| 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 | 39.8 | Very low | 58 | Low | 241 Ų | 241 | 100.5 Ų | 100.5 | 100% | 1.187 | 53% | 0.526 | S | S | * | . | 0 | 121.2 | 0 | -79.1 | 167.9 | 143.8 | 0 | 0 | 105.4 | S3 | M1-S3 PolarHBondContact O-N 3.41Š| |||
| 2 | Y | 48 | Very low | 58.5 | Low | 182 Ų | 182 | 100.9 Ų | 100.9 | 71% | 0.714 | 52% | 0.516 | S | S | * | . | trans | -63.7 | 121.6 | 173.8 | -79.1 | -80.3 | 0 | 0 | 0 | 107.9 | E6 | Y2-E6 WeakPolarHBondContact CA-OE2 2.84Å; Y2-E6 VanDerWaalsContact CD1-OE2 3.3Å; Y2-E6 WeakPolarHBondContact CD1-OE2 3.2Å | ||
| 3 | S | 53.7 | Low | 58.9 | Low | 46 Ų | 46 | 97.8 Ų | 97.8 | 32% | 0.322 | 50% | 0.498 | S | S | . | . | trans | -68.8 | 144.6 | -179.4 | -167.1 | 0 | 0 | 0 | 0 | 108.6 | M1 S5 E6 I7 | M1-S3 PolarHBondContact O-N 3.41Å; S3-S5 VanDerWaalsContact CB-OG 3.28Å; S3-S5 WeakPolarHBondContact CB-OG 3.23Å; S3-S5 PolarHBondContact O-N 2.92Å; S3-S5 PolarHBondContact OG-OG 3.28Å; S3-S5 VanDerWaalsContact OG-OG 3.08Å; S3-E6 PolarHBondContact N-OE2 3.06Å; S3-E6 WeakPolarHBondContact O-CB 3.23Å; S3-E6 PolarHBondContact O-N 2.97Å; S3-I7 PolarHBondContact O-N 2.68Å | ||
| 4 | I | 60.1 | Low | 59.7 | Low | 152 Ų | 152 | 95.4 Ų | 95.4 | 78% | 0.779 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -55 | -28.6 | 179.3 | -66 | 170.7 | 0 | 0 | 0 | 110.3 | G8 | I4-G8 PolarHBondContact O-N 3.37Å |
| 5 | S | 57.2 | Low | 60.4 | Low | 43 Ų | 43 | 98 Ų | 98 | 30% | 0.301 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.1 | -46.3 | 172.4 | 51.8 | 0 | 0 | 0 | 0 | 113 | S3 I7 G8 I9 | S3-S5 VanDerWaalsContact CB-OG 3.28Å; S3-S5 WeakPolarHBondContact CB-OG 3.23Å; S3-S5 PolarHBondContact O-N 2.92Å; S3-S5 PolarHBondContact OG-OG 3.28Å; S3-S5 VanDerWaalsContact OG-OG 3.08Å; S5-I7 PolarHBondContact O-N 3.16Å; S5-G8 PolarHBondContact O-N 3.12Å; S5-I9 VanDerWaalsContact O-CG1 3.29Å; S5-I9 WeakPolarHBondContact O-CG1 3.09Å; S5-I9 PolarHBondContact O-N 3.02Å |
| 6 | E | 53 | Low | 60.8 | Low | 45 Ų | 45 | 95.3 Ų | 95.3 | 21% | 0.21 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -63.2 | -45.1 | 180 | -65.2 | -179.2 | 118.5 | 0 | 0 | 111.1 | Y2 S3 G8 I9 F10 | Y2-E6 WeakPolarHBondContact CA-OE2 2.84Å; Y2-E6 VanDerWaalsContact CD1-OE2 3.3Å; Y2-E6 WeakPolarHBondContact CD1-OE2 3.2Å; S3-E6 PolarHBondContact N-OE2 3.06Å; S3-E6 WeakPolarHBondContact O-CB 3.23Å; S3-E6 PolarHBondContact O-N 2.97Å; E6-G8 VanDerWaalsContact C-N 3.27Å; E6-G8 PolarHBondContact O-N 3.36Å; E6-I9 PolarHBondContact O-N 2.94Å; E6-F10 VanDerWaalsContact O-CD2 3.22Å; E6-F10 WeakPolarHBondContact O-CD2 3.41Å; E6-F10 PolarHBondContact O-N 3.17Å |
| 7 | I | 62.5 | Low | 61.1 | Low | 94 Ų | 94 | 96.1 Ų | 96.1 | 48% | 0.482 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -62.5 | -38.5 | 177.5 | -58.9 | 173.6 | 0 | 0 | 0 | 110.4 | S3 S5 S11 | S3-I7 PolarHBondContact O-N 2.68Å; S5-I7 PolarHBondContact O-N 3.16Å; I7-S11 VanDerWaalsContact O-CB 3.25Å; I7-S11 WeakPolarHBondContact O-CB 3.33Å; I7-S11 PolarHBondContact O-N 2.88Å; I7-S11 PolarHBondContact O-OG 2.79Å |
| 8 | G | 64.7 | Low | 61.5 | Low | 39 Ų | 39 | 100.2 Ų | 100.2 | 40% | 0.402 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -62.2 | -46.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | I4 S5 E6 S11 W12 | I4-G8 PolarHBondContact O-N 3.37Å; S5-G8 PolarHBondContact O-N 3.12Å; E6-G8 VanDerWaalsContact C-N 3.27Å; E6-G8 PolarHBondContact O-N 3.36Å; G8-S11 PolarHBondContact O-N 2.81Å; G8-W12 WeakPolarHBondContact O-CB 3.45Å; G8-W12 PolarHBondContact O-N 3.06Å |
| 9 | I | 65 | Low | 61.6 | Low | 68 Ų | 68 | 98.7 Ų | 98.7 | 35% | 0.349 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.9 | -47.4 | 177.8 | -65.8 | 163.5 | 0 | 0 | 0 | 110.6 | S5 E6 S11 W12 Q13 | S5-I9 VanDerWaalsContact O-CG1 3.29Å; S5-I9 WeakPolarHBondContact O-CG1 3.09Å; S5-I9 PolarHBondContact O-N 3.02Å; E6-I9 PolarHBondContact O-N 2.94Å; I9-S11 PolarHBondContact O-N 3.43Å; I9-W12 PolarHBondContact O-N 3.19Å; I9-Q13 HydrophobicContact CG2-CG 4.35Å; I9-Q13 WeakPolarHBondContact O-CB 3.42Å; I9-Q13 WeakPolarHBondContact O-CG 3.15Å; I9-Q13 PolarHBondContact O-N 2.79Å |
| 10 | F | 65.9 | Low | 61.6 | Low | 123 Ų | 123 | 97.9 Ų | 97.9 | 54% | 0.539 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -63.3 | -40.2 | 178.5 | -85.5 | -69.7 | 0 | 0 | 0 | 112.5 | E6 T14 | E6-F10 VanDerWaalsContact O-CD2 3.22Å; E6-F10 WeakPolarHBondContact O-CD2 3.41Å; E6-F10 PolarHBondContact O-N 3.17Å; F10-T14 WeakPolarHBondContact O-CB 3.5Å; F10-T14 PolarHBondContact O-N 2.88Å; F10-T14 PolarHBondContact O-OG1 3.48Å |
| 11 | S | 67.6 | Low | 61.5 | Low | 72 Ų | 72 | 100.5 Ų | 100.5 | 50% | 0.503 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.1 | -42.2 | 176.5 | -60.9 | 0 | 0 | 0 | 0 | 111.3 | I7 G8 I9 W15 | I7-S11 VanDerWaalsContact O-CB 3.25Å; I7-S11 WeakPolarHBondContact O-CB 3.33Å; I7-S11 PolarHBondContact O-N 2.88Å; I7-S11 PolarHBondContact O-OG 2.79Å; G8-S11 PolarHBondContact O-N 2.81Å; I9-S11 PolarHBondContact O-N 3.43Å; S11-W15 WeakPolarHBondContact O-CB 3.32Å; S11-W15 PolarHBondContact O-N 3.41Å |
| 12 | W | 65.1 | Low | 62.3 | Low | 106 Ų | 106 | 94.6 Ų | 94.6 | 40% | 0.402 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -67.7 | -45.9 | 177.8 | -178.1 | -102.2 | 0 | 0 | 0 | 112.6 | G8 I9 T14 W15 I16 | G8-W12 WeakPolarHBondContact O-CB 3.45Å; G8-W12 PolarHBondContact O-N 3.06Å; I9-W12 PolarHBondContact O-N 3.19Å; W12-T14 VanDerWaalsContact C-N 3.32Å; W12-T14 PolarHBondContact O-N 3.43Å; W12-W15 HydrophobicContact CD2-CE3 4.46Å; W12-W15 AromaticContact CE3-CE3 3.94Å; W12-W15 HydrophobicContact CE3-CE3 3.94Å; W12-W15 HydrophobicContact CE3-CZ3 4.32Å; W12-W15 AromaticContact CH2-CE3 3.97Å; W12-W15 HydrophobicContact CH2-CE3 3.97Å; W12-W15 AromaticContact CH2-CZ3 3.53Å; W12-W15 HydrophobicContact CH2-CZ3 3.53Å; W12-W15 HydrophobicContact CZ2-CE3 4.47Å; W12-W15 HydrophobicContact CZ2-CZ3 4.2Å; W12-W15 AromaticContact CZ3-CE3 3.68Å; W12-W15 HydrophobicContact CZ3-CE3 3.68Å; W12-W15 AromaticContact CZ3-CZ3 3.6Å; W12-W15 HydrophobicContact CZ3-CZ3 3.6Å; W12-W15 PolarHBondContact O-N 2.92Å; W12-W15 VanDerWaalsContact O-N 3.15Å; W12-I16 HydrophobicContact CZ2-CD1 3.93Å; W12-I16 HydrophobicContact CZ2-CG1 4.32Å; W12-I16 PolarHBondContact O-N 2.83Å |
| 13 | Q | 63.2 | Low | 62.7 | Low | 60 Ų | 60 | 90.4 Ų | 90.4 | 28% | 0.28 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -58.7 | -45.4 | 175.5 | -76.2 | -171.1 | -12.8 | 0 | 0 | 111.2 | I9 W15 I16 I17 | I9-Q13 HydrophobicContact CG2-CG 4.35Å; I9-Q13 WeakPolarHBondContact O-CB 3.42Å; I9-Q13 WeakPolarHBondContact O-CG 3.15Å; I9-Q13 PolarHBondContact O-N 2.79Å; Q13-W15 VanDerWaalsContact C-N 3.3Å; Q13-W15 PolarHBondContact O-N 3.03Å; Q13-I16 PolarHBondContact O-N 3.46Å; Q13-I17 WeakPolarHBondContact O-CB 3.45Å; Q13-I17 VanDerWaalsContact O-CG1 3.26Å; Q13-I17 WeakPolarHBondContact O-CG1 3.31Å; Q13-I17 PolarHBondContact O-N 3Å |
| 14 | T | 70.2 | Confident | 62.7 | Low | 65 Ų | 65 | 90.6 Ų | 90.6 | 40% | 0.399 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -62.4 | -39.3 | 176.8 | -55.5 | 0 | 0 | 0 | 0 | 111.2 | F10 W12 R18 | F10-T14 WeakPolarHBondContact O-CB 3.5Å; F10-T14 PolarHBondContact O-N 2.88Å; F10-T14 PolarHBondContact O-OG1 3.48Å; W12-T14 VanDerWaalsContact C-N 3.32Å; W12-T14 PolarHBondContact O-N 3.43Å; T14-R18 WeakPolarHBondContact O-CB 3.45Å; T14-R18 VanDerWaalsContact O-CG 3.31Å; T14-R18 WeakPolarHBondContact O-CG 3.22Å; T14-R18 PolarHBondContact O-N 3.47Å |
| 15 | W | 70.3 | Confident | 62.2 | Low | 134 Ų | 134 | 85.3 Ų | 85.3 | 51% | 0.508 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -66.6 | -46.2 | 177.8 | -175.8 | 75 | 0 | 0 | 0 | 112.4 | S11 W12 Q13 I17 R18 L19 | S11-W15 WeakPolarHBondContact O-CB 3.32Å; S11-W15 PolarHBondContact O-N 3.41Å; W12-W15 HydrophobicContact CD2-CE3 4.46Å; W12-W15 AromaticContact CE3-CE3 3.94Å; W12-W15 HydrophobicContact CE3-CE3 3.94Å; W12-W15 HydrophobicContact CE3-CZ3 4.32Å; W12-W15 AromaticContact CH2-CE3 3.97Å; W12-W15 HydrophobicContact CH2-CE3 3.97Å; W12-W15 AromaticContact CH2-CZ3 3.53Å; W12-W15 HydrophobicContact CH2-CZ3 3.53Å; W12-W15 HydrophobicContact CZ2-CE3 4.47Å; W12-W15 HydrophobicContact CZ2-CZ3 4.2Å; W12-W15 AromaticContact CZ3-CE3 3.68Å; W12-W15 HydrophobicContact CZ3-CE3 3.68Å; W12-W15 AromaticContact CZ3-CZ3 3.6Å; W12-W15 HydrophobicContact CZ3-CZ3 3.6Å; W12-W15 PolarHBondContact O-N 2.92Å; W12-W15 VanDerWaalsContact O-N 3.15Å; Q13-W15 VanDerWaalsContact C-N 3.3Å; Q13-W15 PolarHBondContact O-N 3.03Å; W15-I17 PolarHBondContact O-N 3.2Å; W15-R18 PolarHBondContact O-N 2.88Å; W15-L19 HydrophobicContact CD2-CD1 4.48Å; W15-L19 HydrophobicContact CH2-CD1 3.63Å; W15-L19 HydrophobicContact CZ2-CD1 3.51Å; W15-L19 HydrophobicContact CZ3-CD1 4.16Å; W15-L19 WeakPolarHBondContact O-CB 3.39Å; W15-L19 PolarHBondContact O-N 2.9Å |
| 16 | I | 66.3 | Low | 61.9 | Low | 54 Ų | 54 | 89 Ų | 89 | 28% | 0.277 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -61.2 | -44.5 | 175.6 | -72.1 | -169.2 | 0 | 0 | 0 | 111.1 | W12 Q13 R18 L19 L20 | W12-I16 HydrophobicContact CZ2-CD1 3.93Å; W12-I16 HydrophobicContact CZ2-CG1 4.32Å; W12-I16 PolarHBondContact O-N 2.83Å; Q13-I16 PolarHBondContact O-N 3.46Å; I16-R18 VanDerWaalsContact C-N 3.33Å; I16-R18 PolarHBondContact O-N 3.38Å; I16-L19 PolarHBondContact O-N 2.8Å; I16-L20 HydrophobicContact CG2-CD1 3.8Å; I16-L20 HydrophobicContact CG2-CG 4.25Å; I16-L20 WeakPolarHBondContact O-CB 3.14Å; I16-L20 WeakPolarHBondContact O-CG 3.33Å; I16-L20 PolarHBondContact O-N 3.25Å |
| 17 | I | 66.8 | Low | 61.7 | Low | 110 Ų | 110 | 93.8 Ų | 93.8 | 56% | 0.564 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -62.8 | -41.7 | 178.7 | -68.1 | 166.2 | 0 | 0 | 0 | 110.6 | Q13 W15 L20 K21 | Q13-I17 WeakPolarHBondContact O-CB 3.45Å; Q13-I17 VanDerWaalsContact O-CG1 3.26Å; Q13-I17 WeakPolarHBondContact O-CG1 3.31Å; Q13-I17 PolarHBondContact O-N 3Å; W15-I17 PolarHBondContact O-N 3.2Å; I17-L20 PolarHBondContact O-N 2.83Å; I17-K21 WeakPolarHBondContact O-CB 3.43Å; I17-K21 PolarHBondContact O-N 3.45Å |
| 18 | R | 67.1 | Low | 60.9 | Low | 170 Ų | 170 | 97.3 Ų | 97.3 | 64% | 0.642 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -62.1 | -43.4 | 174.1 | -76.8 | 179.4 | -177.1 | -178.1 | 2.5 | 111.6 | T14 W15 I16 K21 D22 | T14-R18 WeakPolarHBondContact O-CB 3.45Å; T14-R18 VanDerWaalsContact O-CG 3.31Å; T14-R18 WeakPolarHBondContact O-CG 3.22Å; T14-R18 PolarHBondContact O-N 3.47Å; W15-R18 PolarHBondContact O-N 2.88Å; I16-R18 VanDerWaalsContact C-N 3.33Å; I16-R18 PolarHBondContact O-N 3.38Å; R18-K21 PolarHBondContact O-N 2.83Å; R18-D22 WeakPolarHBondContact O-CB 3.37Å; R18-D22 PolarHBondContact O-N 3.43Å |
| 19 | L | 64.5 | Low | 59.9 | Low | 71 Ų | 71 | 105.3 Ų | 105.3 | 37% | 0.372 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -66.5 | -40 | 180 | -157.4 | 151.2 | 0 | 0 | 0 | 111.7 | W15 I16 K23 | W15-L19 HydrophobicContact CD2-CD1 4.48Å; W15-L19 HydrophobicContact CH2-CD1 3.63Å; W15-L19 HydrophobicContact CZ2-CD1 3.51Å; W15-L19 HydrophobicContact CZ3-CD1 4.16Å; W15-L19 WeakPolarHBondContact O-CB 3.39Å; W15-L19 PolarHBondContact O-N 2.9Å; I16-L19 PolarHBondContact O-N 2.8Å; L19-K23 HydrophobicContact CD2-CD 4.35Å; L19-K23 WeakPolarHBondContact O-CB 3.38Å; L19-K23 WeakPolarHBondContact O-CG 3.38Å; L19-K23 PolarHBondContact O-N 3.4Å |
| 20 | L | 60.5 | Low | 58.9 | Low | 82 Ų | 82 | 107.4 Ų | 107.4 | 43% | 0.429 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -65.9 | -41 | 172.2 | -73.6 | 171.4 | 0 | 0 | 0 | 111.8 | I16 I17 K23 A24 | I16-L20 HydrophobicContact CG2-CD1 3.8Å; I16-L20 HydrophobicContact CG2-CG 4.25Å; I16-L20 WeakPolarHBondContact O-CB 3.14Å; I16-L20 WeakPolarHBondContact O-CG 3.33Å; I16-L20 PolarHBondContact O-N 3.25Å; I17-L20 PolarHBondContact O-N 2.83Å; L20-K23 PolarHBondContact O-N 2.89Å; L20-A24 VanDerWaalsContact O-CB 3.32Å; L20-A24 WeakPolarHBondContact O-CB 3.27Å; L20-A24 PolarHBondContact O-N 2.77Å |
| 21 | K | 59.5 | Low | 57.7 | Low | 154 Ų | 154 | 106 Ų | 106 | 67% | 0.67 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -67.3 | -39.7 | 177.8 | -170.1 | 178.4 | -179.2 | 179.6 | 0 | 111.7 | I17 R18 A24 A25 | I17-K21 WeakPolarHBondContact O-CB 3.43Å; I17-K21 PolarHBondContact O-N 3.45Å; R18-K21 PolarHBondContact O-N 2.83Å; K21-A24 PolarHBondContact O-N 3.45Å; K21-A25 WeakPolarHBondContact O-CB 3.44Å; K21-A25 PolarHBondContact O-N 2.8Å |
| 22 | D | 57.9 | Low | 56.5 | Low | 116 Ų | 116 | 111.1 Ų | 111.1 | 62% | 0.62 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -66.9 | -39.5 | 175.1 | -80 | -8.5 | 0 | 0 | 0 | 110.9 | R18 N26 | R18-D22 WeakPolarHBondContact O-CB 3.37Å; R18-D22 PolarHBondContact O-N 3.43Å; D22-N26 WeakPolarHBondContact O-CB 3.28Å; D22-N26 PolarHBondContact O-N 3.18Å |
| 23 | K | 56.1 | Low | 55.2 | Low | 95 Ų | 95 | 113.2 Ų | 113.2 | 41% | 0.413 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -65.3 | -45.9 | 172.9 | -76.7 | -163 | 177.4 | -163.8 | 0 | 112.6 | L19 L20 A25 N26 E27 H50 | L19-K23 HydrophobicContact CD2-CD 4.35Å; L19-K23 WeakPolarHBondContact O-CB 3.38Å; L19-K23 WeakPolarHBondContact O-CG 3.38Å; L19-K23 PolarHBondContact O-N 3.4Å; L20-K23 PolarHBondContact O-N 2.89Å; K23-A25 VanDerWaalsContact C-N 3.35Å; K23-A25 PolarHBondContact O-N 3.28Å; K23-N26 PolarHBondContact O-N 2.85Å; K23-N26 VanDerWaalsContact O-N 3.17Å; K23-E27 PolarHBondContact O-N 3.47Å; K23-H50 PolarHBondContact NZ-CE1 3.38Å |
| 24 | A | 54.3 | Low | 54 | Low | 49 Ų | 49 | 112.8 Ų | 112.8 | 41% | 0.405 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -64.3 | -39.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | L20 K21 N26 E27 Q28 | L20-A24 VanDerWaalsContact O-CB 3.32Å; L20-A24 WeakPolarHBondContact O-CB 3.27Å; L20-A24 PolarHBondContact O-N 2.77Å; K21-A24 PolarHBondContact O-N 3.45Å; A24-N26 VanDerWaalsContact C-N 3.32Å; A24-E27 PolarHBondContact O-N 3.49Å; A24-Q28 WeakPolarHBondContact O-CB 3.31Å; A24-Q28 PolarHBondContact O-N 3.3Å |
| 25 | A | 49.4 | Very low | 52.4 | Low | 41 Ų | 41 | 116.3 Ų | 116.3 | 34% | 0.339 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -68.5 | -31.6 | 174.4 | 0 | 0 | 0 | 0 | 0 | 112.1 | K21 K23 R29 | K21-A25 WeakPolarHBondContact O-CB 3.44Å; K21-A25 PolarHBondContact O-N 2.8Å; K23-A25 VanDerWaalsContact C-N 3.35Å; K23-A25 PolarHBondContact O-N 3.28Å; A25-R29 VanDerWaalsContact O-CB 3.23Å; A25-R29 WeakPolarHBondContact O-CB 3.16Å; A25-R29 VanDerWaalsContact O-CG 3.23Å; A25-R29 WeakPolarHBondContact O-CG 3.29Å; A25-R29 PolarHBondContact O-N 3.4Å |
| 26 | N | 50.3 | Low | 50.9 | Low | 121 Ų | 121 | 120.4 Ų | 120.4 | 65% | 0.647 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -74 | -36.3 | 175.5 | -161.7 | 41.6 | 0 | 0 | 0 | 112 | D22 K23 A24 | D22-N26 WeakPolarHBondContact O-CB 3.28Å; D22-N26 PolarHBondContact O-N 3.18Å; K23-N26 PolarHBondContact O-N 2.85Å; K23-N26 VanDerWaalsContact O-N 3.17Å; A24-N26 VanDerWaalsContact C-N 3.32Å |
| 27 | E | 47.9 | Very low | 49.9 | Very low | 146 Ų | 146 | 125.8 Ų | 125.8 | 68% | 0.682 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -73 | -38.2 | 172.5 | -73 | 179.2 | 160.4 | 0 | 0 | 112.1 | K23 A24 R29 I30 | K23-E27 PolarHBondContact O-N 3.47Å; A24-E27 PolarHBondContact O-N 3.49Å; E27-R29 PolarHBondContact O-N 3.48Å; E27-I30 PolarHBondContact O-N 2.92Å; E27-I30 VanDerWaalsContact O-N 3.12Å |
| 28 | Q | 45.8 | Very low | 48.9 | Very low | 168 Ų | 168 | 126.7 Ų | 126.7 | 79% | 0.785 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -73.1 | -15.6 | 176.1 | -159.9 | 169.6 | 18.7 | 0 | 0 | 112.6 | A24 I30 | A24-Q28 WeakPolarHBondContact O-CB 3.31Å; A24-Q28 PolarHBondContact O-N 3.3Å; Q28-I30 VanDerWaalsContact C-N 3.33Å |
| 29 | R | 44.6 | Very low | 47.7 | Very low | 206 Ų | 206 | 126.3 Ų | 126.3 | 78% | 0.777 | 65% | 0.646 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.6 | 17.1 | 168.1 | -81.6 | -171.9 | -171.9 | -175.8 | 5.6 | 113.8 | A25 E27 P31 | A25-R29 VanDerWaalsContact O-CB 3.23Å; A25-R29 WeakPolarHBondContact O-CB 3.16Å; A25-R29 VanDerWaalsContact O-CG 3.23Å; A25-R29 WeakPolarHBondContact O-CG 3.29Å; A25-R29 PolarHBondContact O-N 3.4Å; E27-R29 PolarHBondContact O-N 3.48Å; R29-P31 WeakPolarHBondContact O-CD 3.34Å |
| 30 | I | 44 | Very low | 46.5 | Very low | 113 Ų | 113 | 131.6 Ų | 131.6 | 58% | 0.579 | 67% | 0.666 | S | S | * | * | S | Bend | trans | -88.1 | 86.4 | 154.4 | -50.1 | 174 | 0 | 0 | 0 | 106.2 | E27 Q28 L32 L33 | E27-I30 PolarHBondContact O-N 2.92Å; E27-I30 VanDerWaalsContact O-N 3.12Å; Q28-I30 VanDerWaalsContact C-N 3.33Å; I30-L32 PolarHBondContact O-N 2.79Å; I30-L32 VanDerWaalsContact O-N 3.16Å; I30-L33 HydrophobicContact CG2-CD1 4.33Å |
| 31 | P | 39.5 | Very low | 45.7 | Very low | 93 Ų | 93 | 135.5 Ų | 135.5 | 60% | 0.604 | 68% | 0.682 | S | S | * | * | trans | -64.3 | 119.5 | 175.8 | 28.3 | -34.5 | 0 | 0 | 0 | 107.4 | R29 L33 | R29-P31 WeakPolarHBondContact O-CD 3.34Å; P31-L33 PolarHBondContact O-N 2.84Å | ||
| 32 | L | 42.2 | Very low | 44.8 | Very low | 179 Ų | 179 | 135.8 Ų | 135.8 | 94% | 0.937 | 69% | 0.691 | S | S | * | * | trans | 35.7 | 48.1 | 143.9 | -91.3 | 143.5 | 0 | 0 | 0 | 114.4 | I30 G34 | I30-L32 PolarHBondContact O-N 2.79Å; I30-L32 VanDerWaalsContact O-N 3.16Å; L32-G34 VanDerWaalsContact C-N 3.32Å; L32-G34 PolarHBondContact O-N 2.96Å | ||
| 33 | L | 38.6 | Very low | 44.1 | Very low | 151 Ų | 151 | 141.1 Ų | 141.1 | 79% | 0.791 | 70% | 0.702 | S | S | * | * | trans | -77.9 | 98.6 | -179.8 | -117.6 | 151.2 | 0 | 0 | 0 | 104.5 | I30 P31 | I30-L33 HydrophobicContact CG2-CD1 4.33Å; P31-L33 PolarHBondContact O-N 2.84Å | ||
| 34 | G | 37.7 | Very low | 43.4 | Very low | 50 Ų | 50 | 145.7 Ų | 145.7 | 52% | 0.515 | 72% | 0.722 | S | S | . | * | trans | -48.1 | 143.5 | -166.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | L32 W36 | L32-G34 VanDerWaalsContact C-N 3.32Å; L32-G34 PolarHBondContact O-N 2.96Å; G34-W36 PolarHBondContact O-N 3.41Å | ||
| 35 | V | 37.9 | Very low | 42.8 | Very low | 139 Ų | 139 | 150.1 Ų | 150.1 | 84% | 0.842 | 75% | 0.747 | S | S | * | * | trans | 46.2 | 61.4 | 134.1 | -165.9 | 0 | 0 | 0 | 0 | 112.8 | K37 | V35-K37 PolarHBondContact O-N 3.15Š| ||
| 36 | W | 38.7 | Very low | 42.3 | Very low | 220 Ų | 220 | 150.9 Ų | 150.9 | 83% | 0.833 | 76% | 0.758 | S | S | * | * | trans | -92.6 | 92.1 | 164.2 | -139.9 | 69.3 | 0 | 0 | 0 | 108.6 | G34 | G34-W36 PolarHBondContact O-N 3.41Š| ||
| 37 | K | 45.7 | Very low | 41.7 | Very low | 168 Ų | 168 | 150.7 Ų | 150.7 | 73% | 0.73 | 77% | 0.766 | S | S | * | * | trans | -57 | 135.7 | 170.4 | -117.3 | 177 | 176.5 | 178.3 | 0 | 109 | V35 E39 | V35-K37 PolarHBondContact O-N 3.15Å; K37-E39 PolarHBondContact O-N 2.98Å | ||
| 38 | P | 44.7 | Very low | 41.1 | Very low | 128 Ų | 128 | 152.5 Ų | 152.5 | 83% | 0.831 | 77% | 0.772 | S | S | * | * | trans | -78.1 | 89.4 | 176.9 | 31.4 | -31.5 | 0 | 0 | 0 | 109.2 | ||||
| 39 | E | 41.8 | Very low | 40.7 | Very low | 162 Ų | 162 | 154.7 Ų | 154.7 | 76% | 0.757 | 77% | 0.773 | S | S | * | * | trans | -99.4 | 105.7 | 165.3 | -160.7 | 162.6 | -166.2 | 0 | 0 | 108 | K37 | K37-E39 PolarHBondContact O-N 2.98Š| ||
| 40 | K | 39 | Very low | 41 | Very low | 183 Ų | 183 | 149.2 Ų | 149.2 | 80% | 0.796 | 76% | 0.756 | S | S | * | * | trans | 13.5 | 109.9 | 155.5 | -64.8 | 170.6 | 178.5 | 173.7 | 0 | 114.6 | ||||
| 41 | E | 44.9 | Very low | 41.1 | Very low | 163 Ų | 163 | 148.8 Ų | 148.8 | 76% | 0.762 | 76% | 0.76 | S | S | * | * | trans | 174 | 106.2 | 142.2 | -93.8 | 154.2 | -144.7 | 0 | 0 | 112.3 | W43 | E41-W43 VanDerWaalsContact O-CD1 3.28Å; E41-W43 PolarHBondContact O-N 2.97Å | ||
| 42 | N | 40.2 | Very low | 41.4 | Very low | 160 Ų | 160 | 148.6 Ų | 148.6 | 86% | 0.856 | 75% | 0.753 | S | S | * | * | trans | 49.2 | 52.1 | 138.9 | -59.6 | -42.9 | 0 | 0 | 0 | 121.2 | K44 | N42-K44 PolarHBondContact O-N 2.79Š| ||
| 43 | W | 43.1 | Very low | 41.7 | Very low | 229 Ų | 229 | 143.4 Ų | 143.4 | 87% | 0.867 | 73% | 0.729 | S | S | * | * | trans | -85.5 | 104.1 | 165.2 | -72.4 | 84.5 | 0 | 0 | 0 | 111.5 | E41 | E41-W43 VanDerWaalsContact O-CD1 3.28Å; E41-W43 PolarHBondContact O-N 2.97Å | ||
| 44 | K | 42.1 | Very low | 42.3 | Very low | 191 Ų | 191 | 140.9 Ų | 140.9 | 83% | 0.83 | 72% | 0.716 | S | S | * | * | trans | -62.3 | 131.6 | 167.3 | -75.1 | 178.9 | 176 | 176.6 | 0 | 109.4 | N42 G46 | N42-K44 PolarHBondContact O-N 2.79Å; K44-G46 VanDerWaalsContact C-N 3.34Å; K44-G46 PolarHBondContact O-N 3.43Å | ||
| 45 | P | 40.9 | Very low | 42.9 | Very low | 142 Ų | 142 | 141.5 Ų | 141.5 | 92% | 0.922 | 71% | 0.711 | S | S | * | * | trans | -77.6 | 87.5 | 175.6 | 31.6 | -31 | 0 | 0 | 0 | 108.6 | ||||
| 46 | G | 39 | Very low | 43.5 | Very low | 56 Ų | 56 | 142.8 Ų | 142.8 | 58% | 0.577 | 70% | 0.702 | S | S | * | * | trans | -140.5 | 116.1 | -179.9 | 0 | 0 | 0 | 0 | 0 | 110.6 | K44 | K44-G46 VanDerWaalsContact C-N 3.34Å; K44-G46 PolarHBondContact O-N 3.43Å | ||
| 47 | S | 37.2 | Very low | 44.1 | Very low | 117 Ų | 117 | 137.2 Ų | 137.2 | 82% | 0.818 | 68% | 0.683 | S | S | * | * | S | Bend | trans | 68.3 | 75.3 | 159.3 | 64.2 | 0 | 0 | 0 | 0 | 118.7 | ||
| 48 | F | 36.6 | Very low | 44.5 | Very low | 184 Ų | 184 | 131.9 Ų | 131.9 | 81% | 0.807 | 67% | 0.667 | S | S | * | * | trans | -149.3 | 75.3 | 135.1 | -130.7 | -100.2 | 0 | 0 | 0 | 109.8 | H50 | F48-H50 VanDerWaalsContact C-N 3.31Å; F48-H50 HydrophobicContact CD1-CB 3.85Å; F48-H50 HydrophobicContact CE1-CB 4.16Å; F48-H50 AromaticContact CE1-CD2 3.55Å; F48-H50 PolarHBondContact O-N 3.37Å | ||
| 49 | R | 37.4 | Very low | 44.9 | Very low | 214 Ų | 214 | 131.9 Ų | 131.9 | 81% | 0.808 | 65% | 0.654 | S | S | * | * | trans | -74.1 | 86.7 | 165.7 | -76.2 | -173.8 | -166.4 | 179.3 | 3.6 | 107.9 | D52 | R49-D52 WeakPolarHBondContact CD-OD2 3.5Š| ||
| 50 | H | 49 | Very low | 45.8 | Very low | 91 Ų | 91 | 129.3 Ų | 129.3 | 42% | 0.421 | 65% | 0.645 | S | S | . | * | trans | -108.5 | -2.8 | 174.2 | -149 | -55.3 | 0 | 0 | 0 | 112.8 | K23 F48 | K23-H50 PolarHBondContact NZ-CE1 3.38Å; F48-H50 VanDerWaalsContact C-N 3.31Å; F48-H50 HydrophobicContact CD1-CB 3.85Å; F48-H50 HydrophobicContact CE1-CB 4.16Å; F48-H50 AromaticContact CE1-CD2 3.55Å; F48-H50 PolarHBondContact O-N 3.37Å | ||
| 51 | T | 47.3 | Very low | 46.7 | Very low | 105 Ų | 105 | 122.4 Ų | 122.4 | 64% | 0.644 | 62% | 0.619 | S | S | * | * | S | Bend | trans | -97.8 | -14.1 | -179.1 | 34.4 | 0 | 0 | 0 | 0 | 114.6 | ||
| 52 | D | 46.2 | Very low | 47.3 | Very low | 88 Ų | 88 | 118.7 Ų | 118.7 | 47% | 0.471 | 60% | 0.604 | S | S | . | * | S | Bend | trans | -89.8 | -14.3 | -177.3 | -57.5 | -38.7 | 0 | 0 | 0 | 113.7 | R49 P55 Y56 | R49-D52 WeakPolarHBondContact CD-OD2 3.5Å; D52-P55 WeakPolarHBondContact O-CD 3.31Å; D52-P55 WeakPolarHBondContact O-CG 3.3Å; D52-Y56 VanDerWaalsContact O-CD2 3.3Å; D52-Y56 WeakPolarHBondContact O-CD2 3.37Å; D52-Y56 WeakPolarHBondContact O-CE2 3.44Å |
| 53 | T | 48.3 | Very low | 48.3 | Very low | 70 Ų | 70 | 116.1 Ų | 116.1 | 43% | 0.429 | 59% | 0.594 | S | S | . | * | S | Bend | trans | -87.8 | -22.1 | -177.2 | -15.5 | 0 | 0 | 0 | 0 | 113.3 | Y56 F57 | T53-Y56 PolarHBondContact O-N 3.46Å; T53-F57 HydrophobicContact CG2-CE2 4.2Å; T53-F57 WeakPolarHBondContact O-CD2 3.26Å |
| 54 | L | 50.1 | Low | 49.2 | Very low | 99 Ų | 99 | 114.4 Ų | 114.4 | 52% | 0.518 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -63.5 | -39.6 | -179.4 | -80.2 | 159.8 | 0 | 0 | 0 | 114.9 | Y56 F57 | L54-Y56 VanDerWaalsContact C-N 3.29Å; L54-Y56 PolarHBondContact O-N 2.75Å; L54-F57 PolarHBondContact O-N 3.29Å |
| 55 | P | 51.2 | Low | 49.9 | Very low | 63 Ų | 63 | 106.8 Ų | 106.8 | 41% | 0.409 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -63.7 | -35.4 | 177.9 | 21.9 | -31.9 | 0 | 0 | 0 | 112.2 | D52 F57 C58 F59 | D52-P55 WeakPolarHBondContact O-CD 3.31Å; D52-P55 WeakPolarHBondContact O-CG 3.3Å; P55-F57 PolarHBondContact O-N 2.72Å; P55-C58 PolarHBondContact O-N 3.27Å; P55-F59 HydrophobicContact CB-CE2 4.43Å; P55-F59 WeakPolarHBondContact O-CD2 3.38Å; P55-F59 PolarHBondContact O-N 3.45Å |
| 56 | Y | 49.7 | Very low | 50.8 | Low | 165 Ų | 165 | 103.5 Ų | 103.5 | 65% | 0.647 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -65.8 | -34.1 | -177.1 | -69.6 | -79.4 | 0 | 0 | 0 | 113.7 | D52 T53 L54 C58 F59 L60 | D52-Y56 VanDerWaalsContact O-CD2 3.3Å; D52-Y56 WeakPolarHBondContact O-CD2 3.37Å; D52-Y56 WeakPolarHBondContact O-CE2 3.44Å; T53-Y56 PolarHBondContact O-N 3.46Å; L54-Y56 VanDerWaalsContact C-N 3.29Å; L54-Y56 PolarHBondContact O-N 2.75Å; Y56-C58 VanDerWaalsContact C-N 3.28Å; Y56-C58 PolarHBondContact O-N 2.96Å; Y56-F59 PolarHBondContact O-N 3.44Å; Y56-L60 PolarHBondContact O-N 2.75Å |
| 57 | F | 51.8 | Low | 51.8 | Low | 103 Ų | 103 | 102.8 Ų | 102.8 | 45% | 0.452 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -70.9 | -23.6 | 176.9 | -80.3 | -78.8 | 0 | 0 | 0 | 113.3 | T53 L54 P55 L60 P61 | T53-F57 HydrophobicContact CG2-CE2 4.2Å; T53-F57 WeakPolarHBondContact O-CD2 3.26Å; L54-F57 PolarHBondContact O-N 3.29Å; P55-F57 PolarHBondContact O-N 2.72Å; F57-L60 HydrophobicContact CD1-CD1 4.23Å; F57-P61 VanDerWaalsContact O-CD 3.29Å; F57-P61 WeakPolarHBondContact O-CD 3.38Å |
| 58 | C | 54.2 | Low | 52.8 | Low | 56 Ų | 56 | 100.1 Ų | 100.1 | 38% | 0.378 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -79.5 | -21.4 | 175.1 | -69.1 | 0 | 0 | 0 | 0 | 113.4 | P55 Y56 P61 | P55-C58 PolarHBondContact O-N 3.27Å; Y56-C58 VanDerWaalsContact C-N 3.28Å; Y56-C58 PolarHBondContact O-N 2.96Å; C58-P61 WeakPolarHBondContact O-CD 3.44Å |
| 59 | F | 53.2 | Low | 53.4 | Low | 128 Ų | 128 | 95.2 Ų | 95.2 | 56% | 0.561 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -87.2 | -24.8 | 178.8 | -74.4 | -73.2 | 0 | 0 | 0 | 113.9 | P55 Y56 L62 V63 | P55-F59 HydrophobicContact CB-CE2 4.43Å; P55-F59 WeakPolarHBondContact O-CD2 3.38Å; P55-F59 PolarHBondContact O-N 3.45Å; Y56-F59 PolarHBondContact O-N 3.44Å; F59-L62 HydrophobicContact CD1-CD1 4.22Å; F59-L62 WeakPolarHBondContact O-CB 3.35Å; F59-L62 PolarHBondContact O-N 2.91Å; F59-L62 VanDerWaalsContact O-N 3.17Å; F59-V63 PolarHBondContact O-N 3.41Å; F59-V63 VanDerWaalsContact O-N 3.14Å |
| 60 | L | 59.8 | Low | 54.2 | Low | 108 Ų | 108 | 91.8 Ų | 91.8 | 57% | 0.565 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -57.4 | -41.5 | 178.2 | -83.2 | 157.3 | 0 | 0 | 0 | 113.8 | Y56 F57 V63 W64 | Y56-L60 PolarHBondContact O-N 2.75Å; F57-L60 HydrophobicContact CD1-CD1 4.23Å; L60-V63 PolarHBondContact O-N 3.46Å; L60-W64 WeakPolarHBondContact O-CB 3.31Å; L60-W64 PolarHBondContact O-N 2.85Å |
| 61 | P | 58.7 | Low | 54.5 | Low | 39 Ų | 39 | 98 Ų | 98 | 25% | 0.253 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -64.6 | -38.9 | 174.6 | -20.5 | 31.6 | 0 | 0 | 0 | 112.7 | F57 C58 V63 W64 I65 | F57-P61 VanDerWaalsContact O-CD 3.29Å; F57-P61 WeakPolarHBondContact O-CD 3.38Å; C58-P61 WeakPolarHBondContact O-CD 3.44Å; P61-V63 PolarHBondContact O-N 2.85Å; P61-W64 PolarHBondContact O-N 3.48Å; P61-I65 HydrophobicContact CB-CD1 4.39Å; P61-I65 WeakPolarHBondContact O-CB 3.3Å; P61-I65 VanDerWaalsContact O-CD1 3.3Å; P61-I65 WeakPolarHBondContact O-CD1 3.2Å; P61-I65 WeakPolarHBondContact O-CG1 3.48Å; P61-I65 PolarHBondContact O-N 2.99Å |
| 62 | L | 56.5 | Low | 54.5 | Low | 85 Ų | 85 | 97.9 Ų | 97.9 | 45% | 0.445 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62.4 | -43.6 | 178.8 | -85.1 | 149.5 | 0 | 0 | 0 | 111.5 | F59 I65 S66 | F59-L62 HydrophobicContact CD1-CD1 4.22Å; F59-L62 WeakPolarHBondContact O-CB 3.35Å; F59-L62 PolarHBondContact O-N 2.91Å; F59-L62 VanDerWaalsContact O-N 3.17Å; L62-I65 PolarHBondContact O-N 3.43Å; L62-S66 PolarHBondContact O-N 2.86Å; L62-S66 PolarHBondContact O-OG 2.83Å; L62-S66 VanDerWaalsContact O-OG 3.07Å |
| 63 | V | 62.8 | Low | 54.8 | Low | 106 Ų | 106 | 98.9 Ų | 98.9 | 64% | 0.642 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -67 | -41.2 | 177 | 177.9 | 0 | 0 | 0 | 0 | 111.4 | F59 L60 P61 S66 G67 | F59-V63 PolarHBondContact O-N 3.41Å; F59-V63 VanDerWaalsContact O-N 3.14Å; L60-V63 PolarHBondContact O-N 3.46Å; P61-V63 PolarHBondContact O-N 2.85Å; V63-S66 PolarHBondContact O-N 2.95Å; V63-G67 PolarHBondContact O-N 3.46Å; V63-G67 VanDerWaalsContact O-N 3.1Å |
| 64 | W | 60.3 | Low | 54.9 | Low | 193 Ų | 193 | 106 Ų | 106 | 73% | 0.731 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -63.2 | -44.3 | 177.5 | -169.7 | -87.4 | 0 | 0 | 0 | 111.7 | L60 P61 G67 T68 | L60-W64 WeakPolarHBondContact O-CB 3.31Å; L60-W64 PolarHBondContact O-N 2.85Å; P61-W64 PolarHBondContact O-N 3.48Å; W64-G67 WeakPolarHBondContact O-CA 3.21Å; W64-G67 PolarHBondContact O-N 3.43Å; W64-G67 VanDerWaalsContact O-N 3.09Å; W64-T68 PolarHBondContact O-N 3.07Å |
| 65 | I | 57 | Low | 55 | Low | 30 Ų | 30 | 105.6 Ų | 105.6 | 15% | 0.154 | 52% | 0.523 | C | S | . | . | H | α-helix | trans | -67.2 | -39.2 | 179.8 | -71.8 | 166.2 | 0 | 0 | 0 | 110.9 | P61 L62 G67 T68 Y69 F79 | P61-I65 HydrophobicContact CB-CD1 4.39Å; P61-I65 WeakPolarHBondContact O-CB 3.3Å; P61-I65 VanDerWaalsContact O-CD1 3.3Å; P61-I65 WeakPolarHBondContact O-CD1 3.2Å; P61-I65 WeakPolarHBondContact O-CG1 3.48Å; P61-I65 PolarHBondContact O-N 2.99Å; L62-I65 PolarHBondContact O-N 3.43Å; I65-G67 VanDerWaalsContact C-N 3.25Å; I65-G67 PolarHBondContact O-N 3.17Å; I65-T68 WeakPolarHBondContact CA-OG1 3.25Å; I65-T68 PolarHBondContact O-N 3.22Å; I65-T68 PolarHBondContact O-OG1 3.37Å; I65-Y69 HydrophobicContact CG2-CD2 3.9Å; I65-Y69 HydrophobicContact CG2-CE2 3.21Å; I65-Y69 WeakPolarHBondContact O-CD2 3.14Å; I65-Y69 PolarHBondContact O-N 3.34Å; I65-F79 HydrophobicContact CG2-CD2 4.01Å; I65-F79 HydrophobicContact CG2-CE2 3.54Å |
| 66 | S | 59.8 | Low | 54.7 | Low | 73 Ų | 73 | 109.7 Ų | 109.7 | 51% | 0.51 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -59.2 | -34.4 | 169.2 | -64.9 | 0 | 0 | 0 | 0 | 113.2 | L62 V63 | L62-S66 PolarHBondContact O-N 2.86Å; L62-S66 PolarHBondContact O-OG 2.83Å; L62-S66 VanDerWaalsContact O-OG 3.07Å; V63-S66 PolarHBondContact O-N 2.95Å |
| 67 | G | 60.4 | Low | 54.5 | Low | 41 Ų | 41 | 110.2 Ų | 110.2 | 42% | 0.423 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -70.1 | -38.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | V63 W64 I65 Y69 I70 | V63-G67 PolarHBondContact O-N 3.46Å; V63-G67 VanDerWaalsContact O-N 3.1Å; W64-G67 WeakPolarHBondContact O-CA 3.21Å; W64-G67 PolarHBondContact O-N 3.43Å; W64-G67 VanDerWaalsContact O-N 3.09Å; I65-G67 VanDerWaalsContact C-N 3.25Å; I65-G67 PolarHBondContact O-N 3.17Å; G67-Y69 VanDerWaalsContact C-N 3.33Å; G67-I70 PolarHBondContact O-N 3.38Å |
| 68 | T | 58.8 | Low | 54.2 | Low | 62 Ų | 62 | 107.7 Ų | 107.7 | 38% | 0.38 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -71.7 | -27.4 | 177.4 | 53.9 | 0 | 0 | 0 | 0 | 112.5 | W64 I65 I70 W71 D72 | W64-T68 PolarHBondContact O-N 3.07Å; I65-T68 WeakPolarHBondContact CA-OG1 3.25Å; I65-T68 PolarHBondContact O-N 3.22Å; I65-T68 PolarHBondContact O-OG1 3.37Å; T68-I70 PolarHBondContact O-N 3.36Å; T68-W71 PolarHBondContact O-N 3.5Å; T68-W71 VanDerWaalsContact O-N 3.11Å; T68-D72 PolarHBondContact O-N 2.88Å |
| 69 | Y | 50 | Low | 53.6 | Low | 81 Ų | 81 | 107.9 Ų | 107.9 | 32% | 0.318 | 54% | 0.535 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -62.1 | -23.9 | 172.7 | -82.8 | -58.3 | 0 | 0 | 0 | 114.7 | I65 G67 W71 F79 | I65-Y69 HydrophobicContact CG2-CD2 3.9Å; I65-Y69 HydrophobicContact CG2-CE2 3.21Å; I65-Y69 WeakPolarHBondContact O-CD2 3.14Å; I65-Y69 PolarHBondContact O-N 3.34Å; G67-Y69 VanDerWaalsContact C-N 3.33Å; Y69-W71 VanDerWaalsContact C-N 3.26Å; Y69-F79 HydrophobicContact CE1-CG 4.43Å; Y69-F79 HydrophobicContact CE2-CD1 4.41Å; Y69-F79 AromaticContact CE2-CD2 3.73Å; Y69-F79 HydrophobicContact CE2-CD2 3.73Å; Y69-F79 HydrophobicContact CE2-CE1 4.13Å; Y69-F79 AromaticContact CE2-CE2 3.35Å; Y69-F79 HydrophobicContact CE2-CE2 3.35Å; Y69-F79 HydrophobicContact CE2-CG 4.2Å; Y69-F79 AromaticContact CE2-CZ 3.56Å; Y69-F79 HydrophobicContact CE2-CZ 3.56Å; Y69-F79 AromaticContact CZ-CD1 3.9Å; Y69-F79 AromaticContact CZ-CD2 3.47Å; Y69-F79 VanDerWaalsContact CZ-CD2 3.47Å; Y69-F79 AromaticContact CZ-CE2 3.62Å; Y69-F79 AromaticContact CZ-CG 3.57Å; Y69-F79 AromaticContact CZ-CZ 3.89Å; Y69-F79 WeakPolarHBondContact OH-CB 3.44Å; Y69-F79 WeakPolarHBondContact OH-CD2 3.26Å; Y69-F79 VanDerWaalsContact OH-CE2 3.3Å; Y69-F79 WeakPolarHBondContact OH-CE2 3.16Å; Y69-F79 WeakPolarHBondContact OH-CG 3.46Å |
| 70 | I | 54.1 | Low | 53.1 | Low | 142 Ų | 142 | 106.6 Ų | 106.6 | 73% | 0.728 | 53% | 0.534 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.1 | -22.1 | 178.5 | -61.9 | 172.6 | 0 | 0 | 0 | 110.8 | G67 T68 | G67-I70 PolarHBondContact O-N 3.38Å; T68-I70 PolarHBondContact O-N 3.36Å |
| 71 | W | 53.7 | Low | 52.4 | Low | 222 Ų | 222 | 108.1 Ų | 108.1 | 84% | 0.841 | 54% | 0.542 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.8 | -30.7 | -172.3 | -96 | 46.9 | 0 | 0 | 0 | 114.9 | T68 Y69 | T68-W71 PolarHBondContact O-N 3.5Å; T68-W71 VanDerWaalsContact O-N 3.11Å; Y69-W71 VanDerWaalsContact C-N 3.26Å |
| 72 | D | 47.3 | Very low | 51.9 | Low | 101 Ų | 101 | 107.4 Ų | 107.4 | 54% | 0.54 | 54% | 0.54 | S | S | . | . | trans | -140.5 | 104 | -178.6 | -93.8 | -67.3 | 0 | 0 | 0 | 112.2 | T68 Y74 | T68-D72 PolarHBondContact O-N 2.88Å; D72-Y74 PolarHBondContact O-N 3.21Å; D72-Y74 VanDerWaalsContact O-N 3.13Å | ||
| 73 | P | 53.2 | Low | 51.6 | Low | 110 Ų | 110 | 105.5 Ų | 105.5 | 71% | 0.714 | 53% | 0.532 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.4 | 9.9 | -179.3 | 29.2 | -33.2 | 0 | 0 | 0 | 114.5 | ||
| 74 | Y | 50.9 | Low | 50.9 | Low | 220 Ų | 220 | 104.4 Ų | 104.4 | 86% | 0.863 | 53% | 0.525 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -104.4 | -1.2 | -168.4 | -104 | -88.8 | 0 | 0 | 0 | 116.1 | D72 | D72-Y74 PolarHBondContact O-N 3.21Å; D72-Y74 VanDerWaalsContact O-N 3.13Å |
| 75 | E | 50.8 | Low | 50.3 | Low | 90 Ų | 90 | 98 Ų | 98 | 42% | 0.421 | 51% | 0.51 | S | S | . | . | trans | -107.7 | 56.9 | -175.5 | -64.2 | -160.1 | 139.3 | 0 | 0 | 113.8 | ||||
| 76 | F | 45 | Very low | 50.1 | Low | 149 Ų | 149 | 99 Ų | 99 | 65% | 0.654 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -79.7 | -31.1 | -174.6 | -138 | -93.5 | 0 | 0 | 0 | 114.3 | D80 | F76-D80 PolarHBondContact O-N 2.8Å |
| 77 | E | 45.9 | Very low | 49.7 | Very low | 176 Ų | 176 | 101 Ų | 101 | 82% | 0.822 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -80.1 | -38.9 | -174.3 | -72.1 | -166.3 | 156.1 | 0 | 0 | 113.9 | F79 D80 | E77-F79 PolarHBondContact O-N 3.34Å; E77-D80 PolarHBondContact O-N 2.92Å |
| 78 | A | 46.1 | Very low | 49 | Very low | 50 Ų | 50 | 102.8 Ų | 102.8 | 41% | 0.413 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -66.5 | -27.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | A82 | A78-A82 WeakPolarHBondContact O-CB 3.13Å; A78-A82 PolarHBondContact O-N 2.85Å; A78-A82 VanDerWaalsContact O-N 3.08Å |
| 79 | F | 42.3 | Very low | 48.7 | Very low | 59 Ų | 59 | 101.4 Ų | 101.4 | 26% | 0.259 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -68.2 | -45.2 | 176.7 | -178.5 | -127.6 | 0 | 0 | 0 | 113.1 | I65 Y69 E77 L81 A82 V83 | I65-F79 HydrophobicContact CG2-CD2 4.01Å; I65-F79 HydrophobicContact CG2-CE2 3.54Å; Y69-F79 HydrophobicContact CE1-CG 4.43Å; Y69-F79 HydrophobicContact CE2-CD1 4.41Å; Y69-F79 AromaticContact CE2-CD2 3.73Å; Y69-F79 HydrophobicContact CE2-CD2 3.73Å; Y69-F79 HydrophobicContact CE2-CE1 4.13Å; Y69-F79 AromaticContact CE2-CE2 3.35Å; Y69-F79 HydrophobicContact CE2-CE2 3.35Å; Y69-F79 HydrophobicContact CE2-CG 4.2Å; Y69-F79 AromaticContact CE2-CZ 3.56Å; Y69-F79 HydrophobicContact CE2-CZ 3.56Å; Y69-F79 AromaticContact CZ-CD1 3.9Å; Y69-F79 AromaticContact CZ-CD2 3.47Å; Y69-F79 VanDerWaalsContact CZ-CD2 3.47Å; Y69-F79 AromaticContact CZ-CE2 3.62Å; Y69-F79 AromaticContact CZ-CG 3.57Å; Y69-F79 AromaticContact CZ-CZ 3.89Å; Y69-F79 WeakPolarHBondContact OH-CB 3.44Å; Y69-F79 WeakPolarHBondContact OH-CD2 3.26Å; Y69-F79 VanDerWaalsContact OH-CE2 3.3Å; Y69-F79 WeakPolarHBondContact OH-CE2 3.16Å; Y69-F79 WeakPolarHBondContact OH-CG 3.46Å; E77-F79 PolarHBondContact O-N 3.34Å; F79-L81 PolarHBondContact O-N 2.77Å; F79-A82 CarbonylContact O-C 3.59Å; F79-A82 PolarHBondContact O-N 3.39Å; F79-V83 HydrophobicContact CD1-CG2 4.05Å; F79-V83 HydrophobicContact CD2-CG2 3.43Å; F79-V83 VanDerWaalsContact CD2-CG2 3.43Å; F79-V83 HydrophobicContact CE1-CG2 3.75Å; F79-V83 HydrophobicContact CE2-CG2 3.11Å; F79-V83 HydrophobicContact CG-CG2 3.94Å; F79-V83 HydrophobicContact CZ-CG2 3.32Å; F79-V83 WeakPolarHBondContact O-CB 3.25Å; F79-V83 VanDerWaalsContact O-CG2 3.31Å; F79-V83 WeakPolarHBondContact O-CG2 3.38Å; F79-V83 PolarHBondContact O-N 2.79Å |
| 80 | D | 42.7 | Very low | 49 | Very low | 102 Ų | 102 | 100.4 Ų | 100.4 | 55% | 0.545 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.7 | -42.1 | -177.8 | -155.6 | -95.8 | 0 | 0 | 0 | 110 | F76 E77 A82 V83 V84 | F76-D80 PolarHBondContact O-N 2.8Å; E77-D80 PolarHBondContact O-N 2.92Å; D80-A82 PolarHBondContact O-N 3.49Å; D80-V83 PolarHBondContact O-N 3.23Å; D80-V84 VanDerWaalsContact O-CB 3.23Å; D80-V84 WeakPolarHBondContact O-CB 3.29Å; D80-V84 WeakPolarHBondContact O-CG2 3.04Å; D80-V84 PolarHBondContact O-N 3.26Å |
| 81 | L | 44.5 | Very low | 48.9 | Very low | 139 Ų | 139 | 97.8 Ų | 97.8 | 73% | 0.728 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -64.6 | -39.4 | 173.8 | -116.2 | 118.1 | 0 | 0 | 0 | 113.3 | F79 S85 | F79-L81 PolarHBondContact O-N 2.77Å; L81-S85 WeakPolarHBondContact O-CB 3.22Å; L81-S85 PolarHBondContact O-N 2.8Å |
| 82 | A | 48.5 | Very low | 48.9 | Very low | 24 Ų | 24 | 90.5 Ų | 90.5 | 20% | 0.198 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -70 | -41.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | A78 F79 D80 S85 V86 | A78-A82 WeakPolarHBondContact O-CB 3.13Å; A78-A82 PolarHBondContact O-N 2.85Å; A78-A82 VanDerWaalsContact O-N 3.08Å; F79-A82 CarbonylContact O-C 3.59Å; F79-A82 PolarHBondContact O-N 3.39Å; D80-A82 PolarHBondContact O-N 3.49Å; A82-S85 PolarHBondContact O-N 3.46Å; A82-V86 WeakPolarHBondContact O-CB 3.25Å; A82-V86 VanDerWaalsContact O-CG2 3.25Å; A82-V86 WeakPolarHBondContact O-CG2 3.12Å; A82-V86 PolarHBondContact O-N 3.05Å |
| 83 | V | 49.9 | Very low | 49.2 | Very low | 46 Ų | 46 | 89.6 Ų | 89.6 | 28% | 0.279 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -66.5 | -42.4 | 175.9 | 173.8 | 0 | 0 | 0 | 0 | 110.5 | F79 D80 S85 V86 H87 | F79-V83 HydrophobicContact CD1-CG2 4.05Å; F79-V83 HydrophobicContact CD2-CG2 3.43Å; F79-V83 VanDerWaalsContact CD2-CG2 3.43Å; F79-V83 HydrophobicContact CE1-CG2 3.75Å; F79-V83 HydrophobicContact CE2-CG2 3.11Å; F79-V83 HydrophobicContact CG-CG2 3.94Å; F79-V83 HydrophobicContact CZ-CG2 3.32Å; F79-V83 WeakPolarHBondContact O-CB 3.25Å; F79-V83 VanDerWaalsContact O-CG2 3.31Å; F79-V83 WeakPolarHBondContact O-CG2 3.38Å; F79-V83 PolarHBondContact O-N 2.79Å; D80-V83 PolarHBondContact O-N 3.23Å; V83-S85 VanDerWaalsContact C-N 3.34Å; V83-V86 PolarHBondContact O-N 3.32Å; V83-H87 WeakPolarHBondContact O-CB 3.21Å; V83-H87 PolarHBondContact O-N 3.48Å |
| 84 | V | 48 | Very low | 49.4 | Very low | 82 Ų | 82 | 89 Ų | 89 | 50% | 0.497 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -64.6 | -39.3 | 174.4 | 171.5 | 0 | 0 | 0 | 0 | 110.6 | D80 H87 C88 | D80-V84 VanDerWaalsContact O-CB 3.23Å; D80-V84 WeakPolarHBondContact O-CB 3.29Å; D80-V84 WeakPolarHBondContact O-CG2 3.04Å; D80-V84 PolarHBondContact O-N 3.26Å; V84-H87 PolarHBondContact O-N 3.48Å; V84-C88 WeakPolarHBondContact O-CB 3.12Å; V84-C88 PolarHBondContact O-N 3.14Å |
| 85 | S | 48 | Very low | 49.6 | Very low | 60 Ų | 60 | 81.6 Ų | 81.6 | 42% | 0.42 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -64.6 | -42.6 | 174.8 | -173.7 | 0 | 0 | 0 | 0 | 112.2 | L81 A82 V83 C88 G89 | L81-S85 WeakPolarHBondContact O-CB 3.22Å; L81-S85 PolarHBondContact O-N 2.8Å; A82-S85 PolarHBondContact O-N 3.46Å; V83-S85 VanDerWaalsContact C-N 3.34Å; S85-C88 PolarHBondContact O-N 3.17Å; S85-G89 PolarHBondContact O-N 3.04Å |
| 86 | V | 52.9 | Low | 49.7 | Very low | 50 Ų | 50 | 81 Ų | 81 | 30% | 0.303 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -67.2 | -43.9 | 175.4 | 172.2 | 0 | 0 | 0 | 0 | 110.7 | A82 V83 C88 G89 V90 | A82-V86 WeakPolarHBondContact O-CB 3.25Å; A82-V86 VanDerWaalsContact O-CG2 3.25Å; A82-V86 WeakPolarHBondContact O-CG2 3.12Å; A82-V86 PolarHBondContact O-N 3.05Å; V83-V86 PolarHBondContact O-N 3.32Å; V86-C88 PolarHBondContact O-N 2.87Å; V86-G89 PolarHBondContact O-N 2.9Å; V86-V90 HydrophobicContact CG1-CG2 4.16Å; V86-V90 VanDerWaalsContact O-CB 3.25Å; V86-V90 WeakPolarHBondContact O-CB 3.46Å; V86-V90 WeakPolarHBondContact O-CG2 3.48Å; V86-V90 PolarHBondContact O-N 3.32Å |
| 87 | H | 50 | Low | 50.3 | Low | 115 Ų | 115 | 78.7 Ų | 78.7 | 53% | 0.532 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -64.1 | -40.3 | 175.4 | -102.2 | -82.5 | 0 | 0 | 0 | 112 | V83 V84 N91 | V83-H87 WeakPolarHBondContact O-CB 3.21Å; V83-H87 PolarHBondContact O-N 3.48Å; V84-H87 PolarHBondContact O-N 3.48Å; H87-N91 WeakPolarHBondContact O-CB 3.3Å; H87-N91 PolarHBondContact O-N 3.45Å; H87-N91 PolarHBondContact O-ND2 3.08Å |
| 88 | C | 46.9 | Very low | 50.8 | Low | 78 Ų | 78 | 75 Ų | 75 | 53% | 0.527 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -71.7 | -36.9 | 178.6 | -156.7 | 0 | 0 | 0 | 0 | 111.3 | V84 S85 V86 S92 | V84-C88 WeakPolarHBondContact O-CB 3.12Å; V84-C88 PolarHBondContact O-N 3.14Å; S85-C88 PolarHBondContact O-N 3.17Å; V86-C88 PolarHBondContact O-N 2.87Å; C88-S92 VanDerWaalsContact O-CB 3.26Å; C88-S92 WeakPolarHBondContact O-CB 3.18Å; C88-S92 PolarHBondContact O-N 2.86Å; C88-S92 PolarHBondContact O-OG 3.08Å |
| 89 | G | 53.1 | Low | 51.1 | Low | 33 Ų | 33 | 81.7 Ų | 81.7 | 34% | 0.34 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -65.9 | -45.3 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | S85 V86 S92 L93 | S85-G89 PolarHBondContact O-N 3.04Å; V86-G89 PolarHBondContact O-N 2.9Å; G89-S92 PolarHBondContact O-N 2.77Å; G89-L93 VanDerWaalsContact O-CB 3.31Å; G89-L93 WeakPolarHBondContact O-CB 3.28Å; G89-L93 PolarHBondContact O-N 3.46Å |
| 90 | V | 54.7 | Low | 51.5 | Low | 61 Ų | 61 | 85 Ų | 85 | 37% | 0.37 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -68.4 | -39.7 | 176.1 | 172.9 | 0 | 0 | 0 | 0 | 110.9 | V86 L93 L94 | V86-V90 HydrophobicContact CG1-CG2 4.16Å; V86-V90 VanDerWaalsContact O-CB 3.25Å; V86-V90 WeakPolarHBondContact O-CB 3.46Å; V86-V90 WeakPolarHBondContact O-CG2 3.48Å; V86-V90 PolarHBondContact O-N 3.32Å; V90-L93 PolarHBondContact O-N 2.76Å; V90-L94 WeakPolarHBondContact O-CB 3.29Å; V90-L94 PolarHBondContact O-N 3.1Å |
| 91 | N | 52.1 | Low | 52 | Low | 86 Ų | 86 | 85 Ų | 85 | 46% | 0.46 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -68.5 | -35.1 | 175.1 | -73.4 | -17.8 | 0 | 0 | 0 | 112.3 | H87 S95 | H87-N91 WeakPolarHBondContact O-CB 3.3Å; H87-N91 PolarHBondContact O-N 3.45Å; H87-N91 PolarHBondContact O-ND2 3.08Å; N91-S95 WeakPolarHBondContact O-CB 3.09Å; N91-S95 PolarHBondContact O-N 3.23Å; N91-S95 PolarHBondContact O-OG 3.06Å |
| 92 | S | 53.7 | Low | 52.4 | Low | 70 Ų | 70 | 82.5 Ų | 82.5 | 49% | 0.49 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -69.6 | -40.7 | 171.8 | -83 | 0 | 0 | 0 | 0 | 112.2 | C88 G89 S95 C96 | C88-S92 VanDerWaalsContact O-CB 3.26Å; C88-S92 WeakPolarHBondContact O-CB 3.18Å; C88-S92 PolarHBondContact O-N 2.86Å; C88-S92 PolarHBondContact O-OG 3.08Å; G89-S92 PolarHBondContact O-N 2.77Å; S92-S95 PolarHBondContact O-N 3.47Å; S92-C96 VanDerWaalsContact O-CB 3.3Å; S92-C96 WeakPolarHBondContact O-CB 3.39Å; S92-C96 PolarHBondContact O-N 3.34Å |
| 93 | L | 54.7 | Low | 52.5 | Low | 82 Ų | 82 | 85.6 Ų | 85.6 | 43% | 0.429 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -67.1 | -43.6 | 175.3 | -100.2 | 155.6 | 0 | 0 | 0 | 111.5 | G89 V90 C96 L97 | G89-L93 VanDerWaalsContact O-CB 3.31Å; G89-L93 WeakPolarHBondContact O-CB 3.28Å; G89-L93 PolarHBondContact O-N 3.46Å; V90-L93 PolarHBondContact O-N 2.76Å; L93-C96 PolarHBondContact O-N 2.85Å; L93-L97 VanDerWaalsContact O-CB 3.31Å; L93-L97 WeakPolarHBondContact O-CB 3.47Å; L93-L97 VanDerWaalsContact O-CG 3.28Å; L93-L97 WeakPolarHBondContact O-CG 3.33Å; L93-L97 PolarHBondContact O-N 3.09Å |
| 94 | L | 56.5 | Low | 52.5 | Low | 96 Ų | 96 | 89.9 Ų | 89.9 | 50% | 0.503 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.8 | -41.3 | 175.1 | -172.1 | 69.4 | 0 | 0 | 0 | 110.5 | V90 L97 L98 | V90-L94 WeakPolarHBondContact O-CB 3.29Å; V90-L94 PolarHBondContact O-N 3.1Å; L94-L97 PolarHBondContact O-N 3.43Å; L94-L98 HydrophobicContact CG-CD1 4.04Å; L94-L98 WeakPolarHBondContact O-CB 3.48Å; L94-L98 WeakPolarHBondContact O-CD1 3.3Å; L94-L98 WeakPolarHBondContact O-CG 3.34Å; L94-L98 PolarHBondContact O-N 2.94Å |
| 95 | S | 55.2 | Low | 52.5 | Low | 66 Ų | 66 | 88.1 Ų | 88.1 | 46% | 0.462 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.5 | -38.1 | 173.3 | -73.9 | 0 | 0 | 0 | 0 | 112.6 | N91 S92 R99 | N91-S95 WeakPolarHBondContact O-CB 3.09Å; N91-S95 PolarHBondContact O-N 3.23Å; N91-S95 PolarHBondContact O-OG 3.06Å; S92-S95 PolarHBondContact O-N 3.47Å; S95-R99 WeakPolarHBondContact O-CB 3.1Å; S95-R99 VanDerWaalsContact O-CG 3.31Å; S95-R99 WeakPolarHBondContact O-CG 3.23Å; S95-R99 PolarHBondContact O-N 3.48Å |
| 96 | C | 53.3 | Low | 52.5 | Low | 78 Ų | 78 | 91.7 Ų | 91.7 | 53% | 0.527 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -68 | -43.9 | 174.7 | -86.8 | 0 | 0 | 0 | 0 | 111.6 | S92 L93 R99 H100 | S92-C96 VanDerWaalsContact O-CB 3.3Å; S92-C96 WeakPolarHBondContact O-CB 3.39Å; S92-C96 PolarHBondContact O-N 3.34Å; L93-C96 PolarHBondContact O-N 2.85Å; C96-R99 PolarHBondContact O-N 3.07Å; C96-H100 PolarHBondContact O-N 3.04Å |
| 97 | L | 57.9 | Low | 52 | Low | 99 Ų | 99 | 99.9 Ų | 99.9 | 52% | 0.518 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -64.9 | -43.3 | 176.2 | -75.6 | 169.4 | 0 | 0 | 0 | 111.1 | L93 L94 R99 H100 V101 | L93-L97 VanDerWaalsContact O-CB 3.31Å; L93-L97 WeakPolarHBondContact O-CB 3.47Å; L93-L97 VanDerWaalsContact O-CG 3.28Å; L93-L97 WeakPolarHBondContact O-CG 3.33Å; L93-L97 PolarHBondContact O-N 3.09Å; L94-L97 PolarHBondContact O-N 3.43Å; L97-R99 VanDerWaalsContact C-N 3.34Å; L97-R99 PolarHBondContact O-N 2.88Å; L97-H100 PolarHBondContact O-N 3.23Å; L97-V101 WeakPolarHBondContact O-CB 3.48Å; L97-V101 VanDerWaalsContact O-CG2 3.27Å; L97-V101 WeakPolarHBondContact O-CG2 3.4Å; L97-V101 PolarHBondContact O-N 3.06Å |
| 98 | L | 56.3 | Low | 51.5 | Low | 98 Ų | 98 | 106.7 Ų | 106.7 | 51% | 0.513 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -60.8 | -42.9 | 173.4 | -78.3 | 166.2 | 0 | 0 | 0 | 111.2 | L94 H100 V101 V102 | L94-L98 HydrophobicContact CG-CD1 4.04Å; L94-L98 WeakPolarHBondContact O-CB 3.48Å; L94-L98 WeakPolarHBondContact O-CD1 3.3Å; L94-L98 WeakPolarHBondContact O-CG 3.34Å; L94-L98 PolarHBondContact O-N 2.94Å; L98-H100 PolarHBondContact O-N 3.06Å; L98-V101 PolarHBondContact O-N 3.35Å; L98-V102 VanDerWaalsContact O-CB 3.29Å; L98-V102 WeakPolarHBondContact O-CB 2.95Å; L98-V102 WeakPolarHBondContact O-CG2 3.3Å; L98-V102 PolarHBondContact O-N 3.43Å |
| 99 | R | 52.5 | Low | 51.7 | Low | 192 Ų | 192 | 108.2 Ų | 108.2 | 73% | 0.725 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -61.9 | -42 | 173.3 | -79.8 | 177.3 | 179.7 | -113 | 1.3 | 111.8 | S95 C96 L97 V103 | S95-R99 WeakPolarHBondContact O-CB 3.1Å; S95-R99 VanDerWaalsContact O-CG 3.31Å; S95-R99 WeakPolarHBondContact O-CG 3.23Å; S95-R99 PolarHBondContact O-N 3.48Å; C96-R99 PolarHBondContact O-N 3.07Å; L97-R99 VanDerWaalsContact C-N 3.34Å; L97-R99 PolarHBondContact O-N 2.88Å; R99-V103 WeakPolarHBondContact O-CB 2.69Å; R99-V103 WeakPolarHBondContact O-CG2 2.81Å; R99-V103 PolarHBondContact O-N 3.44Å |
| 100 | H | 50.9 | Low | 51.7 | Low | 129 Ų | 129 | 112.1 Ų | 112.1 | 60% | 0.597 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -66.2 | -41.4 | 177.1 | -114.1 | -78.9 | 0 | 0 | 0 | 112.7 | C96 L97 L98 V103 M104 | C96-H100 PolarHBondContact O-N 3.04Å; L97-H100 PolarHBondContact O-N 3.23Å; L98-H100 PolarHBondContact O-N 3.06Å; H100-V103 PolarHBondContact O-N 3.33Å; H100-M104 WeakPolarHBondContact O-CB 3.31Å; H100-M104 WeakPolarHBondContact O-CG 3.44Å; H100-M104 PolarHBondContact O-N 3.34Å |
| 101 | V | 51.4 | Low | 51.5 | Low | 101 Ų | 101 | 114.9 Ų | 114.9 | 61% | 0.612 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -68.6 | -40.3 | 177.3 | 171.7 | 0 | 0 | 0 | 0 | 111 | L97 L98 M104 G105 | L97-V101 WeakPolarHBondContact O-CB 3.48Å; L97-V101 VanDerWaalsContact O-CG2 3.27Å; L97-V101 WeakPolarHBondContact O-CG2 3.4Å; L97-V101 PolarHBondContact O-N 3.06Å; L98-V101 PolarHBondContact O-N 3.35Å; V101-M104 PolarHBondContact O-N 3.34Å; V101-G105 PolarHBondContact O-N 3.11Å |
| 102 | V | 54 | Low | 51.5 | Low | 87 Ų | 87 | 116.6 Ų | 116.6 | 53% | 0.527 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -66.9 | -38.8 | 174.9 | 170.3 | 0 | 0 | 0 | 0 | 111.2 | L98 G105 N106 | L98-V102 VanDerWaalsContact O-CB 3.29Å; L98-V102 WeakPolarHBondContact O-CB 2.95Å; L98-V102 WeakPolarHBondContact O-CG2 3.3Å; L98-V102 PolarHBondContact O-N 3.43Å; V102-G105 PolarHBondContact O-N 3.25Å; V102-N106 WeakPolarHBondContact O-CB 3.09Å; V102-N106 PolarHBondContact O-N 3.13Å |
| 103 | V | 49.8 | Very low | 51.3 | Low | 88 Ų | 88 | 119.6 Ų | 119.6 | 53% | 0.533 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -67.4 | -39.4 | 175.6 | 169.9 | 0 | 0 | 0 | 0 | 111.4 | R99 H100 | R99-V103 WeakPolarHBondContact O-CB 2.69Å; R99-V103 WeakPolarHBondContact O-CG2 2.81Å; R99-V103 PolarHBondContact O-N 3.44Å; H100-V103 PolarHBondContact O-N 3.33Å |
| 104 | M | 51 | Low | 51.1 | Low | 136 Ų | 136 | 122.1 Ų | 122.1 | 67% | 0.67 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -73.4 | -31 | 174.8 | -71.7 | -66.5 | -156.8 | 0 | 0 | 113.1 | H100 V101 | H100-M104 WeakPolarHBondContact O-CB 3.31Å; H100-M104 WeakPolarHBondContact O-CG 3.44Å; H100-M104 PolarHBondContact O-N 3.34Å; V101-M104 PolarHBondContact O-N 3.34Å |
| 105 | G | 48.3 | Very low | 50.7 | Low | 46 Ų | 46 | 123.9 Ų | 123.9 | 47% | 0.474 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -79.2 | -19.3 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | V101 V102 W107 | V101-G105 PolarHBondContact O-N 3.11Å; V102-G105 PolarHBondContact O-N 3.25Å; G105-W107 VanDerWaalsContact C-N 3.32Å |
| 106 | N | 46.6 | Very low | 50.4 | Low | 134 Ų | 134 | 128.4 Ų | 128.4 | 72% | 0.717 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.7 | 6.6 | 172 | -96.2 | -12.5 | 0 | 0 | 0 | 113.5 | V102 | V102-N106 WeakPolarHBondContact O-CB 3.09Å; V102-N106 PolarHBondContact O-N 3.13Å |
| 107 | W | 44.2 | Very low | 50.1 | Low | 223 Ų | 223 | 132.6 Ų | 132.6 | 85% | 0.845 | 66% | 0.655 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -114.3 | 15 | 176.3 | -84.2 | 73.2 | 0 | 0 | 0 | 113 | G105 | G105-W107 VanDerWaalsContact C-N 3.32Š|
| 108 | F | 38.8 | Very low | 49.4 | Very low | 258 Ų | 258 | 135.6 Ų | 135.6 | 100% | 1.132 | 67% | 0.668 | S | S | * | * | trans | -119.9 | 0 | 171.8 | -125.4 | -83.5 | 0 | 0 | 0 | 109.9 |
Retrieved 108 of 108 residues in 70 ms
(Link to these results)