321-A325 WeakPolarHBondContact O-CB 3.28Å; D321-A325 PolarHBondContact O-N 3.35Å; A325-E328 PolarHBondContact O-N 3.25Å; A325-L329 WeakPolarHBondContact O-CB 3.27Å; A325-L329 VanDerWaalsContact O-CG 3.3Å; A325-L329 WeakPolarHBondContact O-CG 3.41Å; A325-L329 PolarHBondContact O-N 3.49Å |
| 326 | A | 73.9 | Confident | 69.2 | Low | 47 Ų | 47 | 107.4 Ų | 107.4 | 39% | 0.388 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -67.3 | -38.1 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | A322 R323 K324 L329 L330 | A322-A326 WeakPolarHBondContact O-CB 2.96Å; A322-A326 PolarHBondContact O-N 3.36Å; R323-A326 PolarHBondContact O-N 3.31Å; K324-A326 VanDerWaalsContact C-N 3.34Å; K324-A326 PolarHBondContact O-N 3.15Å; A326-L329 PolarHBondContact O-N 3.09Å; A326-L330 WeakPolarHBondContact O-CB 3.28Å; A326-L330 WeakPolarHBondContact O-CG 3.35Å; A326-L330 PolarHBondContact O-N 3.09Å |
| 327 | E | 75.9 | Confident | 68.3 | Low | 87 Ų | 87 | 108.1 Ų | 108.1 | 41% | 0.407 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -69 | -33.9 | 175.3 | -76.1 | 177.3 | -167.8 | 0 | 0 | 112.4 | R323 K324 K331 | R323-E327 IonicContact CZ-OE1 3.83Å; R323-E327 IonicContact NE-OE1 2.92Å; R323-E327 IonicContact NH2-OE1 2.89Å; R323-E327 PolarHBondContact NH2-OE1 3.24Å; R323-E327 WeakPolarHBondContact O-CB 3.26Å; R323-E327 WeakPolarHBondContact O-CG 3.3Å; R323-E327 PolarHBondContact O-N 3.14Å; K324-E327 PolarHBondContact O-N 3.45Å; E327-K331 WeakPolarHBondContact O-CG 3.43Å; E327-K331 PolarHBondContact O-N 2.87Å; E327-K331 VanDerWaalsContact O-N 3.12Å |
| 328 | E | 77.4 | Confident | 67.4 | Low | 133 Ų | 133 | 107.5 Ų | 107.5 | 62% | 0.621 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -67.8 | -44.8 | 171.3 | -78.6 | -175.8 | 165.2 | 0 | 0 | 111.8 | K324 A325 L330 K331 D332 | K324-E328 PolarHBondContact O-N 3.03Å; A325-E328 PolarHBondContact O-N 3.25Å; E328-L330 VanDerWaalsContact C-N 3.29Å; E328-L330 PolarHBondContact O-N 3.3Å; E328-K331 PolarHBondContact O-N 3.37Å; E328-D332 PolarHBondContact O-N 3.32Å |
| 329 | L | 75.2 | Confident | 66.2 | Low | 125 Ų | 125 | 108.9 Ų | 108.9 | 65% | 0.654 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -62.5 | -34.8 | 175.9 | -73.5 | 170.1 | 0 | 0 | 0 | 112.8 | A325 A326 A333 | A325-L329 WeakPolarHBondContact O-CB 3.27Å; A325-L329 VanDerWaalsContact O-CG 3.3Å; A325-L329 WeakPolarHBondContact O-CG 3.41Å; A325-L329 PolarHBondContact O-N 3.49Å; A326-L329 PolarHBondContact O-N 3.09Å; L329-A333 WeakPolarHBondContact O-CB 3.38Å; L329-A333 PolarHBondContact O-N 3Å; L329-A333 VanDerWaalsContact O-N 3.08Å |
| 330 | L | 71.6 | Confident | 64.7 | Low | 116 Ų | 116 | 108 Ų | 108 | 61% | 0.607 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -70.1 | -37.2 | 174.8 | -77.7 | 164.9 | 0 | 0 | 0 | 112.2 | A326 E328 A333 E334 | A326-L330 WeakPolarHBondContact O-CB 3.28Å; A326-L330 WeakPolarHBondContact O-CG 3.35Å; A326-L330 PolarHBondContact O-N 3.09Å; E328-L330 VanDerWaalsContact C-N 3.29Å; E328-L330 PolarHBondContact O-N 3.3Å; L330-A333 PolarHBondContact O-N 3.3Å; L330-E334 PolarHBondContact O-N 3.17Å |
| 331 | K | 73.2 | Confident | 63.2 | Low | 126 Ų | 126 | 107.4 Ų | 107.4 | 55% | 0.548 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -69.5 | -36.3 | 174.6 | -75.2 | 173.8 | -177.3 | 171 | 0 | 112.7 | E327 E328 A333 E334 N335 | E327-K331 WeakPolarHBondContact O-CG 3.43Å; E327-K331 PolarHBondContact O-N 2.87Å; E327-K331 VanDerWaalsContact O-N 3.12Å; E328-K331 PolarHBondContact O-N 3.37Å; K331-A333 VanDerWaalsContact C-N 3.31Å; K331-E334 PolarHBondContact O-N 3.08Å; K331-N335 WeakPolarHBondContact O-CB 3.4Å; K331-N335 PolarHBondContact O-N 3.16Å; K331-N335 PolarHBondContact O-ND2 3Å |
| 332 | D | 69.1 | Low | 61.4 | Low | 95 Ų | 95 | 111.5 Ų | 111.5 | 51% | 0.508 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -70.7 | -28.5 | 175 | -78.5 | -10.2 | 0 | 0 | 0 | 112.2 | E328 N336 | E328-D332 PolarHBondContact O-N 3.32Å; D332-N336 WeakPolarHBondContact O-CB 3.33Å; D332-N336 PolarHBondContact O-N 2.93Å; D332-N336 PolarHBondContact O-ND2 2.95Å |
| 333 | A | 64.8 | Low | 59.8 | Low | 55 Ų | 55 | 116.8 Ų | 116.8 | 46% | 0.455 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -72.3 | -42 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112 | L329 L330 K331 N335 N336 | L329-A333 WeakPolarHBondContact O-CB 3.38Å; L329-A333 PolarHBondContact O-N 3Å; L329-A333 VanDerWaalsContact O-N 3.08Å; L330-A333 PolarHBondContact O-N 3.3Å; K331-A333 VanDerWaalsContact C-N 3.31Å; A333-N335 PolarHBondContact O-N 3Å; A333-N336 PolarHBondContact O-N 3.07Å |
| 334 | E | 57.8 | Low | 58.1 | Low | 149 Ų | 149 | 115.8 Ų | 115.8 | 70% | 0.696 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -66.4 | -33.3 | 175.6 | -80.9 | -176.3 | 153.3 | 0 | 0 | 112.9 | L330 K331 | L330-E334 PolarHBondContact O-N 3.17Å; K331-E334 PolarHBondContact O-N 3.08Å |
| 335 | N | 55.3 | Low | 56.2 | Low | 115 Ų | 115 | 116.1 Ų | 116.1 | 62% | 0.615 | 65% | 0.65 | S | S | * | * | H | α-helix | trans | -78.3 | -18.3 | 178 | -75.1 | -32.1 | 0 | 0 | 0 | 114.2 | K331 A333 | K331-N335 WeakPolarHBondContact O-CB 3.4Å; K331-N335 PolarHBondContact O-N 3.16Å; K331-N335 PolarHBondContact O-ND2 3Å; A333-N335 PolarHBondContact O-N 3Å |
| 336 | N | 52.7 | Low | 54.2 | Low | 124 Ų | 124 | 117.7 Ų | 117.7 | 66% | 0.663 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -89.7 | -11.2 | -179.6 | -85.7 | -47.8 | 0 | 0 | 0 | 114 | D332 A333 D338 | D332-N336 WeakPolarHBondContact O-CB 3.33Å; D332-N336 PolarHBondContact O-N 2.93Å; D332-N336 PolarHBondContact O-ND2 2.95Å; A333-N336 PolarHBondContact O-N 3.07Å; N336-D338 VanDerWaalsContact C-N 3.33Å |
| 337 | D | 49.9 | Very low | 52.1 | Low | 143 Ų | 143 | 123.2 Ų | 123.2 | 77% | 0.765 | 68% | 0.681 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -83.4 | -5.9 | 176.8 | -90.7 | -19.8 | 0 | 0 | 0 | 113.6 | ||
| 338 | D | 48.5 | Very low | 50 | Low | 150 Ų | 150 | 128.2 Ų | 128.2 | 80% | 0.802 | 70% | 0.696 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.6 | -3.2 | -179.2 | -82 | -19.3 | 0 | 0 | 0 | 115 | N336 | N336-D338 VanDerWaalsContact C-N 3.33Š|
| 339 | D | 45.7 | Very low | 47.9 | Very low | 155 Ų | 155 | 129.6 Ų | 129.6 | 83% | 0.829 | 70% | 0.7 | S | S | * | * | S | Bend | trans | -122.7 | 32.8 | -178.1 | -162.2 | 39.3 | 0 | 0 | 0 | 114.8 | ||
| 340 | A | 40.3 | Very low | 45.8 | Very low | 95 Ų | 95 | 131.8 Ų | 131.8 | 79% | 0.785 | 71% | 0.707 | S | S | * | * | trans | -132.9 | 83.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 341 | G | 35.5 | Very low | 44 | Very low | 77 Ų | 77 | 131.9 Ų | 131.9 | 79% | 0.794 | 71% | 0.712 | S | S | * | * | trans | 155.5 | 81.8 | 150.2 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 342 | H | 34 | Very low | 42 | Very low | 183 Ų | 183 | 133 Ų | 133 | 85% | 0.847 | 72% | 0.719 | S | S | * | * | trans | -129.3 | 96.6 | 151.1 | -130.2 | -58.5 | 0 | 0 | 0 | 109.8 | ||||
| 343 | H | 34.4 | Very low | 40.2 | Very low | 171 Ų | 171 | 135.3 Ų | 135.3 | 79% | 0.792 | 73% | 0.731 | S | S | * | * | trans | -165.1 | 110.5 | 147.6 | -106.3 | -63.8 | 0 | 0 | 0 | 113.6 | ||||
| 344 | N | 34 | Very low | 38.6 | Very low | 137 Ų | 137 | 136 Ų | 136 | 73% | 0.733 | 74% | 0.744 | S | S | * | * | trans | 58 | 119.7 | 137.6 | -74.7 | -18.2 | 0 | 0 | 0 | 124.5 | ||||
| 345 | S | 33.6 | Very low | 37.6 | Very low | 109 Ų | 109 | 135.5 Ų | 135.5 | 76% | 0.762 | 75% | 0.751 | S | S | * | * | 90.5 | 107.4 | 119.3 | -164.2 | 0 | 0 | 0 | 0 | 120.6 | |||||
| 346 | A | 35.2 | Very low | 36.8 | Very low | 80 Ų | 80 | 136.3 Ų | 136.3 | 66% | 0.661 | 76% | 0.76 | S | S | * | * | trans | 53 | 120.6 | 131.8 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 347 | Q | 30.9 | Very low | 36 | Very low | 163 Ų | 163 | 140.4 Ų | 140.4 | 76% | 0.762 | 77% | 0.772 | S | S | * | * | 143 | 115.9 | 106.6 | -167.4 | 129.5 | -52.1 | 0 | 0 | 114.6 | |||||
| 348 | R | 30.4 | Very low | 35.6 | Very low | 192 Ų | 192 | 140.3 Ų | 140.3 | 73% | 0.725 | 77% | 0.771 | S | S | * | * | trans | 65.5 | 123.3 | 142.3 | -86.6 | -176.3 | 169.1 | 170.7 | 1.3 | 123 | ||||
| 349 | K | 33 | Very low | 35.1 | Very low | 162 Ų | 162 | 141.8 Ų | 141.8 | 70% | 0.704 | 77% | 0.771 | S | S | * | * | 84.3 | 110 | 121.7 | -79.7 | -179 | 178.7 | -169.6 | 0 | 120.7 | |||||
| 350 | H | 31.8 | Very low | 34.5 | Very low | 170 Ų | 170 | 143.2 Ų | 143.2 | 79% | 0.787 | 77% | 0.772 | S | S | * | * | 70.5 | 140.7 | 105.1 | -135.8 | -67.3 | 0 | 0 | 0 | 120.7 | |||||
| 351 | V | 33.8 | Very low | 34.1 | Very low | 119 Ų | 119 | 150 Ų | 150 | 72% | 0.721 | 79% | 0.794 | S | S | * | * | trans | 88 | 140.8 | 159.3 | -170.4 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 352 | Q | 31.7 | Very low | 34.1 | Very low | 149 Ų | 149 | 153.7 Ų | 153.7 | 70% | 0.696 | 79% | 0.794 | S | S | * | * | cis | 176.7 | 145.3 | -23.4 | -177.4 | 171.5 | -0.9 | 0 | 0 | 104.6 | ||||
| 353 | N | 31.5 | Very low | 34.1 | Very low | 143 Ų | 143 | 152.1 Ų | 152.1 | 77% | 0.765 | 79% | 0.791 | S | S | * | * | trans | 23.1 | 132.6 | 156.4 | -56.9 | -14.3 | 0 | 0 | 0 | 121.6 | ||||
| 354 | G | 30.9 | Very low | 34.1 | Very low | 69 Ų | 69 | 151.1 Ų | 151.1 | 71% | 0.711 | 79% | 0.791 | S | S | * | * | 118.1 | 139.9 | 106.8 | 0 | 0 | 0 | 0 | 0 | 118.5 | |||||
| 355 | V | 35.8 | Very low | 34.1 | Very low | 140 Ų | 140 | 151.9 Ų | 151.9 | 85% | 0.848 | 79% | 0.794 | S | S | * | * | trans | 92.7 | 106.4 | 146.6 | -171.3 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 356 | T | 39.3 | Very low | 34.1 | Very low | 131 Ų | 131 | 154.6 Ų | 154.6 | 80% | 0.804 | 80% | 0.796 | S | S | * | * | trans | -42.1 | 135.6 | 149.3 | 22.4 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 357 | K | 36 | Very low | 34 | Very low | 210 Ų | 210 | 159.5 Ų | 159.5 | 91% | 0.913 | 81% | 0.805 | S | S | * | * | -168.3 | 139.7 | 121.1 | -115.8 | 177.1 | 179.1 | 178.4 | 0 | 114 | |||||
| 358 | D | 40.7 | Very low | 34.2 | Very low | 142 Ų | 142 | 159.3 Ų | 159.3 | 76% | 0.759 | 81% | 0.808 | S | S | * | * | trans | -65.8 | 158.3 | 173.1 | -97.4 | -35 | 0 | 0 | 0 | 115.7 | ||||
| 359 | K | 38 | Very low | 34.5 | Very low | 181 Ų | 181 | 156.8 Ų | 156.8 | 79% | 0.787 | 82% | 0.815 | S | S | * | * | trans | 83.2 | 114.3 | 142 | -77.7 | 173.3 | -174.5 | -169.5 | 0 | 121.8 | ||||
| 360 | H | 33.3 | Very low | 34.7 | Very low | 185 Ų | 185 | 156.3 Ų | 156.3 | 86% | 0.856 | 82% | 0.824 | S | S | * | * | -149.8 | 131.6 | 116.8 | -99.5 | -79.7 | 0 | 0 | 0 | 105.1 | |||||
| 361 | L | 33.2 | Very low | 34.9 | Very low | 237 Ų | 237 | 155.1 Ų | 155.1 | 100% | 1.241 | 83% | 0.827 | S | S | * | * | cis | -136.4 | 0 | 39 | -88.4 | 141.4 | 0 | 0 | 0 | 112.6 |
Retrieved 361 of 361 residues in 691.3 ms
(Link to these results)