| 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 | 50.2 | Low | 73.6 | Confident | 163 Ų | 163 | 86.4 Ų | 86.4 | 80% | 0.803 | 42% | 0.424 | S | S | * | . | 0 | 116 | 0 | -63.6 | -55.3 | -134.7 | 0 | 0 | 106.5 | Q6 | M1-Q6 HydrophobicContact CB-CG 4Š| |||
| 2 | D | 77 | Confident | 73.8 | Confident | 69 Ų | 69 | 81 Ų | 81 | 37% | 0.369 | 40% | 0.404 | S | S | . | . | trans | -63.8 | 145.4 | 175.9 | 171.4 | 53 | 0 | 0 | 0 | 110.2 | C4 Q5 Q6 | D2-C4 PolarHBondContact O-N 2.7Å; D2-C4 WeakPolarHBondContact OD2-CA 3.48Å; D2-C4 WeakPolarHBondContact OD2-CB 2.97Å; D2-C4 PolarHBondContact OD2-N 2.87Å; D2-Q5 PolarHBondContact O-N 3.41Å; D2-Q6 PolarHBondContact O-N 3.38Å | ||
| 3 | L | 75.3 | Confident | 74.2 | Confident | 109 Ų | 109 | 83.3 Ų | 83.3 | 57% | 0.571 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -61 | -30.5 | -174.9 | -172.8 | 73.5 | 0 | 0 | 0 | 111.4 | K7 | L3-K7 WeakPolarHBondContact O-CG 3.45Å; L3-K7 PolarHBondContact O-N 3.34Å |
| 4 | C | 73.7 | Confident | 74.4 | Confident | 32 Ų | 32 | 88.8 Ų | 88.8 | 22% | 0.216 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -65.7 | -50 | 176.6 | -166.4 | 0 | 0 | 0 | 0 | 110.5 | D2 Q6 K7 V8 | D2-C4 PolarHBondContact O-N 2.7Å; D2-C4 WeakPolarHBondContact OD2-CA 3.48Å; D2-C4 WeakPolarHBondContact OD2-CB 2.97Å; D2-C4 PolarHBondContact OD2-N 2.87Å; C4-Q6 VanDerWaalsContact C-N 3.31Å; C4-Q6 PolarHBondContact O-N 2.79Å; C4-K7 PolarHBondContact O-N 3.14Å; C4-K7 VanDerWaalsContact O-N 3.09Å; C4-V8 WeakPolarHBondContact O-CG2 3.4Å; C4-V8 PolarHBondContact O-N 3.46Å |
| 5 | Q | 74 | Confident | 74.6 | Confident | 64 Ų | 64 | 85.3 Ų | 85.3 | 30% | 0.299 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -56.8 | -45 | 178.9 | -174 | -178.6 | -17.6 | 0 | 0 | 111.4 | D2 K7 V8 E9 | D2-Q5 PolarHBondContact O-N 3.41Å; Q5-K7 VanDerWaalsContact C-N 3.35Å; Q5-K7 PolarHBondContact O-N 3.13Å; Q5-V8 PolarHBondContact O-N 2.91Å; Q5-E9 HydrophobicContact CG-CG 4.49Å; Q5-E9 PolarHBondContact NE2-OE1 3.45Å; Q5-E9 WeakPolarHBondContact O-CB 3.3Å; Q5-E9 WeakPolarHBondContact O-CG 3.44Å; Q5-E9 PolarHBondContact O-N 2.92Å |
| 6 | Q | 75.3 | Confident | 74.9 | Confident | 86 Ų | 86 | 84.1 Ų | 84.1 | 40% | 0.402 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -62.1 | -40.2 | 177.6 | -70.9 | -173.5 | -8.7 | 0 | 0 | 112.8 | M1 D2 C4 Q10 | M1-Q6 HydrophobicContact CB-CG 4Å; D2-Q6 PolarHBondContact O-N 3.38Å; C4-Q6 VanDerWaalsContact C-N 3.31Å; C4-Q6 PolarHBondContact O-N 2.79Å; Q6-Q10 WeakPolarHBondContact O-CB 3.46Å; Q6-Q10 VanDerWaalsContact O-CG 3.26Å; Q6-Q10 WeakPolarHBondContact O-CG 3.36Å; Q6-Q10 PolarHBondContact O-N 2.9Å |
| 7 | K | 76.2 | Confident | 75 | Confident | 120 Ų | 120 | 87.5 Ų | 87.5 | 52% | 0.522 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -68.1 | -40.5 | 177.9 | -76 | -179.2 | 179.3 | 178 | 0 | 111.9 | L3 C4 Q5 Q10 E11 | L3-K7 WeakPolarHBondContact O-CG 3.45Å; L3-K7 PolarHBondContact O-N 3.34Å; C4-K7 PolarHBondContact O-N 3.14Å; C4-K7 VanDerWaalsContact O-N 3.09Å; Q5-K7 VanDerWaalsContact C-N 3.35Å; Q5-K7 PolarHBondContact O-N 3.13Å; K7-Q10 PolarHBondContact O-N 3.32Å; K7-E11 WeakPolarHBondContact O-CB 3.13Å; K7-E11 PolarHBondContact O-N 2.93Å |
| 8 | V | 75.8 | Confident | 75.2 | Confident | 37 Ų | 37 | 89.9 Ų | 89.9 | 22% | 0.224 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -64.3 | -44.6 | 176.1 | 172 | 0 | 0 | 0 | 0 | 110.7 | C4 Q5 Q10 E11 A12 L52 C57 | C4-V8 WeakPolarHBondContact O-CG2 3.4Å; C4-V8 PolarHBondContact O-N 3.46Å; Q5-V8 PolarHBondContact O-N 2.91Å; V8-Q10 PolarHBondContact O-N 3.41Å; V8-E11 PolarHBondContact O-N 3.4Å; V8-A12 VanDerWaalsContact O-CB 3.24Å; V8-A12 WeakPolarHBondContact O-CB 3.3Å; V8-A12 PolarHBondContact O-N 3.31Å; V8-L52 HydrophobicContact CG1-CD2 3.99Å; V8-C57 VanDerWaalsContact CG2-SG 3.55Å |
| 9 | E | 75.5 | Confident | 75.2 | Confident | 64 Ų | 64 | 87.7 Ų | 87.7 | 30% | 0.299 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -61.1 | -42.2 | 174.7 | -74.8 | 174.6 | -171.8 | 0 | 0 | 112.1 | Q5 A12 Q13 | Q5-E9 HydrophobicContact CG-CG 4.49Å; Q5-E9 PolarHBondContact NE2-OE1 3.45Å; Q5-E9 WeakPolarHBondContact O-CB 3.3Å; Q5-E9 WeakPolarHBondContact O-CG 3.44Å; Q5-E9 PolarHBondContact O-N 2.92Å; E9-A12 PolarHBondContact O-N 3.01Å; E9-Q13 WeakPolarHBondContact O-CB 3.37Å; E9-Q13 VanDerWaalsContact O-CG 3.23Å; E9-Q13 WeakPolarHBondContact O-CG 3.46Å; E9-Q13 PolarHBondContact O-N 2.79Å |
| 10 | Q | 78.2 | Confident | 75.2 | Confident | 104 Ų | 104 | 84 Ų | 84 | 49% | 0.486 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -63 | -44 | 176.1 | -77.4 | 178.4 | 13.1 | 0 | 0 | 112.3 | Q6 K7 V8 Q13 R14 | Q6-Q10 WeakPolarHBondContact O-CB 3.46Å; Q6-Q10 VanDerWaalsContact O-CG 3.26Å; Q6-Q10 WeakPolarHBondContact O-CG 3.36Å; Q6-Q10 PolarHBondContact O-N 2.9Å; K7-Q10 PolarHBondContact O-N 3.32Å; V8-Q10 PolarHBondContact O-N 3.41Å; Q10-Q13 PolarHBondContact O-N 3.22Å; Q10-R14 WeakPolarHBondContact O-CG 3.33Å; Q10-R14 PolarHBondContact O-N 2.92Å |
| 11 | E | 78.1 | Confident | 75.4 | Confident | 102 Ų | 102 | 87.4 Ų | 87.4 | 48% | 0.477 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -69.8 | -40.5 | 179.5 | -166 | 61.4 | -162.9 | 0 | 0 | 111.3 | K7 V8 Q13 R14 C15 | K7-E11 WeakPolarHBondContact O-CB 3.13Å; K7-E11 PolarHBondContact O-N 2.93Å; V8-E11 PolarHBondContact O-N 3.4Å; E11-Q13 VanDerWaalsContact C-N 3.33Å; E11-Q13 PolarHBondContact O-N 3.19Å; E11-R14 WeakPolarHBondContact O-CB 3.39Å; E11-R14 PolarHBondContact O-N 3.25Å; E11-R14 VanDerWaalsContact O-N 3.11Å; E11-R14 WeakPolarHBondContact OE2-CD 3.31Å; E11-R14 IonicContact OE2-NH1 3.71Å; E11-C15 PolarHBondContact O-N 3.19Å; E11-C15 PolarHBondContact O-SG 3.27Å |
| 12 | A | 76.8 | Confident | 76.5 | Confident | 22 Ų | 22 | 83.5 Ų | 83.5 | 18% | 0.182 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -56.5 | -46.4 | 171.9 | 0 | 0 | 0 | 0 | 0 | 112 | V8 E9 R14 C15 F16 L52 | V8-A12 VanDerWaalsContact O-CB 3.24Å; V8-A12 WeakPolarHBondContact O-CB 3.3Å; V8-A12 PolarHBondContact O-N 3.31Å; E9-A12 PolarHBondContact O-N 3.01Å; A12-R14 VanDerWaalsContact C-N 3.32Å; A12-R14 PolarHBondContact O-N 3.32Å; A12-C15 PolarHBondContact O-N 2.87Å; A12-F16 WeakPolarHBondContact O-CB 3.41Å; A12-F16 PolarHBondContact O-N 3.27Å; A12-L52 HydrophobicContact CB-CD1 3.58Å; A12-L52 HydrophobicContact CB-CD2 3.76Å; A12-L52 HydrophobicContact CB-CG 4.27Å |
| 13 | Q | 78.3 | Confident | 76.3 | Confident | 111 Ų | 111 | 81.8 Ų | 81.8 | 52% | 0.519 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -62.9 | -37.3 | 176.2 | -75.3 | 176.9 | 14.8 | 0 | 0 | 112.3 | E9 Q10 E11 K17 | E9-Q13 WeakPolarHBondContact O-CB 3.37Å; E9-Q13 VanDerWaalsContact O-CG 3.23Å; E9-Q13 WeakPolarHBondContact O-CG 3.46Å; E9-Q13 PolarHBondContact O-N 2.79Å; Q10-Q13 PolarHBondContact O-N 3.22Å; E11-Q13 VanDerWaalsContact C-N 3.33Å; E11-Q13 PolarHBondContact O-N 3.19Å; Q13-K17 WeakPolarHBondContact O-CB 3.46Å; Q13-K17 VanDerWaalsContact O-CG 3.29Å; Q13-K17 WeakPolarHBondContact O-CG 3.41Å; Q13-K17 PolarHBondContact O-N 3.09Å |
| 14 | R | 77.9 | Confident | 76.3 | Confident | 160 Ų | 160 | 83.7 Ų | 83.7 | 60% | 0.604 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -64.8 | -49.8 | 175.3 | -74.4 | 171.5 | 179.8 | -166.6 | 0.4 | 111.2 | Q10 E11 A12 F16 K17 Q18 | Q10-R14 WeakPolarHBondContact O-CG 3.33Å; Q10-R14 PolarHBondContact O-N 2.92Å; E11-R14 WeakPolarHBondContact O-CB 3.39Å; E11-R14 PolarHBondContact O-N 3.25Å; E11-R14 VanDerWaalsContact O-N 3.11Å; E11-R14 WeakPolarHBondContact OE2-CD 3.31Å; E11-R14 IonicContact OE2-NH1 3.71Å; A12-R14 VanDerWaalsContact C-N 3.32Å; A12-R14 PolarHBondContact O-N 3.32Å; R14-F16 PolarHBondContact O-N 3.32Å; R14-K17 PolarHBondContact O-N 3.25Å; R14-Q18 PolarHBondContact O-N 2.88Å |
| 15 | C | 76.3 | Confident | 76.4 | Confident | 36 Ų | 36 | 89.3 Ų | 89.3 | 24% | 0.243 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -58.2 | -47.1 | 176.9 | -69.3 | 0 | 0 | 0 | 0 | 111.3 | E11 A12 K17 Q18 S19 | E11-C15 PolarHBondContact O-N 3.19Å; E11-C15 PolarHBondContact O-SG 3.27Å; A12-C15 PolarHBondContact O-N 2.87Å; C15-K17 PolarHBondContact O-N 3.49Å; C15-Q18 PolarHBondContact O-N 2.91Å; C15-S19 PolarHBondContact O-N 2.87Å; C15-S19 PolarHBondContact O-OG 3.42Å |
| 16 | F | 79.3 | Confident | 76.4 | Confident | 66 Ų | 66 | 90.6 Ų | 90.6 | 29% | 0.289 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -59.6 | -47.2 | 178.5 | -177.7 | -103.8 | 0 | 0 | 0 | 112.4 | A12 R14 Q18 S19 A20 I41 L44 A45 L48 | A12-F16 WeakPolarHBondContact O-CB 3.41Å; A12-F16 PolarHBondContact O-N 3.27Å; R14-F16 PolarHBondContact O-N 3.32Å; F16-Q18 VanDerWaalsContact C-N 3.3Å; F16-Q18 PolarHBondContact O-N 2.89Å; F16-S19 PolarHBondContact O-N 2.92Å; F16-A20 VanDerWaalsContact O-CB 3.28Å; F16-A20 WeakPolarHBondContact O-CB 3.23Å; F16-A20 PolarHBondContact O-N 3.03Å; F16-I41 HydrophobicContact CE2-CG2 4.07Å; F16-I41 HydrophobicContact CZ-CG2 3.62Å; F16-L44 HydrophobicContact CD2-CD2 4.49Å; F16-A45 HydrophobicContact CD2-CB 4.22Å; F16-A45 HydrophobicContact CE2-CB 3.42Å; F16-A45 VanDerWaalsContact CE2-CB 3.42Å; F16-A45 HydrophobicContact CZ-CB 3.91Å; F16-L48 HydrophobicContact CB-CD1 4.47Å; F16-L48 HydrophobicContact CD2-CD1 4.08Å |
| 17 | K | 77.8 | Confident | 76.1 | Confident | 143 Ų | 143 | 86.9 Ų | 86.9 | 62% | 0.622 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -59.8 | -40.5 | 177.1 | -77.1 | 172.3 | -179.8 | 173.9 | 0 | 112.2 | Q13 R14 C15 R21 | Q13-K17 WeakPolarHBondContact O-CB 3.46Å; Q13-K17 VanDerWaalsContact O-CG 3.29Å; Q13-K17 WeakPolarHBondContact O-CG 3.41Å; Q13-K17 PolarHBondContact O-N 3.09Å; R14-K17 PolarHBondContact O-N 3.25Å; C15-K17 PolarHBondContact O-N 3.49Å; K17-R21 WeakPolarHBondContact O-CB 3.24Å; K17-R21 PolarHBondContact O-N 3.19Å |
| 18 | Q | 78.6 | Confident | 76 | Confident | 130 Ų | 130 | 87.2 Ų | 87.2 | 61% | 0.607 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -69 | -46.3 | 178.3 | -176.1 | 172.9 | -17.6 | 0 | 0 | 111.9 | R14 C15 F16 R21 I22 | R14-Q18 PolarHBondContact O-N 2.88Å; C15-Q18 PolarHBondContact O-N 2.91Å; F16-Q18 VanDerWaalsContact C-N 3.3Å; F16-Q18 PolarHBondContact O-N 2.89Å; Q18-R21 WeakPolarHBondContact O-CB 3.49Å; Q18-R21 PolarHBondContact O-N 3.46Å; Q18-I22 HydrophobicContact CG-CD1 4.06Å; Q18-I22 WeakPolarHBondContact O-CG1 3.43Å; Q18-I22 PolarHBondContact O-N 3.5Å |
| 19 | S | 75 | Confident | 76 | Confident | 48 Ų | 48 | 89.3 Ų | 89.3 | 34% | 0.336 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -62.4 | -43.7 | 177.2 | -62.9 | 0 | 0 | 0 | 0 | 111.8 | C15 F16 R21 I22 G23 L44 | C15-S19 PolarHBondContact O-N 2.87Å; C15-S19 PolarHBondContact O-OG 3.42Å; F16-S19 PolarHBondContact O-N 2.92Å; S19-R21 VanDerWaalsContact C-N 3.29Å; S19-R21 PolarHBondContact O-N 2.95Å; S19-I22 PolarHBondContact O-N 2.93Å; S19-G23 PolarHBondContact O-N 2.94Å; S19-L44 VanDerWaalsContact CB-CD2 3.45Å |
| 20 | A | 75.6 | Confident | 76.1 | Confident | 13 Ų | 13 | 91.9 Ų | 91.9 | 11% | 0.107 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -61 | -38.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | F16 R24 I41 | F16-A20 VanDerWaalsContact O-CB 3.28Å; F16-A20 WeakPolarHBondContact O-CB 3.23Å; F16-A20 PolarHBondContact O-N 3.03Å; A20-R24 WeakPolarHBondContact O-CB 3.31Å; A20-R24 VanDerWaalsContact O-CG 3.29Å; A20-R24 WeakPolarHBondContact O-CG 3.4Å; A20-R24 PolarHBondContact O-N 3.24Å; A20-I41 HydrophobicContact CB-CD1 4.4Å; A20-I41 HydrophobicContact CB-CG1 4.48Å; A20-I41 HydrophobicContact CB-CG2 4.28Å |
| 21 | R | 77.6 | Confident | 76.2 | Confident | 157 Ų | 157 | 94.4 Ų | 94.4 | 59% | 0.592 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -65.9 | -44.1 | 176 | -175 | -178.3 | -178.1 | -176.6 | 3 | 112.2 | K17 Q18 S19 R25 | K17-R21 WeakPolarHBondContact O-CB 3.24Å; K17-R21 PolarHBondContact O-N 3.19Å; Q18-R21 WeakPolarHBondContact O-CB 3.49Å; Q18-R21 PolarHBondContact O-N 3.46Å; S19-R21 VanDerWaalsContact C-N 3.29Å; S19-R21 PolarHBondContact O-N 2.95Å; R21-R25 WeakPolarHBondContact O-CG 3.26Å; R21-R25 PolarHBondContact O-N 3.37Å; R21-R25 VanDerWaalsContact O-N 3.12Å |
| 22 | I | 75 | Confident | 75.8 | Confident | 80 Ų | 80 | 92 Ų | 92 | 41% | 0.41 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -66.8 | -46.3 | 177.7 | -66.4 | 169.3 | 0 | 0 | 0 | 110.1 | Q18 S19 R24 R25 N26 | Q18-I22 HydrophobicContact CG-CD1 4.06Å; Q18-I22 WeakPolarHBondContact O-CG1 3.43Å; Q18-I22 PolarHBondContact O-N 3.5Å; S19-I22 PolarHBondContact O-N 2.93Å; I22-R24 VanDerWaalsContact C-N 3.34Å; I22-R24 PolarHBondContact O-N 2.81Å; I22-R25 WeakPolarHBondContact O-CB 3.43Å; I22-R25 PolarHBondContact O-N 2.83Å; I22-R25 VanDerWaalsContact O-N 3.1Å; I22-N26 PolarHBondContact O-N 3.31Å |
| 23 | G | 72.4 | Confident | 75.9 | Confident | 34 Ų | 34 | 94.1 Ų | 94.1 | 35% | 0.351 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -56.1 | -46.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | S19 R25 N26 A27 | S19-G23 PolarHBondContact O-N 2.94Å; G23-R25 PolarHBondContact O-N 3.43Å; G23-N26 PolarHBondContact O-N 3.3Å; G23-A27 VanDerWaalsContact O-CB 3.28Å; G23-A27 WeakPolarHBondContact O-CB 3.26Å; G23-A27 PolarHBondContact O-N 3.36Å |
| 24 | R | 74.2 | Confident | 75.7 | Confident | 148 Ų | 148 | 95 Ų | 95 | 56% | 0.558 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -60.5 | -44.1 | 173.9 | -74.8 | 179.1 | -173.3 | -172.4 | 1.6 | 112.8 | A20 I22 A27 I28 I41 | A20-R24 WeakPolarHBondContact O-CB 3.31Å; A20-R24 VanDerWaalsContact O-CG 3.29Å; A20-R24 WeakPolarHBondContact O-CG 3.4Å; A20-R24 PolarHBondContact O-N 3.24Å; I22-R24 VanDerWaalsContact C-N 3.34Å; I22-R24 PolarHBondContact O-N 2.81Å; R24-A27 PolarHBondContact O-N 3.43Å; R24-I28 VanDerWaalsContact O-CG1 3.3Å; R24-I28 WeakPolarHBondContact O-CG1 3.45Å; R24-I28 PolarHBondContact O-N 3.3Å; R24-I41 HydrophobicContact CG-CD1 4.02Å |
| 25 | R | 76.3 | Confident | 75.2 | Confident | 151 Ų | 151 | 95 Ų | 95 | 57% | 0.57 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -60.7 | -46.2 | 177.7 | -79.7 | 179.6 | 172.9 | -178.2 | -5.5 | 111.9 | R21 I22 G23 A27 I28 A29 | R21-R25 WeakPolarHBondContact O-CG 3.26Å; R21-R25 PolarHBondContact O-N 3.37Å; R21-R25 VanDerWaalsContact O-N 3.12Å; I22-R25 WeakPolarHBondContact O-CB 3.43Å; I22-R25 PolarHBondContact O-N 2.83Å; I22-R25 VanDerWaalsContact O-N 3.1Å; G23-R25 PolarHBondContact O-N 3.43Å; R25-A27 VanDerWaalsContact C-N 3.33Å; R25-I28 PolarHBondContact O-N 3.15Å; R25-A29 WeakPolarHBondContact O-CB 3.36Å; R25-A29 PolarHBondContact O-N 3.1Å |
| 26 | N | 73.4 | Confident | 74.8 | Confident | 90 Ų | 90 | 96.6 Ų | 96.6 | 48% | 0.481 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -65.4 | -39.8 | 179.2 | -70 | -4.8 | 0 | 0 | 0 | 111.4 | I22 G23 A29 N30 | I22-N26 PolarHBondContact O-N 3.31Å; G23-N26 PolarHBondContact O-N 3.3Å; N26-A29 PolarHBondContact O-N 3.48Å; N26-N30 VanDerWaalsContact O-CB 3.3Å; N26-N30 WeakPolarHBondContact O-CB 3.38Å; N26-N30 PolarHBondContact O-N 3.43Å; N26-N30 PolarHBondContact O-ND2 3.23Å |
| 27 | A | 69.5 | Low | 74.2 | Confident | 9 Ų | 9 | 95 Ų | 95 | 7% | 0.074 | 48% | 0.48 | C | S | . | . | H | α-helix | trans | -67 | -39.2 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | G23 R24 R25 N30 D31 V32 Q37 | G23-A27 VanDerWaalsContact O-CB 3.28Å; G23-A27 WeakPolarHBondContact O-CB 3.26Å; G23-A27 PolarHBondContact O-N 3.36Å; R24-A27 PolarHBondContact O-N 3.43Å; R25-A27 VanDerWaalsContact C-N 3.33Å; A27-N30 CarbonylContact O-C 3.55Å; A27-N30 PolarHBondContact O-N 2.91Å; A27-D31 PolarHBondContact O-N 3.36Å; A27-V32 HydrophobicContact CB-CB 3.93Å; A27-V32 HydrophobicContact CB-CG1 4.41Å; A27-V32 PolarHBondContact O-N 3.17Å; A27-Q37 HydrophobicContact CB-CG 3.29Å |
| 28 | I | 74.4 | Confident | 73.7 | Confident | 126 Ų | 126 | 91.9 Ų | 91.9 | 65% | 0.646 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -63.1 | -44 | 171.9 | -66.5 | 164.5 | 0 | 0 | 0 | 110.3 | R24 R25 N30 D31 | R24-I28 VanDerWaalsContact O-CG1 3.3Å; R24-I28 WeakPolarHBondContact O-CG1 3.45Å; R24-I28 PolarHBondContact O-N 3.3Å; R25-I28 PolarHBondContact O-N 3.15Å; I28-N30 PolarHBondContact O-N 3.07Å; I28-D31 PolarHBondContact O-N 2.97Å |
| 29 | A | 76.1 | Confident | 73.2 | Confident | 82 Ų | 82 | 89.8 Ų | 89.8 | 68% | 0.678 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -63.8 | -30.5 | 178.7 | 0 | 0 | 0 | 0 | 0 | 113 | R25 N26 | R25-A29 WeakPolarHBondContact O-CB 3.36Å; R25-A29 PolarHBondContact O-N 3.1Å; N26-A29 PolarHBondContact O-N 3.48Å |
| 30 | N | 76.8 | Confident | 73 | Confident | 118 Ų | 118 | 91 Ų | 91 | 63% | 0.631 | 47% | 0.474 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -99.2 | 9 | -178.2 | -65.1 | -25.4 | 0 | 0 | 0 | 113.5 | N26 A27 I28 V32 | N26-N30 VanDerWaalsContact O-CB 3.3Å; N26-N30 WeakPolarHBondContact O-CB 3.38Å; N26-N30 PolarHBondContact O-N 3.43Å; N26-N30 PolarHBondContact O-ND2 3.23Å; A27-N30 CarbonylContact O-C 3.55Å; A27-N30 PolarHBondContact O-N 2.91Å; I28-N30 PolarHBondContact O-N 3.07Å; N30-V32 HydrophobicContact CB-CG2 3.84Å; N30-V32 PolarHBondContact O-N 3.41Å |
| 31 | D | 79.8 | Confident | 72.7 | Confident | 156 Ų | 156 | 91.9 Ų | 91.9 | 83% | 0.834 | 48% | 0.476 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.9 | 39.9 | -176.9 | -154.3 | 20.2 | 0 | 0 | 0 | 114 | A27 I28 | A27-D31 PolarHBondContact O-N 3.36Å; I28-D31 PolarHBondContact O-N 2.97Å |
| 32 | V | 71.3 | Confident | 72.2 | Confident | 53 Ų | 53 | 88.2 Ų | 88.2 | 32% | 0.321 | 47% | 0.471 | S | S | . | . | trans | -80 | 132.3 | 179.7 | 174.2 | 0 | 0 | 0 | 0 | 109.4 | A27 N30 D36 Q37 | A27-V32 HydrophobicContact CB-CB 3.93Å; A27-V32 HydrophobicContact CB-CG1 4.41Å; A27-V32 PolarHBondContact O-N 3.17Å; N30-V32 HydrophobicContact CB-CG2 3.84Å; N30-V32 PolarHBondContact O-N 3.41Å; V32-D36 HydrophobicContact CG1-CB 3.5Å; V32-Q37 HydrophobicContact CG1-CG 4.25Å; V32-Q37 PolarHBondContact O-NE2 3.11Å | ||
| 33 | S | 78.3 | Confident | 71.9 | Confident | 66 Ų | 66 | 88.5 Ų | 88.5 | 46% | 0.462 | 47% | 0.473 | S | S | . | . | trans | -51.1 | 141.4 | 177.3 | 176.5 | 0 | 0 | 0 | 0 | 112.3 | Y35 D36 Q37 | S33-Y35 PolarHBondContact O-N 2.95Å; S33-Y35 VanDerWaalsContact O-N 3.1Å; S33-Y35 PolarHBondContact OG-N 2.89Å; S33-D36 PolarHBondContact O-N 3.04Å; S33-Q37 WeakPolarHBondContact O-CG 3.29Å; S33-Q37 PolarHBondContact O-N 3.4Å | ||
| 34 | I | 73.6 | Confident | 71.7 | Confident | 128 Ų | 128 | 89.7 Ų | 89.7 | 66% | 0.656 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -55 | -31.4 | 176.6 | -63.1 | 173.1 | 0 | 0 | 0 | 111.5 | Q37 T38 | I34-Q37 WeakPolarHBondContact O-CB 3.43Å; I34-Q37 PolarHBondContact O-N 3.42Å; I34-T38 PolarHBondContact O-N 3.01Å; I34-T38 PolarHBondContact O-OG1 3.17Å |
| 35 | Y | 67.4 | Low | 71.3 | Confident | 161 Ų | 161 | 84.1 Ų | 84.1 | 63% | 0.631 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -62.3 | -50.8 | 175.5 | -175.3 | -95.3 | 0 | 0 | 0 | 111.4 | S33 Q37 T38 M39 | S33-Y35 PolarHBondContact O-N 2.95Å; S33-Y35 VanDerWaalsContact O-N 3.1Å; S33-Y35 PolarHBondContact OG-N 2.89Å; Y35-Q37 VanDerWaalsContact C-N 3.28Å; Y35-Q37 PolarHBondContact O-N 3.46Å; Y35-T38 PolarHBondContact O-N 3.37Å; Y35-M39 HydrophobicContact CE1-CE 4.13Å; Y35-M39 HydrophobicContact CE1-SD 4.29Å; Y35-M39 PolarHBondContact O-N 2.89Å |
| 36 | D | 69.4 | Low | 70.9 | Confident | 70 Ų | 70 | 81.1 Ų | 81.1 | 37% | 0.374 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -65.5 | -33.3 | 179.4 | -63.3 | -29.9 | 0 | 0 | 0 | 111.9 | V32 S33 S40 | V32-D36 HydrophobicContact CG1-CB 3.5Å; S33-D36 PolarHBondContact O-N 3.04Å; D36-S40 WeakPolarHBondContact O-CB 3.33Å; D36-S40 PolarHBondContact O-N 3.18Å; D36-S40 PolarHBondContact O-OG 3.43Å |
| 37 | Q | 64.7 | Low | 70.5 | Confident | 31 Ų | 31 | 81.8 Ų | 81.8 | 15% | 0.145 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -60.8 | -49.3 | 172.3 | -67.1 | -175.3 | 24.9 | 0 | 0 | 112.1 | A27 V32 S33 I34 Y35 M39 S40 I41 | A27-Q37 HydrophobicContact CB-CG 3.29Å; V32-Q37 HydrophobicContact CG1-CG 4.25Å; V32-Q37 PolarHBondContact O-NE2 3.11Å; S33-Q37 WeakPolarHBondContact O-CG 3.29Å; S33-Q37 PolarHBondContact O-N 3.4Å; I34-Q37 WeakPolarHBondContact O-CB 3.43Å; I34-Q37 PolarHBondContact O-N 3.42Å; Y35-Q37 VanDerWaalsContact C-N 3.28Å; Y35-Q37 PolarHBondContact O-N 3.46Å; Q37-M39 VanDerWaalsContact C-N 3.35Å; Q37-S40 PolarHBondContact O-N 3.37Å; Q37-I41 VanDerWaalsContact O-CG1 3.29Å; Q37-I41 WeakPolarHBondContact O-CG1 3.42Å; Q37-I41 PolarHBondContact O-N 3.44Å; Q37-I41 VanDerWaalsContact O-N 3.07Å |
| 38 | T | 67.5 | Low | 70.2 | Confident | 79 Ų | 79 | 83.3 Ų | 83.3 | 49% | 0.485 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -66.1 | -42.4 | -177.1 | -54.6 | 0 | 0 | 0 | 0 | 110.1 | I34 Y35 I41 T42 | I34-T38 PolarHBondContact O-N 3.01Å; I34-T38 PolarHBondContact O-OG1 3.17Å; Y35-T38 PolarHBondContact O-N 3.37Å; T38-I41 PolarHBondContact O-N 3.3Å; T38-T42 PolarHBondContact O-N 2.77Å; T38-T42 PolarHBondContact O-OG1 2.96Å; T38-T42 VanDerWaalsContact O-OG1 3.07Å |
| 39 | M | 69.6 | Low | 69.6 | Low | 85 Ų | 85 | 83.7 Ų | 83.7 | 42% | 0.419 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -63.1 | -44.5 | 177 | -170.6 | 158.5 | 64 | 0 | 0 | 112.1 | Y35 Q37 I41 T42 I43 | Y35-M39 HydrophobicContact CE1-CE 4.13Å; Y35-M39 HydrophobicContact CE1-SD 4.29Å; Y35-M39 PolarHBondContact O-N 2.89Å; Q37-M39 VanDerWaalsContact C-N 3.35Å; M39-I41 VanDerWaalsContact C-N 3.33Å; M39-I41 PolarHBondContact O-N 3.01Å; M39-T42 PolarHBondContact O-N 2.98Å; M39-I43 HydrophobicContact CG-CD1 3.97Å; M39-I43 VanDerWaalsContact O-CG1 3.31Å; M39-I43 WeakPolarHBondContact O-CG1 3.45Å; M39-I43 PolarHBondContact O-N 3.05Å |
| 40 | S | 70.3 | Confident | 68.9 | Low | 75 Ų | 75 | 84 Ų | 84 | 52% | 0.524 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -61.2 | -40.8 | 177.1 | -59.6 | 0 | 0 | 0 | 0 | 112.4 | D36 Q37 L44 | D36-S40 WeakPolarHBondContact O-CB 3.33Å; D36-S40 PolarHBondContact O-N 3.18Å; D36-S40 PolarHBondContact O-OG 3.43Å; Q37-S40 PolarHBondContact O-N 3.37Å; S40-L44 WeakPolarHBondContact O-CB 3.35Å; S40-L44 PolarHBondContact O-N 3.04Å; S40-L44 VanDerWaalsContact O-N 3.1Å |
| 41 | I | 68.6 | Low | 68 | Low | 30 Ų | 30 | 84.1 Ų | 84.1 | 15% | 0.154 | 46% | 0.461 | C | S | . | . | H | α-helix | trans | -66.8 | -41.8 | 176.7 | -67.9 | 167.4 | 0 | 0 | 0 | 110.9 | F16 A20 R24 Q37 T38 M39 L44 A45 | F16-I41 HydrophobicContact CE2-CG2 4.07Å; F16-I41 HydrophobicContact CZ-CG2 3.62Å; A20-I41 HydrophobicContact CB-CD1 4.4Å; A20-I41 HydrophobicContact CB-CG1 4.48Å; A20-I41 HydrophobicContact CB-CG2 4.28Å; R24-I41 HydrophobicContact CG-CD1 4.02Å; Q37-I41 VanDerWaalsContact O-CG1 3.29Å; Q37-I41 WeakPolarHBondContact O-CG1 3.42Å; Q37-I41 PolarHBondContact O-N 3.44Å; Q37-I41 VanDerWaalsContact O-N 3.07Å; T38-I41 PolarHBondContact O-N 3.3Å; M39-I41 VanDerWaalsContact C-N 3.33Å; M39-I41 PolarHBondContact O-N 3.01Å; I41-L44 PolarHBondContact O-N 2.85Å; I41-A45 PolarHBondContact O-N 2.89Å |
| 42 | T | 67.4 | Low | 66.8 | Low | 80 Ų | 80 | 78.8 Ų | 78.8 | 49% | 0.491 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -65.3 | -43.3 | 178.4 | -62.2 | 0 | 0 | 0 | 0 | 111.7 | T38 M39 L44 A45 V46 | T38-T42 PolarHBondContact O-N 2.77Å; T38-T42 PolarHBondContact O-OG1 2.96Å; T38-T42 VanDerWaalsContact O-OG1 3.07Å; M39-T42 PolarHBondContact O-N 2.98Å; T42-L44 VanDerWaalsContact C-N 3.35Å; T42-L44 PolarHBondContact O-N 3.35Å; T42-A45 WeakPolarHBondContact O-CB 3.29Å; T42-A45 PolarHBondContact O-N 3.37Å; T42-V46 WeakPolarHBondContact O-CG2 3.28Å; T42-V46 PolarHBondContact O-N 3.23Å |
| 43 | I | 69.3 | Low | 66 | Low | 87 Ų | 87 | 79.8 Ų | 79.8 | 45% | 0.446 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -59.5 | -48 | 176 | -67.9 | 165.5 | 0 | 0 | 0 | 109.9 | M39 A45 V46 E47 | M39-I43 HydrophobicContact CG-CD1 3.97Å; M39-I43 VanDerWaalsContact O-CG1 3.31Å; M39-I43 WeakPolarHBondContact O-CG1 3.45Å; M39-I43 PolarHBondContact O-N 3.05Å; I43-A45 VanDerWaalsContact C-N 3.27Å; I43-A45 PolarHBondContact O-N 3.07Å; I43-V46 PolarHBondContact O-N 3.47Å; I43-V46 VanDerWaalsContact O-N 3.15Å; I43-E47 HydrophobicContact CG2-CG 4.29Å; I43-E47 WeakPolarHBondContact O-CG 3.36Å; I43-E47 PolarHBondContact O-N 3.46Å |
| 44 | L | 68 | Low | 64.6 | Low | 59 Ų | 59 | 81.4 Ų | 81.4 | 31% | 0.309 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -60.5 | -36.2 | 177.3 | -165.1 | 107.1 | 0 | 0 | 0 | 112.4 | F16 S19 S40 I41 T42 L48 | F16-L44 HydrophobicContact CD2-CD2 4.49Å; S19-L44 VanDerWaalsContact CB-CD2 3.45Å; S40-L44 WeakPolarHBondContact O-CB 3.35Å; S40-L44 PolarHBondContact O-N 3.04Å; S40-L44 VanDerWaalsContact O-N 3.1Å; I41-L44 PolarHBondContact O-N 2.85Å; T42-L44 VanDerWaalsContact C-N 3.35Å; T42-L44 PolarHBondContact O-N 3.35Å; L44-L48 HydrophobicContact CD2-CD1 3.81Å; L44-L48 HydrophobicContact CG-CD1 4.18Å; L44-L48 VanDerWaalsContact O-CB 3.3Å; L44-L48 WeakPolarHBondContact O-CB 3.42Å; L44-L48 VanDerWaalsContact O-CG 3.26Å; L44-L48 WeakPolarHBondContact O-CG 3.47Å; L44-L48 PolarHBondContact O-N 3.34Å |
| 45 | A | 65.8 | Low | 63.4 | Low | 30 Ų | 30 | 82.2 Ų | 82.2 | 25% | 0.248 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -62.8 | -46.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | F16 I41 T42 I43 L48 Q49 | F16-A45 HydrophobicContact CD2-CB 4.22Å; F16-A45 HydrophobicContact CE2-CB 3.42Å; F16-A45 VanDerWaalsContact CE2-CB 3.42Å; F16-A45 HydrophobicContact CZ-CB 3.91Å; I41-A45 PolarHBondContact O-N 2.89Å; T42-A45 WeakPolarHBondContact O-CB 3.29Å; T42-A45 PolarHBondContact O-N 3.37Å; I43-A45 VanDerWaalsContact C-N 3.27Å; I43-A45 PolarHBondContact O-N 3.07Å; A45-L48 PolarHBondContact O-N 2.85Å; A45-Q49 WeakPolarHBondContact O-CB 3.28Å; A45-Q49 PolarHBondContact O-N 2.91Å |
| 46 | V | 67 | Low | 62.4 | Low | 89 Ų | 89 | 77.1 Ų | 77.1 | 54% | 0.539 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -65.5 | -44.9 | 179.4 | 173.4 | 0 | 0 | 0 | 0 | 110.6 | T42 I43 L48 Q49 A50 | T42-V46 WeakPolarHBondContact O-CG2 3.28Å; T42-V46 PolarHBondContact O-N 3.23Å; I43-V46 PolarHBondContact O-N 3.47Å; I43-V46 VanDerWaalsContact O-N 3.15Å; V46-L48 PolarHBondContact O-N 3.04Å; V46-Q49 PolarHBondContact O-N 3.06Å; V46-A50 PolarHBondContact O-N 3.39Å |
| 47 | E | 66.8 | Low | 61.1 | Low | 104 Ų | 104 | 74.9 Ų | 74.9 | 49% | 0.486 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -61.3 | -43.4 | 176.1 | -72.2 | 179.9 | 170.3 | 0 | 0 | 111.7 | I43 A50 M51 | I43-E47 HydrophobicContact CG2-CG 4.29Å; I43-E47 WeakPolarHBondContact O-CG 3.36Å; I43-E47 PolarHBondContact O-N 3.46Å; E47-A50 PolarHBondContact O-N 3Å; E47-M51 HydrophobicContact CB-CE 4.06Å; E47-M51 WeakPolarHBondContact O-CB 3.44Å; E47-M51 WeakPolarHBondContact O-CE 3.47Å; E47-M51 WeakPolarHBondContact O-CG 3.48Å; E47-M51 PolarHBondContact O-N 3.38Å |
| 48 | L | 62.1 | Low | 60.1 | Low | 40 Ų | 40 | 83.4 Ų | 83.4 | 21% | 0.209 | 46% | 0.456 | C | S | . | . | H | α-helix | trans | -64.5 | -40.2 | 175.2 | -77.5 | 168.6 | 0 | 0 | 0 | 112 | F16 L44 A45 V46 A50 M51 L52 | F16-L48 HydrophobicContact CB-CD1 4.47Å; F16-L48 HydrophobicContact CD2-CD1 4.08Å; L44-L48 HydrophobicContact CD2-CD1 3.81Å; L44-L48 HydrophobicContact CG-CD1 4.18Å; L44-L48 VanDerWaalsContact O-CB 3.3Å; L44-L48 WeakPolarHBondContact O-CB 3.42Å; L44-L48 VanDerWaalsContact O-CG 3.26Å; L44-L48 WeakPolarHBondContact O-CG 3.47Å; L44-L48 PolarHBondContact O-N 3.34Å; A45-L48 PolarHBondContact O-N 2.85Å; V46-L48 PolarHBondContact O-N 3.04Å; L48-A50 VanDerWaalsContact C-N 3.27Å; L48-A50 PolarHBondContact O-N 2.93Å; L48-M51 HydrophobicContact CD2-CE 4.11Å; L48-M51 HydrophobicContact CG-CE 4.43Å; L48-M51 PolarHBondContact O-N 3.48Å; L48-L52 VanDerWaalsContact O-CG 3.31Å; L48-L52 WeakPolarHBondContact O-CG 3.43Å; L48-L52 PolarHBondContact O-N 3.1Å |
| 49 | Q | 61.3 | Low | 59.3 | Low | 134 Ų | 134 | 85.4 Ų | 85.4 | 63% | 0.626 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -64 | -34.1 | 177.3 | -170.6 | 170.2 | -1.9 | 0 | 0 | 112 | A45 V46 | A45-Q49 WeakPolarHBondContact O-CB 3.28Å; A45-Q49 PolarHBondContact O-N 2.91Å; V46-Q49 PolarHBondContact O-N 3.06Å |
| 50 | A | 61.5 | Low | 58.2 | Low | 88 Ų | 88 | 90 Ų | 90 | 73% | 0.727 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -76.9 | -29.9 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | V46 E47 L48 | V46-A50 PolarHBondContact O-N 3.39Å; E47-A50 PolarHBondContact O-N 3Å; L48-A50 VanDerWaalsContact C-N 3.27Å; L48-A50 PolarHBondContact O-N 2.93Å |
| 51 | M | 58.1 | Low | 56.9 | Low | 121 Ų | 121 | 90.5 Ų | 90.5 | 60% | 0.596 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -83.1 | -23.9 | 179.4 | -78.6 | -171.6 | -73.6 | 0 | 0 | 113.9 | E47 L48 P53 | E47-M51 HydrophobicContact CB-CE 4.06Å; E47-M51 WeakPolarHBondContact O-CB 3.44Å; E47-M51 WeakPolarHBondContact O-CE 3.47Å; E47-M51 WeakPolarHBondContact O-CG 3.48Å; E47-M51 PolarHBondContact O-N 3.38Å; L48-M51 HydrophobicContact CD2-CE 4.11Å; L48-M51 HydrophobicContact CG-CE 4.43Å; L48-M51 PolarHBondContact O-N 3.48Å; M51-P53 WeakPolarHBondContact O-CD 3.46Å; M51-P53 VanDerWaalsContact O-N 3.08Å |
| 52 | L | 55.9 | Low | 55.8 | Low | 45 Ų | 45 | 93 Ų | 93 | 24% | 0.236 | 50% | 0.502 | C | S | . | . | S | Bend | trans | -62.4 | 114 | 173.7 | -75.9 | 166.4 | 0 | 0 | 0 | 107.7 | V8 A12 L48 F54 | V8-L52 HydrophobicContact CG1-CD2 3.99Å; A12-L52 HydrophobicContact CB-CD1 3.58Å; A12-L52 HydrophobicContact CB-CD2 3.76Å; A12-L52 HydrophobicContact CB-CG 4.27Å; L48-L52 VanDerWaalsContact O-CG 3.31Å; L48-L52 WeakPolarHBondContact O-CG 3.43Å; L48-L52 PolarHBondContact O-N 3.1Å; L52-F54 HydrophobicContact CB-CD2 4.17Å; L52-F54 HydrophobicContact CB-CE2 3.81Å; L52-F54 HydrophobicContact CB-CZ 4.19Å; L52-F54 HydrophobicContact CD1-CE2 4.37Å; L52-F54 HydrophobicContact CD1-CZ 4.1Å; L52-F54 WeakPolarHBondContact O-CD2 3.29Å; L52-F54 PolarHBondContact O-N 2.81Å |
| 53 | P | 53.5 | Low | 54.7 | Low | 73 Ų | 73 | 94 Ų | 94 | 47% | 0.474 | 51% | 0.508 | S | S | . | . | trans | -77.3 | 81.8 | 177.5 | 34.1 | -32.5 | 0 | 0 | 0 | 106.5 | M51 D55 A56 C57 | M51-P53 WeakPolarHBondContact O-CD 3.46Å; M51-P53 VanDerWaalsContact O-N 3.08Å; P53-D55 PolarHBondContact O-N 2.92Å; P53-D55 VanDerWaalsContact O-N 3.14Å; P53-A56 HydrophobicContact CB-CB 3.51Å; P53-A56 HydrophobicContact CG-CB 3.63Å; P53-A56 PolarHBondContact O-N 3.26Å; P53-C57 PolarHBondContact O-N 3.12Å | ||
| 54 | F | 49.5 | Very low | 53.9 | Low | 101 Ų | 101 | 95.2 Ų | 95.2 | 44% | 0.443 | 53% | 0.525 | S | S | . | . | G | 310 helix | trans | -54.3 | -27.2 | 165.4 | -67.2 | -77.7 | 0 | 0 | 0 | 109.8 | L52 C57 | L52-F54 HydrophobicContact CB-CD2 4.17Å; L52-F54 HydrophobicContact CB-CE2 3.81Å; L52-F54 HydrophobicContact CB-CZ 4.19Å; L52-F54 HydrophobicContact CD1-CE2 4.37Å; L52-F54 HydrophobicContact CD1-CZ 4.1Å; L52-F54 WeakPolarHBondContact O-CD2 3.29Å; L52-F54 PolarHBondContact O-N 2.81Å; F54-C57 PolarHBondContact O-N 3.37Å |
| 55 | D | 47.3 | Very low | 52.8 | Low | 144 Ų | 144 | 95.2 Ų | 95.2 | 77% | 0.77 | 53% | 0.533 | S | S | * | . | G | 310 helix | trans | -71.4 | -26.3 | 170.7 | -74.2 | -31.6 | 0 | 0 | 0 | 115.2 | P53 C57 R58 | P53-D55 PolarHBondContact O-N 2.92Å; P53-D55 VanDerWaalsContact O-N 3.14Å; D55-C57 VanDerWaalsContact C-N 3.3Å; D55-R58 WeakPolarHBondContact O-CG 3.3Å; D55-R58 PolarHBondContact O-N 3.1Å |
| 56 | A | 46.4 | Very low | 51.8 | Low | 55 Ų | 55 | 98.4 Ų | 98.4 | 46% | 0.455 | 55% | 0.549 | S | S | . | . | G | 310 helix | trans | -85 | -3.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | P53 R58 | P53-A56 HydrophobicContact CB-CB 3.51Å; P53-A56 HydrophobicContact CG-CB 3.63Å; P53-A56 PolarHBondContact O-N 3.26Å; A56-R58 PolarHBondContact O-N 2.95Å |
| 57 | C | 42.9 | Very low | 50.8 | Low | 23 Ų | 23 | 102 Ų | 102 | 16% | 0.155 | 56% | 0.558 | C | S | . | * | G | 310 helix | trans | -76.6 | 8.9 | 162.2 | -91.1 | 0 | 0 | 0 | 0 | 112.7 | V8 P53 F54 D55 D59 | V8-C57 VanDerWaalsContact CG2-SG 3.55Å; P53-C57 PolarHBondContact O-N 3.12Å; F54-C57 PolarHBondContact O-N 3.37Å; D55-C57 VanDerWaalsContact C-N 3.3Å; C57-D59 PolarHBondContact O-N 3.38Å; C57-D59 VanDerWaalsContact O-N 3.13Å |
| 58 | R | 43.2 | Very low | 49.9 | Very low | 210 Ų | 210 | 108.1 Ų | 108.1 | 79% | 0.792 | 58% | 0.576 | S | S | * | * | S | Bend | trans | -58.5 | 120 | 159.7 | -78.1 | -170.1 | 128.8 | 163.3 | 0.5 | 107.8 | D55 A56 E60 | D55-R58 WeakPolarHBondContact O-CG 3.3Å; D55-R58 PolarHBondContact O-N 3.1Å; A56-R58 PolarHBondContact O-N 2.95Å; R58-E60 PolarHBondContact O-N 3.19Å |
| 59 | D | 50.2 | Low | 48.9 | Very low | 120 Ų | 120 | 110.1 Ų | 110.1 | 64% | 0.642 | 59% | 0.594 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -51.4 | 4.8 | -166.4 | -75.9 | -49.3 | 0 | 0 | 0 | 118.2 | C57 | C57-D59 PolarHBondContact O-N 3.38Å; C57-D59 VanDerWaalsContact O-N 3.13Å |
| 60 | E | 47.8 | Very low | 48 | Very low | 183 Ų | 183 | 108.2 Ų | 108.2 | 86% | 0.855 | 60% | 0.595 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.6 | -7.7 | -168.5 | -61.1 | -164.4 | 168.6 | 0 | 0 | 115.2 | R58 | R58-E60 PolarHBondContact O-N 3.19Š|
| 61 | T | 42.7 | Very low | 47.1 | Very low | 84 Ų | 84 | 112 Ų | 112 | 52% | 0.515 | 60% | 0.596 | S | S | . | * | S | Bend | trans | -113.5 | 112.7 | 174.4 | 37.9 | 0 | 0 | 0 | 0 | 112.3 | V63 | T61-V63 PolarHBondContact O-N 3.21Š|
| 62 | P | 45 | Very low | 46.1 | Very low | 82 Ų | 82 | 111.7 Ų | 111.7 | 53% | 0.532 | 60% | 0.6 | S | S | . | * | trans | -61.1 | 139.8 | 174.5 | 25.2 | -32.2 | 0 | 0 | 0 | 109.4 | S64 A65 | P62-S64 PolarHBondContact O-N 3.2Å; P62-A65 HydrophobicContact CG-CB 4.46Å; P62-A65 VanDerWaalsContact O-CB 3.3Å; P62-A65 WeakPolarHBondContact O-CB 3.3Å; P62-A65 PolarHBondContact O-N 2.93Å | ||
| 63 | V | 45.4 | Very low | 45.3 | Very low | 102 Ų | 102 | 113.7 Ų | 113.7 | 62% | 0.618 | 62% | 0.623 | S | S | * | * | G | 310 helix | trans | -53.1 | -23.9 | -178.9 | -176.9 | 0 | 0 | 0 | 0 | 112.6 | T61 A65 V66 | T61-V63 PolarHBondContact O-N 3.21Å; V63-A65 PolarHBondContact O-N 3.34Å; V63-V66 PolarHBondContact O-N 3.35Å |
| 64 | S | 51 | Low | 44.5 | Very low | 113 Ų | 113 | 116.3 Ų | 116.3 | 79% | 0.79 | 64% | 0.637 | S | S | * | * | G | 310 helix | trans | -63.9 | -22.3 | 172.7 | 55.5 | 0 | 0 | 0 | 0 | 114.5 | P62 | P62-S64 PolarHBondContact O-N 3.2Š|
| 65 | A | 45.3 | Very low | 44 | Very low | 58 Ų | 58 | 120.2 Ų | 120.2 | 48% | 0.479 | 65% | 0.654 | S | S | . | * | G | 310 helix | trans | -84.9 | -14.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | P62 V63 K67 | P62-A65 HydrophobicContact CG-CB 4.46Å; P62-A65 VanDerWaalsContact O-CB 3.3Å; P62-A65 WeakPolarHBondContact O-CB 3.3Å; P62-A65 PolarHBondContact O-N 2.93Å; V63-A65 PolarHBondContact O-N 3.34Å; A65-K67 VanDerWaalsContact C-N 3.3Å; A65-K67 PolarHBondContact O-N 2.89Å |
| 66 | V | 45.9 | Very low | 43.6 | Very low | 98 Ų | 98 | 121 Ų | 121 | 59% | 0.594 | 66% | 0.658 | S | S | * | * | S | Bend | trans | -72.9 | 89.4 | 174.2 | -173.3 | 0 | 0 | 0 | 0 | 108 | V63 R68 | V63-V66 PolarHBondContact O-N 3.35Å; V66-R68 PolarHBondContact O-N 3.29Å |
| 67 | K | 44.6 | Very low | 43.3 | Very low | 164 Ų | 164 | 132.8 Ų | 132.8 | 71% | 0.713 | 69% | 0.691 | S | S | * | * | trans | -54.2 | 129.3 | 174.1 | -74.6 | -178.4 | 177.9 | 176.3 | 0 | 108.9 | A65 S69 | A65-K67 VanDerWaalsContact C-N 3.3Å; A65-K67 PolarHBondContact O-N 2.89Å; K67-S69 WeakPolarHBondContact CB-OG 3.49Å; K67-S69 PolarHBondContact O-N 3.07Å | ||
| 68 | R | 47.7 | Very low | 43.3 | Very low | 233 Ų | 233 | 138.3 Ų | 138.3 | 88% | 0.879 | 72% | 0.718 | S | S | * | * | G | 310 helix | trans | -53.3 | -4.9 | 172.7 | -82.9 | -179 | 170.4 | 179.5 | -2.8 | 114.9 | V66 S70 F71 | V66-R68 PolarHBondContact O-N 3.29Å; R68-S70 PolarHBondContact O-N 3.33Å; R68-F71 PolarHBondContact O-N 3.47Å |
| 69 | S | 42.2 | Very low | 43.3 | Very low | 82 Ų | 82 | 134.5 Ų | 134.5 | 57% | 0.573 | 71% | 0.714 | S | S | * | * | G | 310 helix | trans | -63 | -21.7 | -178.9 | 47.5 | 0 | 0 | 0 | 0 | 114 | K67 F71 V72 | K67-S69 WeakPolarHBondContact CB-OG 3.49Å; K67-S69 PolarHBondContact O-N 3.07Å; S69-F71 PolarHBondContact O-N 3.02Å; S69-V72 PolarHBondContact O-N 3.38Å |
| 70 | S | 42.2 | Very low | 42.9 | Very low | 94 Ų | 94 | 135.3 Ų | 135.3 | 66% | 0.657 | 72% | 0.718 | S | S | * | * | G | 310 helix | trans | -71.4 | -15.5 | -179.8 | -43.2 | 0 | 0 | 0 | 0 | 114 | R68 | R68-S70 PolarHBondContact O-N 3.33Š|
| 71 | F | 41.9 | Very low | 42.6 | Very low | 168 Ų | 168 | 132.5 Ų | 132.5 | 74% | 0.737 | 71% | 0.71 | S | S | * | * | G | 310 helix | trans | -88.8 | -7.2 | 179 | -100 | -87.4 | 0 | 0 | 0 | 114.4 | R68 S69 | R68-F71 PolarHBondContact O-N 3.47Å; S69-F71 PolarHBondContact O-N 3.02Å |
| 72 | V | 37.7 | Very low | 42.6 | Very low | 114 Ų | 114 | 135.5 Ų | 135.5 | 69% | 0.691 | 72% | 0.722 | S | S | * | * | G | 310 helix | trans | -90.1 | -2.1 | -174.9 | -173.6 | 0 | 0 | 0 | 0 | 112.7 | S69 V74 | S69-V72 PolarHBondContact O-N 3.38Å; V72-V74 VanDerWaalsContact C-N 3.29Å; V72-V74 PolarHBondContact O-N 3.07Å |
| 73 | A | 38.9 | Very low | 42.5 | Very low | 86 Ų | 86 | 139.1 Ų | 139.1 | 71% | 0.711 | 73% | 0.734 | S | S | * | * | G | 310 helix | trans | -76 | -7.9 | -177.5 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 74 | V | 37.6 | Very low | 42.3 | Very low | 129 Ų | 129 | 141.7 Ų | 141.7 | 78% | 0.782 | 74% | 0.743 | S | S | * | * | G | 310 helix | trans | -112.8 | 47.8 | -178 | -159.5 | 0 | 0 | 0 | 0 | 112 | V72 | V72-V74 VanDerWaalsContact C-N 3.29Å; V72-V74 PolarHBondContact O-N 3.07Å |
| 75 | K | 38.6 | Very low | 41.6 | Very low | 182 Ų | 182 | 143.9 Ų | 143.9 | 79% | 0.791 | 74% | 0.739 | S | S | * | * | S | Bend | trans | -122 | -0.8 | 164.8 | -145.5 | -177.7 | 176.6 | -176.6 | 0 | 114.6 | ||
| 76 | N | 38.1 | Very low | 41.3 | Very low | 160 Ų | 160 | 151.1 Ų | 151.1 | 86% | 0.856 | 76% | 0.761 | S | S | * | * | trans | -128.7 | 36.2 | -178.7 | -76.8 | -4.1 | 0 | 0 | 0 | 113.8 | ||||
| 77 | R | 40.2 | Very low | 40.9 | Very low | 303 Ų | 303 | 155.9 Ų | 155.9 | 100% | 1.143 | 78% | 0.776 | S | S | * | * | trans | -135.4 | 0 | 158.7 | -89.4 | -172.1 | 176.3 | -176.8 | -1.1 | 108.3 |
Retrieved 77 of 77 residues in 38.7 ms
(Link to these results)