| 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 | 42.9 | Very low | 50.4 | Low | 211 Ų | 211 | 137.9 Ų | 137.9 | 100% | 1.039 | 67% | 0.669 | S | S | * | * | 0 | 115.9 | 0 | -70.4 | -176.5 | -178.8 | 0 | 0 | 108.1 | |||||
| 2 | R | 35.9 | Very low | 51.3 | Low | 250 Ų | 250 | 135.2 Ų | 135.2 | 94% | 0.943 | 65% | 0.652 | S | S | * | * | trans | -84.5 | 113.9 | 173.5 | -76.6 | -179.3 | 167.8 | 176.2 | -3.9 | 107.8 | I4 | R2-I4 PolarHBondContact O-N 3.42Š| ||
| 3 | C | 37.3 | Very low | 52.2 | Low | 113 Ų | 113 | 128.2 Ų | 128.2 | 76% | 0.764 | 63% | 0.626 | S | S | * | * | trans | -64.8 | 121.1 | 173 | -64.4 | 0 | 0 | 0 | 0 | 108.7 | F5 | C3-F5 PolarHBondContact O-N 3.22Š| ||
| 4 | I | 52.6 | Low | 53.2 | Low | 142 Ų | 142 | 121.4 Ų | 121.4 | 73% | 0.728 | 59% | 0.593 | S | S | * | * | trans | -73 | 107.3 | 172.1 | -59.2 | 172 | 0 | 0 | 0 | 106.2 | R2 I6 | R2-I4 PolarHBondContact O-N 3.42Å; I4-I6 VanDerWaalsContact C-N 3.3Å; I4-I6 HydrophobicContact CG2-CG1 3.8Å; I4-I6 PolarHBondContact O-N 3.23Å | ||
| 5 | F | 46.9 | Very low | 54 | Low | 192 Ų | 192 | 118.9 Ų | 118.9 | 84% | 0.842 | 59% | 0.588 | S | S | * | * | trans | -72.2 | 90.7 | 168.1 | -100.9 | -91.2 | 0 | 0 | 0 | 107.8 | C3 T7 | C3-F5 PolarHBondContact O-N 3.22Å; F5-T7 PolarHBondContact O-N 3.45Å | ||
| 6 | I | 55 | Low | 54.6 | Low | 64 Ų | 64 | 112.4 Ų | 112.4 | 33% | 0.328 | 56% | 0.557 | S | S | . | * | trans | -72.3 | 111.8 | 171.8 | -55.5 | 178.6 | 0 | 0 | 0 | 106.3 | I4 E10 Q11 I14 | I4-I6 VanDerWaalsContact C-N 3.3Å; I4-I6 HydrophobicContact CG2-CG1 3.8Å; I4-I6 PolarHBondContact O-N 3.23Å; I6-E10 HydrophobicContact CG2-CB 3.38Å; I6-Q11 HydrophobicContact CB-CG 4.08Å; I6-Q11 HydrophobicContact CG2-CB 4.37Å; I6-Q11 HydrophobicContact CG2-CG 3.52Å; I6-Q11 PolarHBondContact O-NE2 3.32Å; I6-I14 HydrophobicContact CD1-CD1 4.27Å; I6-I14 HydrophobicContact CG2-CD1 4.03Å | ||
| 7 | T | 57.2 | Low | 55.4 | Low | 78 Ų | 78 | 106.1 Ų | 106.1 | 48% | 0.479 | 53% | 0.527 | S | S | . | . | trans | -60.8 | 153.4 | 176.2 | 56.3 | 0 | 0 | 0 | 0 | 110.2 | F5 Y9 E10 Q11 | F5-T7 PolarHBondContact O-N 3.45Å; T7-Y9 PolarHBondContact O-N 2.8Å; T7-E10 PolarHBondContact N-OE2 2.96Å; T7-E10 VanDerWaalsContact N-OE2 3.11Å; T7-E10 WeakPolarHBondContact O-CA 3.34Å; T7-E10 WeakPolarHBondContact O-CB 3.11Å; T7-E10 PolarHBondContact O-N 3.5Å; T7-E10 WeakPolarHBondContact OG1-CG 3.28Å; T7-E10 PolarHBondContact OG1-OE2 3.25Å; T7-Q11 PolarHBondContact O-N 3.48Å | ||
| 8 | V | 55.5 | Low | 56.1 | Low | 119 Ų | 119 | 104.2 Ų | 104.2 | 72% | 0.721 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -52.4 | -34.7 | 179.3 | 178.5 | 0 | 0 | 0 | 0 | 111.4 | Q11 F12 | V8-Q11 PolarHBondContact O-N 2.95Å; V8-F12 WeakPolarHBondContact O-CB 3.36Å; V8-F12 PolarHBondContact O-N 2.94Å |
| 9 | Y | 55.5 | Low | 56.5 | Low | 150 Ų | 150 | 102 Ų | 102 | 59% | 0.588 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -64 | -41.3 | 174.9 | -173.5 | -95.2 | 0 | 0 | 0 | 113.2 | T7 S13 | T7-Y9 PolarHBondContact O-N 2.8Å; Y9-S13 WeakPolarHBondContact O-CB 3.35Å; Y9-S13 PolarHBondContact O-N 2.85Å; Y9-S13 PolarHBondContact O-OG 3.16Å |
| 10 | E | 56.4 | Low | 56.9 | Low | 91 Ų | 91 | 97.7 Ų | 97.7 | 43% | 0.425 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -70.9 | -39 | 176.1 | -71.8 | 177.1 | 110.3 | 0 | 0 | 111.5 | I6 T7 F12 S13 I14 | I6-E10 HydrophobicContact CG2-CB 3.38Å; T7-E10 PolarHBondContact N-OE2 2.96Å; T7-E10 VanDerWaalsContact N-OE2 3.11Å; T7-E10 WeakPolarHBondContact O-CA 3.34Å; T7-E10 WeakPolarHBondContact O-CB 3.11Å; T7-E10 PolarHBondContact O-N 3.5Å; T7-E10 WeakPolarHBondContact OG1-CG 3.28Å; T7-E10 PolarHBondContact OG1-OE2 3.25Å; E10-F12 VanDerWaalsContact C-N 3.31Å; E10-F12 PolarHBondContact O-N 3.35Å; E10-S13 PolarHBondContact O-N 3.47Å; E10-I14 WeakPolarHBondContact O-CB 3.39Å; E10-I14 WeakPolarHBondContact O-CD1 3.17Å; E10-I14 WeakPolarHBondContact O-CG1 3.27Å; E10-I14 PolarHBondContact O-N 3.41Å |
| 11 | Q | 58.6 | Low | 57.3 | Low | 107 Ų | 107 | 97.1 Ų | 97.1 | 50% | 0.5 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -60.1 | -43.8 | 173.4 | -65.3 | -173 | 9 | 0 | 0 | 111.2 | I6 T7 V8 I14 T15 | I6-Q11 HydrophobicContact CB-CG 4.08Å; I6-Q11 HydrophobicContact CG2-CB 4.37Å; I6-Q11 HydrophobicContact CG2-CG 3.52Å; I6-Q11 PolarHBondContact O-NE2 3.32Å; T7-Q11 PolarHBondContact O-N 3.48Å; V8-Q11 PolarHBondContact O-N 2.95Å; Q11-I14 PolarHBondContact O-N 2.86Å; Q11-T15 WeakPolarHBondContact O-CB 3.3Å; Q11-T15 PolarHBondContact O-N 2.8Å; Q11-T15 PolarHBondContact O-OG1 3.5Å |
| 12 | F | 61.7 | Low | 58.5 | Low | 105 Ų | 105 | 93 Ų | 93 | 46% | 0.461 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -62.6 | -43.7 | 175.6 | -169.9 | -96.4 | 0 | 0 | 0 | 111.5 | V8 E10 I14 T15 C16 S31 | V8-F12 WeakPolarHBondContact O-CB 3.36Å; V8-F12 PolarHBondContact O-N 2.94Å; E10-F12 VanDerWaalsContact C-N 3.31Å; E10-F12 PolarHBondContact O-N 3.35Å; F12-I14 PolarHBondContact O-N 3.39Å; F12-T15 PolarHBondContact O-N 2.79Å; F12-C16 WeakPolarHBondContact O-CB 3.36Å; F12-C16 PolarHBondContact O-N 3.32Å; F12-S31 WeakPolarHBondContact CZ-O 3.47Å |
| 13 | S | 63.6 | Low | 59.7 | Low | 45 Ų | 45 | 84.4 Ų | 84.4 | 32% | 0.315 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -64.4 | -39.7 | 178.6 | -61.5 | 0 | 0 | 0 | 0 | 112.6 | Y9 E10 C17 | Y9-S13 WeakPolarHBondContact O-CB 3.35Å; Y9-S13 PolarHBondContact O-N 2.85Å; Y9-S13 PolarHBondContact O-OG 3.16Å; E10-S13 PolarHBondContact O-N 3.47Å; S13-C17 VanDerWaalsContact O-CB 3.29Å; S13-C17 WeakPolarHBondContact O-CB 3.46Å; S13-C17 PolarHBondContact O-N 3.07Å |
| 14 | I | 65.2 | Low | 60.7 | Low | 32 Ų | 32 | 83.2 Ų | 83.2 | 16% | 0.164 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -66.6 | -48.5 | 175.7 | -67.1 | 164.8 | 0 | 0 | 0 | 110.2 | I6 E10 Q11 F12 C16 C17 I18 L51 | I6-I14 HydrophobicContact CD1-CD1 4.27Å; I6-I14 HydrophobicContact CG2-CD1 4.03Å; E10-I14 WeakPolarHBondContact O-CB 3.39Å; E10-I14 WeakPolarHBondContact O-CD1 3.17Å; E10-I14 WeakPolarHBondContact O-CG1 3.27Å; E10-I14 PolarHBondContact O-N 3.41Å; Q11-I14 PolarHBondContact O-N 2.86Å; F12-I14 PolarHBondContact O-N 3.39Å; I14-C16 VanDerWaalsContact C-N 3.28Å; I14-C16 PolarHBondContact O-N 2.76Å; I14-C17 PolarHBondContact O-N 3.17Å; I14-I18 HydrophobicContact CG2-CD1 3.63Å; I14-I18 HydrophobicContact CG2-CG1 4.26Å; I14-I18 WeakPolarHBondContact O-CB 3.37Å; I14-I18 VanDerWaalsContact O-CG1 3.31Å; I14-I18 WeakPolarHBondContact O-CG1 3.41Å; I14-I18 PolarHBondContact O-N 2.92Å; I14-L51 HydrophobicContact CD1-CD2 3.64Å; I14-L51 HydrophobicContact CG1-CD2 3.62Å |
| 15 | T | 65.5 | Low | 61 | Low | 85 Ų | 85 | 84 Ų | 84 | 52% | 0.521 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -61.1 | -41.5 | 179.5 | -54.8 | 0 | 0 | 0 | 0 | 111.2 | Q11 F12 S19 | Q11-T15 WeakPolarHBondContact O-CB 3.3Å; Q11-T15 PolarHBondContact O-N 2.8Å; Q11-T15 PolarHBondContact O-OG1 3.5Å; F12-T15 PolarHBondContact O-N 2.79Å; T15-S19 VanDerWaalsContact O-CB 3.32Å; T15-S19 WeakPolarHBondContact O-CB 3.46Å; T15-S19 PolarHBondContact O-N 3.02Å; T15-S19 PolarHBondContact O-OG 3.49Å |
| 16 | C | 64.4 | Low | 61.4 | Low | 14 Ų | 14 | 82.3 Ų | 82.3 | 10% | 0.095 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -62.2 | -46.2 | 175.7 | -175.9 | 0 | 0 | 0 | 0 | 111.7 | F12 I14 S19 Q20 C32 | F12-C16 WeakPolarHBondContact O-CB 3.36Å; F12-C16 PolarHBondContact O-N 3.32Å; I14-C16 VanDerWaalsContact C-N 3.28Å; I14-C16 PolarHBondContact O-N 2.76Å; C16-S19 WeakPolarHBondContact O-CB 3.46Å; C16-S19 PolarHBondContact O-N 3.19Å; C16-Q20 VanDerWaalsContact O-CG 3.3Å; C16-Q20 WeakPolarHBondContact O-CG 3.41Å; C16-Q20 PolarHBondContact O-N 2.81Å; C16-C32 WeakPolarHBondContact CA-SG 3.28Å; C16-C32 HydrophobicContact CB-CB 4.32Å; C16-C32 WeakPolarHBondContact CB-SG 3.46Å; C16-C32 VanDerWaalsContact SG-CA 3.57Å; C16-C32 WeakPolarHBondContact SG-CB 3.39Å; C16-C32 CovalentContact SG-SG 2.02Å; C16-C32 PolarHBondContact SG-SG 2.96Å |
| 17 | C | 67 | Low | 61.3 | Low | 6 Ų | 6 | 80.5 Ų | 80.5 | 4% | 0.041 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -66.2 | -44.8 | 177.1 | 169.2 | 0 | 0 | 0 | 0 | 113.2 | S13 I14 S19 Q20 I21 C48 | S13-C17 VanDerWaalsContact O-CB 3.29Å; S13-C17 WeakPolarHBondContact O-CB 3.46Å; S13-C17 PolarHBondContact O-N 3.07Å; I14-C17 PolarHBondContact O-N 3.17Å; C17-S19 PolarHBondContact O-N 3.38Å; C17-Q20 WeakPolarHBondContact O-CB 3.3Å; C17-Q20 PolarHBondContact O-N 3Å; C17-Q20 VanDerWaalsContact O-N 3.08Å; C17-I21 WeakPolarHBondContact O-CG1 3.41Å; C17-I21 PolarHBondContact O-N 3.31Å; C17-C48 HydrophobicContact CB-CB 3.51Å; C17-C48 WeakPolarHBondContact CB-SG 3.45Å; C17-C48 WeakPolarHBondContact SG-CB 3.27Å; C17-C48 CovalentContact SG-SG 1.97Å; C17-C48 PolarHBondContact SG-SG 3.1Å |
| 18 | I | 68.1 | Low | 61 | Low | 71 Ų | 71 | 84.3 Ų | 84.3 | 36% | 0.364 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -58.7 | -42.7 | 176.5 | -70.3 | 170.9 | 0 | 0 | 0 | 109.4 | I14 Q20 I21 I22 I52 | I14-I18 HydrophobicContact CG2-CD1 3.63Å; I14-I18 HydrophobicContact CG2-CG1 4.26Å; I14-I18 WeakPolarHBondContact O-CB 3.37Å; I14-I18 VanDerWaalsContact O-CG1 3.31Å; I14-I18 WeakPolarHBondContact O-CG1 3.41Å; I14-I18 PolarHBondContact O-N 2.92Å; I18-Q20 VanDerWaalsContact C-N 3.31Å; I18-Q20 PolarHBondContact O-N 2.86Å; I18-I21 PolarHBondContact O-N 3.36Å; I18-I22 HydrophobicContact CG2-CD1 3.5Å; I18-I22 VanDerWaalsContact CG2-CD1 3.5Å; I18-I22 HydrophobicContact CG2-CG1 4.24Å; I18-I22 VanDerWaalsContact O-CG1 3.28Å; I18-I22 WeakPolarHBondContact O-CG1 3.45Å; I18-I22 PolarHBondContact O-N 3.3Å; I18-I52 HydrophobicContact CG1-CD1 4.1Å |
| 19 | S | 64.9 | Low | 60.7 | Low | 63 Ų | 63 | 85.3 Ų | 85.3 | 44% | 0.441 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -61 | -37.9 | 176 | -61.1 | 0 | 0 | 0 | 0 | 112.6 | T15 C16 C17 N23 | T15-S19 VanDerWaalsContact O-CB 3.32Å; T15-S19 WeakPolarHBondContact O-CB 3.46Å; T15-S19 PolarHBondContact O-N 3.02Å; T15-S19 PolarHBondContact O-OG 3.49Å; C16-S19 WeakPolarHBondContact O-CB 3.46Å; C16-S19 PolarHBondContact O-N 3.19Å; C17-S19 PolarHBondContact O-N 3.38Å; S19-N23 PolarHBondContact O-N 2.81Å |
| 20 | Q | 64.2 | Low | 60.4 | Low | 16 Ų | 16 | 87.7 Ų | 87.7 | 8% | 0.075 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -69.3 | -35.9 | 175.3 | -72.4 | 170.2 | 3.3 | 0 | 0 | 113.3 | C16 C17 I18 P24 V27 Y41 L45 | C16-Q20 VanDerWaalsContact O-CG 3.3Å; C16-Q20 WeakPolarHBondContact O-CG 3.41Å; C16-Q20 PolarHBondContact O-N 2.81Å; C17-Q20 WeakPolarHBondContact O-CB 3.3Å; C17-Q20 PolarHBondContact O-N 3Å; C17-Q20 VanDerWaalsContact O-N 3.08Å; I18-Q20 VanDerWaalsContact C-N 3.31Å; I18-Q20 PolarHBondContact O-N 2.86Å; Q20-P24 VanDerWaalsContact O-CA 3.3Å; Q20-P24 WeakPolarHBondContact O-CA 3.41Å; Q20-V27 HydrophobicContact CB-CG2 4.2Å; Q20-V27 HydrophobicContact CG-CB 4.36Å; Q20-V27 HydrophobicContact CG-CG1 3.62Å; Q20-V27 HydrophobicContact CG-CG2 3.75Å; Q20-Y41 HydrophobicContact CG-CE2 4.39Å; Q20-Y41 WeakPolarHBondContact CG-OH 3.47Å; Q20-Y41 VanDerWaalsContact OE1-CE2 3.23Å; Q20-Y41 VanDerWaalsContact OE1-CZ 3.26Å; Q20-Y41 PolarHBondContact OE1-OH 3Å; Q20-Y41 VanDerWaalsContact OE1-OH 3.12Å; Q20-L45 HydrophobicContact CB-CD1 4.11Å |
| 21 | I | 65 | Low | 60.3 | Low | 86 Ų | 86 | 86.8 Ų | 86.8 | 44% | 0.441 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -71.6 | -44.3 | 177.4 | -67.1 | 167.5 | 0 | 0 | 0 | 110.8 | C17 I18 N23 I52 | C17-I21 WeakPolarHBondContact O-CG1 3.41Å; C17-I21 PolarHBondContact O-N 3.31Å; I18-I21 PolarHBondContact O-N 3.36Å; I21-N23 VanDerWaalsContact C-N 3.34Å; I21-I52 HydrophobicContact CD1-CD1 3.49Å; I21-I52 VanDerWaalsContact CD1-CD1 3.49Å |
| 22 | I | 66.8 | Low | 60 | Low | 124 Ų | 124 | 83.6 Ų | 83.6 | 64% | 0.636 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -70.2 | -35.2 | -178.1 | -65.9 | 171.2 | 0 | 0 | 0 | 110.9 | I18 | I18-I22 HydrophobicContact CG2-CD1 3.5Å; I18-I22 VanDerWaalsContact CG2-CD1 3.5Å; I18-I22 HydrophobicContact CG2-CG1 4.24Å; I18-I22 VanDerWaalsContact O-CG1 3.28Å; I18-I22 WeakPolarHBondContact O-CG1 3.45Å; I18-I22 PolarHBondContact O-N 3.3Å |
| 23 | N | 61.6 | Low | 59.6 | Low | 69 Ų | 69 | 82.1 Ų | 82.1 | 37% | 0.369 | 44% | 0.441 | S | S | . | . | trans | -139.9 | 69.1 | -172.7 | -131.5 | -37 | 0 | 0 | 0 | 111.9 | S19 I21 N25 K26 V27 | S19-N23 PolarHBondContact O-N 2.81Å; I21-N23 VanDerWaalsContact C-N 3.34Å; N23-N25 PolarHBondContact O-N 2.93Å; N23-K26 HydrophobicContact CB-CB 4.04Å; N23-K26 PolarHBondContact O-N 2.85Å; N23-V27 VanDerWaalsContact O-CG2 3.27Å; N23-V27 WeakPolarHBondContact O-CG2 3.47Å | ||
| 24 | P | 59.7 | Low | 59 | Low | 88 Ų | 88 | 87.5 Ų | 87.5 | 57% | 0.571 | 46% | 0.458 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.1 | -26.6 | -175.4 | 23.6 | -34 | 0 | 0 | 0 | 112.8 | Q20 | Q20-P24 VanDerWaalsContact O-CA 3.3Å; Q20-P24 WeakPolarHBondContact O-CA 3.41Å |
| 25 | N | 57.1 | Low | 58.2 | Low | 159 Ų | 159 | 92.5 Ų | 92.5 | 85% | 0.85 | 49% | 0.493 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.7 | -5.9 | -179.6 | -71.3 | -29.9 | 0 | 0 | 0 | 114.5 | N23 | N23-N25 PolarHBondContact O-N 2.93Š|
| 26 | K | 55.3 | Low | 57.7 | Low | 157 Ų | 157 | 93.2 Ų | 93.2 | 68% | 0.683 | 49% | 0.489 | S | S | * | . | trans | -106.8 | 9.4 | 177.5 | -81.7 | -165.8 | 178.8 | -178.3 | 0 | 113.8 | N23 N28 | N23-K26 HydrophobicContact CB-CB 4.04Å; N23-K26 PolarHBondContact O-N 2.85Å; K26-N28 PolarHBondContact O-N 3.47Å | ||
| 27 | V | 53.7 | Low | 57.4 | Low | 26 Ų | 26 | 97.8 Ų | 97.8 | 16% | 0.158 | 51% | 0.512 | C | S | . | . | trans | -78 | 48.3 | 179.7 | -158.3 | 0 | 0 | 0 | 0 | 111.6 | Q20 N23 L33 | Q20-V27 HydrophobicContact CB-CG2 4.2Å; Q20-V27 HydrophobicContact CG-CB 4.36Å; Q20-V27 HydrophobicContact CG-CG1 3.62Å; Q20-V27 HydrophobicContact CG-CG2 3.75Å; N23-V27 VanDerWaalsContact O-CG2 3.27Å; N23-V27 WeakPolarHBondContact O-CG2 3.47Å; V27-L33 HydrophobicContact CG1-CD1 4.09Å | ||
| 28 | N | 50.9 | Low | 57.1 | Low | 157 Ų | 157 | 102.9 Ų | 102.9 | 84% | 0.84 | 54% | 0.543 | S | S | * | . | trans | -99.3 | 14.3 | 159.7 | -96.4 | 5.8 | 0 | 0 | 0 | 111.3 | K26 F30 | K26-N28 PolarHBondContact O-N 3.47Å; N28-F30 PolarHBondContact O-N 3.16Å | ||
| 29 | H | 48.8 | Very low | 56.8 | Low | 141 Ų | 141 | 107 Ų | 107 | 65% | 0.653 | 56% | 0.558 | S | S | * | * | trans | -77.8 | 97.5 | 172.1 | -136 | -89 | 0 | 0 | 0 | 109.4 | S31 C32 | H29-S31 PolarHBondContact ND1-OG 2.89Å; H29-S31 PolarHBondContact O-N 3.42Å; H29-C32 PolarHBondContact O-N 3.16Å | ||
| 30 | F | 50 | Low | 56.8 | Low | 199 Ų | 199 | 107.1 Ų | 107.1 | 87% | 0.873 | 55% | 0.554 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -40.4 | 0.7 | 177.6 | -127.9 | -100.4 | 0 | 0 | 0 | 117.6 | N28 | N28-F30 PolarHBondContact O-N 3.16Š|
| 31 | S | 53.3 | Low | 56.6 | Low | 72 Ų | 72 | 109.4 Ų | 109.4 | 50% | 0.503 | 56% | 0.562 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -97.5 | -25.7 | -176.5 | -40.4 | 0 | 0 | 0 | 0 | 113 | F12 H29 | F12-S31 WeakPolarHBondContact CZ-O 3.47Å; H29-S31 PolarHBondContact ND1-OG 2.89Å; H29-S31 PolarHBondContact O-N 3.42Å |
| 32 | C | 53.7 | Low | 56.7 | Low | 41 Ų | 41 | 108.7 Ų | 108.7 | 28% | 0.277 | 56% | 0.562 | S | S | . | * | S | Bend | trans | -87.7 | -24.8 | -177.6 | -95.1 | 0 | 0 | 0 | 0 | 114.3 | C16 H29 | C16-C32 WeakPolarHBondContact CA-SG 3.28Å; C16-C32 HydrophobicContact CB-CB 4.32Å; C16-C32 WeakPolarHBondContact CB-SG 3.46Å; C16-C32 VanDerWaalsContact SG-CA 3.57Å; C16-C32 WeakPolarHBondContact SG-CB 3.39Å; C16-C32 CovalentContact SG-SG 2.02Å; C16-C32 PolarHBondContact SG-SG 2.96Å; H29-C32 PolarHBondContact O-N 3.16Å |
| 33 | L | 52.1 | Low | 56.7 | Low | 73 Ų | 73 | 107.7 Ų | 107.7 | 38% | 0.382 | 56% | 0.557 | S | S | . | * | trans | -120.4 | 83.7 | -171.2 | -73.7 | 154.6 | 0 | 0 | 0 | 108.2 | V27 Y41 | V27-L33 HydrophobicContact CG1-CD1 4.09Å; L33-Y41 HydrophobicContact CD2-CD2 3.79Å; L33-Y41 HydrophobicContact CD2-CE2 4.13Å | ||
| 34 | K | 51.3 | Low | 56.9 | Low | 159 Ų | 159 | 108.7 Ų | 108.7 | 69% | 0.691 | 56% | 0.558 | S | S | * | * | S | Bend | trans | -57.7 | 149.1 | 139.8 | -84.6 | -173 | 177.8 | -176.3 | 0 | 106.4 | F36 | K34-F36 HydrophobicContact CB-CD2 3.71Å; K34-F36 HydrophobicContact CB-CE2 3.7Å; K34-F36 WeakPolarHBondContact O-CD2 3.39Å; K34-F36 PolarHBondContact O-N 3.39Å |
| 35 | P | 49.7 | Very low | 57.3 | Low | 137 Ų | 137 | 107.2 Ų | 107.2 | 89% | 0.89 | 55% | 0.545 | S | S | * | . | S | Bend | trans | -62.5 | 82.3 | -176.1 | 27.1 | -34.9 | 0 | 0 | 0 | 109.7 | ||
| 36 | F | 54.3 | Low | 57.9 | Low | 100 Ų | 100 | 105.5 Ų | 105.5 | 44% | 0.439 | 53% | 0.532 | S | S | . | . | trans | -104.4 | 119.8 | 179.3 | -88.2 | -72.7 | 0 | 0 | 0 | 105.3 | K34 V38 L40 | K34-F36 HydrophobicContact CB-CD2 3.71Å; K34-F36 HydrophobicContact CB-CE2 3.7Å; K34-F36 WeakPolarHBondContact O-CD2 3.39Å; K34-F36 PolarHBondContact O-N 3.39Å; F36-V38 PolarHBondContact O-N 2.93Å; F36-L40 HydrophobicContact CB-CD2 4.35Å; F36-L40 HydrophobicContact CD1-CD2 3.29Å; F36-L40 HydrophobicContact CE1-CD2 3.8Å; F36-L40 HydrophobicContact CG-CD2 4.08Å | ||
| 37 | D | 57.6 | Low | 58.5 | Low | 109 Ų | 109 | 100.9 Ų | 100.9 | 58% | 0.583 | 52% | 0.523 | S | S | * | . | trans | -27.3 | 126.9 | 173.2 | -151.4 | -63 | 0 | 0 | 0 | 111.4 | K39 L40 Y41 | D37-K39 CarbonylContact O-C 3.59Å; D37-K39 PolarHBondContact O-N 3.19Å; D37-K39 WeakPolarHBondContact OD1-CB 3.45Å; D37-K39 PolarHBondContact OD1-N 3.36Å; D37-L40 HydrophobicContact CB-CB 4.43Å; D37-L40 WeakPolarHBondContact O-CA 3.5Å; D37-L40 WeakPolarHBondContact O-CB 3.37Å; D37-L40 PolarHBondContact O-N 2.88Å; D37-Y41 PolarHBondContact O-N 1.97Å; D37-Y41 VanDerWaalsContact O-N 3.1Å | ||
| 38 | V | 60.5 | Low | 59.2 | Low | 113 Ų | 113 | 100.3 Ų | 100.3 | 69% | 0.685 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -52.4 | -27.8 | -178.7 | 179.2 | 0 | 0 | 0 | 0 | 111.1 | F36 Y41 T42 | F36-V38 PolarHBondContact O-N 2.93Å; V38-Y41 WeakPolarHBondContact O-CB 3.28Å; V38-Y41 PolarHBondContact O-N 3.32Å; V38-T42 WeakPolarHBondContact O-CG2 3.36Å; V38-T42 PolarHBondContact O-N 3.39Å; V38-T42 VanDerWaalsContact O-N 3.08Å; V38-T42 PolarHBondContact O-OG1 3.08Å |
| 39 | K | 63.3 | Low | 60.1 | Low | 157 Ų | 157 | 99 Ų | 99 | 68% | 0.683 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -64.5 | -42.4 | 171.8 | -66.7 | -179.2 | 178 | 177 | 0 | 113.1 | D37 Y41 T42 L43 | D37-K39 CarbonylContact O-C 3.59Å; D37-K39 PolarHBondContact O-N 3.19Å; D37-K39 WeakPolarHBondContact OD1-CB 3.45Å; D37-K39 PolarHBondContact OD1-N 3.36Å; K39-Y41 VanDerWaalsContact C-N 3.34Å; K39-T42 PolarHBondContact O-OG1 3.35Å; K39-L43 WeakPolarHBondContact O-CG 3.42Å; K39-L43 PolarHBondContact O-N 2.81Å; K39-L43 VanDerWaalsContact O-N 3.16Å |
| 40 | L | 63.3 | Low | 61.4 | Low | 67 Ų | 67 | 99.8 Ų | 99.8 | 35% | 0.351 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -70.4 | -34.8 | 176.9 | -160.3 | 75.7 | 0 | 0 | 0 | 111.4 | F36 D37 L43 K44 | F36-L40 HydrophobicContact CB-CD2 4.35Å; F36-L40 HydrophobicContact CD1-CD2 3.29Å; F36-L40 HydrophobicContact CE1-CD2 3.8Å; F36-L40 HydrophobicContact CG-CD2 4.08Å; D37-L40 HydrophobicContact CB-CB 4.43Å; D37-L40 WeakPolarHBondContact O-CA 3.5Å; D37-L40 WeakPolarHBondContact O-CB 3.37Å; D37-L40 PolarHBondContact O-N 2.88Å; L40-L43 PolarHBondContact O-N 3.18Å; L40-K44 WeakPolarHBondContact O-CB 2.83Å; L40-K44 WeakPolarHBondContact O-CG 2.77Å; L40-K44 PolarHBondContact O-N 2.86Å |
| 41 | Y | 61.5 | Low | 62.4 | Low | 64 Ų | 64 | 93.8 Ų | 93.8 | 25% | 0.251 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -59.1 | -50.9 | 173.9 | 177.6 | -89.2 | 0 | 0 | 0 | 111.9 | Q20 L33 D37 V38 K39 L43 K44 L45 | Q20-Y41 HydrophobicContact CG-CE2 4.39Å; Q20-Y41 WeakPolarHBondContact CG-OH 3.47Å; Q20-Y41 VanDerWaalsContact OE1-CE2 3.23Å; Q20-Y41 VanDerWaalsContact OE1-CZ 3.26Å; Q20-Y41 PolarHBondContact OE1-OH 3Å; Q20-Y41 VanDerWaalsContact OE1-OH 3.12Å; L33-Y41 HydrophobicContact CD2-CD2 3.79Å; L33-Y41 HydrophobicContact CD2-CE2 4.13Å; D37-Y41 PolarHBondContact O-N 1.97Å; D37-Y41 VanDerWaalsContact O-N 3.1Å; V38-Y41 WeakPolarHBondContact O-CB 3.28Å; V38-Y41 PolarHBondContact O-N 3.32Å; K39-Y41 VanDerWaalsContact C-N 3.34Å; Y41-L43 VanDerWaalsContact C-N 3.33Å; Y41-L43 PolarHBondContact O-N 3.38Å; Y41-K44 PolarHBondContact O-N 3.01Å; Y41-L45 HydrophobicContact CE1-CD1 4.26Å; Y41-L45 WeakPolarHBondContact O-CB 3.29Å; Y41-L45 PolarHBondContact O-N 3.39Å |
| 42 | T | 65.6 | Low | 63.2 | Low | 71 Ų | 71 | 92.4 Ų | 92.4 | 44% | 0.436 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -62.9 | -39.8 | -180 | 49.2 | 0 | 0 | 0 | 0 | 112 | V38 K39 L45 Q46 | V38-T42 WeakPolarHBondContact O-CG2 3.36Å; V38-T42 PolarHBondContact O-N 3.39Å; V38-T42 VanDerWaalsContact O-N 3.08Å; V38-T42 PolarHBondContact O-OG1 3.08Å; K39-T42 PolarHBondContact O-OG1 3.35Å; T42-L45 PolarHBondContact O-N 2.94Å; T42-Q46 WeakPolarHBondContact O-CG 3.3Å; T42-Q46 PolarHBondContact O-N 3.21Å |
| 43 | L | 67.9 | Low | 64.1 | Low | 103 Ų | 103 | 94.6 Ų | 94.6 | 54% | 0.539 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -61.4 | -44.4 | 172.7 | -74.9 | 168.3 | 0 | 0 | 0 | 112.4 | K39 L40 Y41 Q46 A47 | K39-L43 WeakPolarHBondContact O-CG 3.42Å; K39-L43 PolarHBondContact O-N 2.81Å; K39-L43 VanDerWaalsContact O-N 3.16Å; L40-L43 PolarHBondContact O-N 3.18Å; Y41-L43 VanDerWaalsContact C-N 3.33Å; Y41-L43 PolarHBondContact O-N 3.38Å; L43-Q46 PolarHBondContact O-N 3.06Å; L43-A47 WeakPolarHBondContact O-CB 3.18Å; L43-A47 PolarHBondContact O-N 3.08Å |
| 44 | K | 65.3 | Low | 65 | Low | 90 Ų | 90 | 93.7 Ų | 93.7 | 39% | 0.391 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -64.8 | -40.1 | 176.9 | -76.3 | -177 | 178.1 | -171.6 | 0 | 112.1 | L40 Y41 A47 C48 | L40-K44 WeakPolarHBondContact O-CB 2.83Å; L40-K44 WeakPolarHBondContact O-CG 2.77Å; L40-K44 PolarHBondContact O-N 2.86Å; Y41-K44 PolarHBondContact O-N 3.01Å; K44-A47 PolarHBondContact O-N 3.44Å; K44-C48 WeakPolarHBondContact O-CB 3.31Å; K44-C48 PolarHBondContact O-N 3.04Å |
| 45 | L | 68 | Low | 65.9 | Low | 56 Ų | 56 | 89.1 Ų | 89.1 | 29% | 0.293 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -64.4 | -42.7 | 176.6 | -164.5 | 108 | 0 | 0 | 0 | 111.2 | Q20 Y41 T42 C48 K49 | Q20-L45 HydrophobicContact CB-CD1 4.11Å; Y41-L45 HydrophobicContact CE1-CD1 4.26Å; Y41-L45 WeakPolarHBondContact O-CB 3.29Å; Y41-L45 PolarHBondContact O-N 3.39Å; T42-L45 PolarHBondContact O-N 2.94Å; L45-C48 PolarHBondContact O-N 2.97Å; L45-K49 WeakPolarHBondContact O-CB 3.34Å; L45-K49 PolarHBondContact O-N 2.93Å |
| 46 | Q | 69.7 | Low | 66.8 | Low | 124 Ų | 124 | 87 Ų | 87 | 58% | 0.579 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -62.3 | -43.5 | 173.8 | -76.6 | -176.1 | -15.1 | 0 | 0 | 112.1 | T42 L43 C48 K49 K50 | T42-Q46 WeakPolarHBondContact O-CG 3.3Å; T42-Q46 PolarHBondContact O-N 3.21Å; L43-Q46 PolarHBondContact O-N 3.06Å; Q46-C48 VanDerWaalsContact C-N 3.34Å; Q46-K49 PolarHBondContact O-N 3.39Å; Q46-K50 WeakPolarHBondContact O-CG 3.49Å; Q46-K50 PolarHBondContact O-N 2.95Å |
| 47 | A | 67.8 | Low | 67.4 | Low | 60 Ų | 60 | 85 Ų | 85 | 50% | 0.496 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -62.1 | -42.7 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | L43 K44 K50 L51 | L43-A47 WeakPolarHBondContact O-CB 3.18Å; L43-A47 PolarHBondContact O-N 3.08Å; K44-A47 PolarHBondContact O-N 3.44Å; A47-K50 WeakPolarHBondContact O-CB 3.41Å; A47-K50 PolarHBondContact O-N 2.73Å; A47-L51 PolarHBondContact O-N 3.23Å |
| 48 | C | 68.6 | Low | 67.7 | Low | 13 Ų | 13 | 86.4 Ų | 86.4 | 9% | 0.088 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -67.9 | -40.2 | 176.6 | 172.7 | 0 | 0 | 0 | 0 | 112.9 | C17 K44 L45 Q46 K50 L51 I52 | C17-C48 HydrophobicContact CB-CB 3.51Å; C17-C48 WeakPolarHBondContact CB-SG 3.45Å; C17-C48 WeakPolarHBondContact SG-CB 3.27Å; C17-C48 CovalentContact SG-SG 1.97Å; C17-C48 PolarHBondContact SG-SG 3.1Å; K44-C48 WeakPolarHBondContact O-CB 3.31Å; K44-C48 PolarHBondContact O-N 3.04Å; L45-C48 PolarHBondContact O-N 2.97Å; Q46-C48 VanDerWaalsContact C-N 3.34Å; C48-K50 VanDerWaalsContact C-N 3.26Å; C48-K50 PolarHBondContact O-N 3.18Å; C48-L51 CarbonylContact O-C 3.55Å; C48-L51 WeakPolarHBondContact O-CA 3.47Å; C48-L51 WeakPolarHBondContact O-CB 3.47Å; C48-L51 PolarHBondContact O-N 2.83Å; C48-I52 WeakPolarHBondContact O-CG1 3.48Å; C48-I52 PolarHBondContact O-N 3.42Å |
| 49 | K | 69.3 | Low | 67.6 | Low | 129 Ų | 129 | 88.7 Ų | 88.7 | 56% | 0.561 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -59.7 | -39.4 | 173.2 | -171.8 | 173.8 | -178.4 | 176.3 | 0 | 111.2 | L45 Q46 N53 | L45-K49 WeakPolarHBondContact O-CB 3.34Å; L45-K49 PolarHBondContact O-N 2.93Å; Q46-K49 PolarHBondContact O-N 3.39Å; K49-N53 WeakPolarHBondContact O-CB 3.33Å; K49-N53 VanDerWaalsContact O-CG 3.24Å; K49-N53 PolarHBondContact O-N 2.95Å; K49-N53 PolarHBondContact O-OD1 3.43Å |
| 50 | K | 75.8 | Confident | 67.2 | Low | 158 Ų | 158 | 89.6 Ų | 89.6 | 69% | 0.687 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -62.6 | -41.4 | 171.5 | -74.2 | -178.7 | 178.2 | -177.4 | 0 | 112 | Q46 A47 C48 N53 S54 | Q46-K50 WeakPolarHBondContact O-CG 3.49Å; Q46-K50 PolarHBondContact O-N 2.95Å; A47-K50 WeakPolarHBondContact O-CB 3.41Å; A47-K50 PolarHBondContact O-N 2.73Å; C48-K50 VanDerWaalsContact C-N 3.26Å; C48-K50 PolarHBondContact O-N 3.18Å; K50-N53 PolarHBondContact O-N 2.95Å; K50-S54 VanDerWaalsContact O-CB 3.3Å; K50-S54 WeakPolarHBondContact O-CB 3.4Å; K50-S54 PolarHBondContact O-N 3.11Å |
| 51 | L | 71.2 | Confident | 66.7 | Low | 73 Ų | 73 | 91.1 Ų | 91.1 | 38% | 0.382 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -65.2 | -45.6 | 177.9 | -170.1 | 75.5 | 0 | 0 | 0 | 111.7 | I14 A47 C48 S54 I55 | I14-L51 HydrophobicContact CD1-CD2 3.64Å; I14-L51 HydrophobicContact CG1-CD2 3.62Å; A47-L51 PolarHBondContact O-N 3.23Å; C48-L51 CarbonylContact O-C 3.55Å; C48-L51 WeakPolarHBondContact O-CA 3.47Å; C48-L51 WeakPolarHBondContact O-CB 3.47Å; C48-L51 PolarHBondContact O-N 2.83Å; L51-S54 WeakPolarHBondContact O-CB 3.45Å; L51-S54 PolarHBondContact O-N 2.85Å; L51-I55 HydrophobicContact CD2-CD1 4.32Å; L51-I55 HydrophobicContact CG-CD1 3.96Å; L51-I55 WeakPolarHBondContact O-CB 3.47Å; L51-I55 VanDerWaalsContact O-CG1 3.28Å; L51-I55 WeakPolarHBondContact O-CG1 3.45Å; L51-I55 PolarHBondContact O-N 3.12Å |
| 52 | I | 70.8 | Confident | 65.9 | Low | 44 Ų | 44 | 94.2 Ų | 94.2 | 23% | 0.226 | 46% | 0.459 | C | S | . | . | H | α-helix | trans | -61.3 | -47.6 | 176 | -67.9 | 170 | 0 | 0 | 0 | 110 | I18 I21 C48 S54 I55 E56 | I18-I52 HydrophobicContact CG1-CD1 4.1Å; I21-I52 HydrophobicContact CD1-CD1 3.49Å; I21-I52 VanDerWaalsContact CD1-CD1 3.49Å; C48-I52 WeakPolarHBondContact O-CG1 3.48Å; C48-I52 PolarHBondContact O-N 3.42Å; I52-S54 VanDerWaalsContact C-N 3.26Å; I52-S54 PolarHBondContact O-N 3.2Å; I52-I55 CarbonylContact O-C 3.55Å; I52-I55 PolarHBondContact O-N 2.02Å; I52-E56 HydrophobicContact CG2-CG 4.39Å; I52-E56 WeakPolarHBondContact O-CB 3.4Å; I52-E56 PolarHBondContact O-N 3.03Å |
| 53 | N | 72 | Confident | 65.3 | Low | 86 Ų | 86 | 96.5 Ų | 96.5 | 46% | 0.46 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -59.4 | -38.3 | 175.6 | -75.4 | -1.6 | 0 | 0 | 0 | 112.1 | K49 K50 S57 | K49-N53 WeakPolarHBondContact O-CB 3.33Å; K49-N53 VanDerWaalsContact O-CG 3.24Å; K49-N53 PolarHBondContact O-N 2.95Å; K49-N53 PolarHBondContact O-OD1 3.43Å; K50-N53 PolarHBondContact O-N 2.95Å; N53-S57 VanDerWaalsContact O-CB 3.28Å; N53-S57 WeakPolarHBondContact O-CB 3.3Å; N53-S57 PolarHBondContact O-N 2.86Å |
| 54 | S | 71.9 | Confident | 64.3 | Low | 54 Ų | 54 | 98.3 Ų | 98.3 | 38% | 0.378 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -65.8 | -47.7 | 175.9 | -170.2 | 0 | 0 | 0 | 0 | 110.6 | K50 L51 I52 S57 F58 | K50-S54 VanDerWaalsContact O-CB 3.3Å; K50-S54 WeakPolarHBondContact O-CB 3.4Å; K50-S54 PolarHBondContact O-N 3.11Å; L51-S54 WeakPolarHBondContact O-CB 3.45Å; L51-S54 PolarHBondContact O-N 2.85Å; I52-S54 VanDerWaalsContact C-N 3.26Å; I52-S54 PolarHBondContact O-N 3.2Å; S54-S57 CarbonylContact O-C 3.6Å; S54-S57 WeakPolarHBondContact O-CB 2.85Å; S54-S57 PolarHBondContact O-N 3.39Å; S54-S57 VanDerWaalsContact O-N 3.16Å; S54-F58 WeakPolarHBondContact O-CD2 3.36Å; S54-F58 PolarHBondContact O-N 3.48Å |
| 55 | I | 70 | Confident | 62.8 | Low | 63 Ų | 63 | 99 Ų | 99 | 32% | 0.323 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.5 | -49 | 176.2 | -70.6 | 168.1 | 0 | 0 | 0 | 110.2 | L51 I52 S57 F58 W59 | L51-I55 HydrophobicContact CD2-CD1 4.32Å; L51-I55 HydrophobicContact CG-CD1 3.96Å; L51-I55 WeakPolarHBondContact O-CB 3.47Å; L51-I55 VanDerWaalsContact O-CG1 3.28Å; L51-I55 WeakPolarHBondContact O-CG1 3.45Å; L51-I55 PolarHBondContact O-N 3.12Å; I52-I55 CarbonylContact O-C 3.55Å; I52-I55 PolarHBondContact O-N 2.02Å; I55-S57 VanDerWaalsContact C-N 3.3Å; I55-S57 PolarHBondContact O-N 2.91Å; I55-F58 CarbonylContact O-C 3.57Å; I55-F58 WeakPolarHBondContact O-CA 3.49Å; I55-F58 WeakPolarHBondContact O-CB 3.11Å; I55-F58 PolarHBondContact O-N 3.49Å; I55-W59 VanDerWaalsContact CG2-NE1 3.34Å; I55-W59 PolarHBondContact O-N 3.43Å |
| 56 | E | 68.8 | Low | 61.6 | Low | 92 Ų | 92 | 105.5 Ų | 105.5 | 43% | 0.43 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -58.5 | -41.3 | 174.6 | -77.8 | -161.3 | 89 | 0 | 0 | 112 | I52 F58 W59 R60 | I52-E56 HydrophobicContact CG2-CG 4.39Å; I52-E56 WeakPolarHBondContact O-CB 3.4Å; I52-E56 PolarHBondContact O-N 3.03Å; E56-F58 VanDerWaalsContact C-N 3.34Å; E56-W59 PolarHBondContact O-N 3.39Å; E56-R60 WeakPolarHBondContact O-CB 2.94Å; E56-R60 VanDerWaalsContact O-CG 3.3Å; E56-R60 WeakPolarHBondContact O-CG 3.37Å; E56-R60 PolarHBondContact O-N 2.95Å |
| 57 | S | 65.7 | Low | 61.2 | Low | 60 Ų | 60 | 104.6 Ų | 104.6 | 42% | 0.42 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.9 | -41.8 | 173.7 | -168.6 | 0 | 0 | 0 | 0 | 111.1 | N53 S54 I55 R60 I61 | N53-S57 VanDerWaalsContact O-CB 3.28Å; N53-S57 WeakPolarHBondContact O-CB 3.3Å; N53-S57 PolarHBondContact O-N 2.86Å; S54-S57 CarbonylContact O-C 3.6Å; S54-S57 WeakPolarHBondContact O-CB 2.85Å; S54-S57 PolarHBondContact O-N 3.39Å; S54-S57 VanDerWaalsContact O-N 3.16Å; I55-S57 VanDerWaalsContact C-N 3.3Å; I55-S57 PolarHBondContact O-N 2.91Å; S57-R60 PolarHBondContact O-N 2.74Å; S57-I61 WeakPolarHBondContact O-CB 3.32Å; S57-I61 WeakPolarHBondContact O-CD1 3.41Å; S57-I61 WeakPolarHBondContact O-CG1 3.42Å; S57-I61 PolarHBondContact O-N 3.39Å |
| 58 | F | 64.1 | Low | 60.8 | Low | 137 Ų | 137 | 106.9 Ų | 106.9 | 60% | 0.601 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -63.1 | -41.8 | 174.8 | -88 | -74.9 | 0 | 0 | 0 | 111.9 | S54 I55 E56 I61 K62 | S54-F58 WeakPolarHBondContact O-CD2 3.36Å; S54-F58 PolarHBondContact O-N 3.48Å; I55-F58 CarbonylContact O-C 3.57Å; I55-F58 WeakPolarHBondContact O-CA 3.49Å; I55-F58 WeakPolarHBondContact O-CB 3.11Å; I55-F58 PolarHBondContact O-N 3.49Å; E56-F58 VanDerWaalsContact C-N 3.34Å; F58-I61 PolarHBondContact O-N 2.6Å; F58-K62 WeakPolarHBondContact O-CB 3.34Å; F58-K62 PolarHBondContact O-N 2.94Å |
| 59 | W | 59.6 | Low | 60.4 | Low | 162 Ų | 162 | 112.2 Ų | 112.2 | 61% | 0.614 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -67.9 | -41.1 | 175.8 | -74 | 105.5 | 0 | 0 | 0 | 111.9 | I55 E56 K62 I63 | I55-W59 VanDerWaalsContact CG2-NE1 3.34Å; I55-W59 PolarHBondContact O-N 3.43Å; E56-W59 PolarHBondContact O-N 3.39Å; W59-K62 PolarHBondContact O-N 3.05Å; W59-I63 VanDerWaalsContact O-CG1 3.27Å; W59-I63 WeakPolarHBondContact O-CG1 3.41Å; W59-I63 PolarHBondContact O-N 2.95Å |
| 60 | R | 53.8 | Low | 59.9 | Low | 176 Ų | 176 | 111.2 Ų | 111.2 | 66% | 0.664 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -63.3 | -42.4 | 174.1 | -75.3 | 179.5 | -170.7 | -125 | 3.4 | 112 | E56 S57 K62 I63 N64 | E56-R60 WeakPolarHBondContact O-CB 2.94Å; E56-R60 VanDerWaalsContact O-CG 3.3Å; E56-R60 WeakPolarHBondContact O-CG 3.37Å; E56-R60 PolarHBondContact O-N 2.95Å; S57-R60 PolarHBondContact O-N 2.74Å; R60-K62 VanDerWaalsContact C-N 3.3Å; R60-K62 PolarHBondContact O-N 2.8Å; R60-I63 PolarHBondContact O-N 2.78Å; R60-N64 PolarHBondContact O-N 3.03Å |
| 61 | I | 52.6 | Low | 58.9 | Low | 98 Ų | 98 | 108.3 Ų | 108.3 | 50% | 0.503 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -61.7 | -42.3 | 174.9 | -70 | 162.4 | 0 | 0 | 0 | 110 | S57 F58 I63 N64 | S57-I61 WeakPolarHBondContact O-CB 3.32Å; S57-I61 WeakPolarHBondContact O-CD1 3.41Å; S57-I61 WeakPolarHBondContact O-CG1 3.42Å; S57-I61 PolarHBondContact O-N 3.39Å; F58-I61 PolarHBondContact O-N 2.6Å; I61-I63 PolarHBondContact O-N 2.85Å; I61-N64 PolarHBondContact O-N 2.69Å |
| 62 | K | 46.5 | Very low | 58.1 | Low | 130 Ų | 130 | 110.6 Ų | 110.6 | 57% | 0.565 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -70.4 | -29.5 | -179.2 | -148.2 | 179 | -175.2 | -173 | 0 | 113.2 | F58 W59 R60 N64 C65 | F58-K62 WeakPolarHBondContact O-CB 3.34Å; F58-K62 PolarHBondContact O-N 2.94Å; W59-K62 PolarHBondContact O-N 3.05Å; R60-K62 VanDerWaalsContact C-N 3.3Å; R60-K62 PolarHBondContact O-N 2.8Å; K62-N64 VanDerWaalsContact C-N 3.3Å; K62-C65 PolarHBondContact O-N 3.46Å |
| 63 | I | 51.8 | Low | 57.2 | Low | 119 Ų | 119 | 115.4 Ų | 115.4 | 61% | 0.61 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -73.1 | -23.1 | 174.1 | -69.3 | 164.6 | 0 | 0 | 0 | 111.7 | W59 R60 I61 T66 | W59-I63 VanDerWaalsContact O-CG1 3.27Å; W59-I63 WeakPolarHBondContact O-CG1 3.41Å; W59-I63 PolarHBondContact O-N 2.95Å; R60-I63 PolarHBondContact O-N 2.78Å; I61-I63 PolarHBondContact O-N 2.85Å; I63-T66 PolarHBondContact O-OG1 3.27Å |
| 64 | N | 46.5 | Very low | 56 | Low | 140 Ų | 140 | 117.6 Ų | 117.6 | 75% | 0.749 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.2 | 9.9 | 173.8 | -91.6 | 10.6 | 0 | 0 | 0 | 114.3 | R60 I61 K62 | R60-N64 PolarHBondContact O-N 3.03Å; I61-N64 PolarHBondContact O-N 2.69Å; K62-N64 VanDerWaalsContact C-N 3.3Å |
| 65 | C | 35.1 | Very low | 54.7 | Low | 106 Ų | 106 | 122.9 Ų | 122.9 | 72% | 0.716 | 61% | 0.614 | S | S | * | * | trans | -104.2 | 39.1 | 172 | -68.2 | 0 | 0 | 0 | 0 | 112.7 | K62 | K62-C65 PolarHBondContact O-N 3.46Š| ||
| 66 | T | 41.9 | Very low | 53.3 | Low | 192 Ų | 192 | 128.4 Ų | 128.4 | 100% | 1.178 | 64% | 0.641 | S | S | * | * | trans | -95.7 | 0 | 156.9 | 2.3 | 0 | 0 | 0 | 0 | 108.4 | I63 | I63-T66 PolarHBondContact O-OG1 3.27Š|
Retrieved 66 of 66 residues in 15.6 ms
(Link to these results)