| 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 | 49.3 | Very low | 50.7 | Low | 221 Ų | 221 | 94.8 Ų | 94.8 | 100% | 1.089 | 59% | 0.589 | S | S | * | * | 0 | -46.8 | 0 | -66.5 | -163.7 | -79.5 | 0 | 0 | 112.7 | L3 A4 G5 | M1-L3 PolarHBondContact O-N 3.35Å; M1-A4 PolarHBondContact O-N 3.06Å; M1-G5 PolarHBondContact O-N 3.08Å; M1-G5 VanDerWaalsContact O-N 3.16Å | |||
| 2 | A | 40.2 | Very low | 51.9 | Low | 89 Ų | 89 | 93.3 Ų | 93.3 | 74% | 0.736 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -59.8 | -40.2 | -179.3 | 0 | 0 | 0 | 0 | 0 | 115.4 | A4 G5 L6 | A2-A4 VanDerWaalsContact C-N 3.32Å; A2-A4 PolarHBondContact O-N 3.09Å; A2-G5 PolarHBondContact O-N 3.47Å; A2-L6 WeakPolarHBondContact O-CB 3.05Å; A2-L6 PolarHBondContact O-N 3.46Å |
| 3 | L | 42.3 | Very low | 52.5 | Low | 139 Ų | 139 | 92.3 Ų | 92.3 | 73% | 0.728 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -66.7 | -32.9 | 178.3 | -174.6 | 63.1 | 0 | 0 | 0 | 112.9 | M1 L6 A7 | M1-L3 PolarHBondContact O-N 3.35Å; L3-L6 HydrophobicContact CD1-CD2 4.43Å; L3-A7 WeakPolarHBondContact O-CB 3.48Å; L3-A7 PolarHBondContact O-N 3.12Å |
| 4 | A | 51 | Low | 53.1 | Low | 68 Ų | 68 | 90.7 Ų | 90.7 | 56% | 0.562 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -72.3 | -41.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | M1 A2 L6 A7 M8 | M1-A4 PolarHBondContact O-N 3.06Å; A2-A4 VanDerWaalsContact C-N 3.32Å; A2-A4 PolarHBondContact O-N 3.09Å; A4-L6 VanDerWaalsContact C-N 3.33Å; A4-A7 PolarHBondContact O-N 3.21Å; A4-M8 WeakPolarHBondContact O-CB 3.36Å; A4-M8 PolarHBondContact O-N 3.09Å |
| 5 | G | 46.6 | Very low | 53.6 | Low | 47 Ų | 47 | 85.5 Ų | 85.5 | 49% | 0.485 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -65.9 | -35.1 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | M1 A2 M8 G9 | M1-G5 PolarHBondContact O-N 3.08Å; M1-G5 VanDerWaalsContact O-N 3.16Å; A2-G5 PolarHBondContact O-N 3.47Å; G5-M8 PolarHBondContact O-N 2.84Å; G5-G9 PolarHBondContact O-N 3.49Å |
| 6 | L | 43.1 | Very low | 53.9 | Low | 119 Ų | 119 | 85.3 Ų | 85.3 | 62% | 0.623 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -66.5 | -43.1 | 173 | -174.8 | 70 | 0 | 0 | 0 | 111.4 | A2 L3 A4 G9 C10 | A2-L6 WeakPolarHBondContact O-CB 3.05Å; A2-L6 PolarHBondContact O-N 3.46Å; L3-L6 HydrophobicContact CD1-CD2 4.43Å; A4-L6 VanDerWaalsContact C-N 3.33Å; L6-G9 PolarHBondContact O-N 3.01Å; L6-C10 WeakPolarHBondContact O-CB 3.32Å; L6-C10 PolarHBondContact O-N 3.27Å |
| 7 | A | 52.7 | Low | 54.1 | Low | 49 Ų | 49 | 88 Ų | 88 | 41% | 0.405 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63.8 | -42.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | L3 A4 C10 I11 | L3-A7 WeakPolarHBondContact O-CB 3.48Å; L3-A7 PolarHBondContact O-N 3.12Å; A4-A7 PolarHBondContact O-N 3.21Å; A7-C10 PolarHBondContact O-N 3.19Å; A7-I11 WeakPolarHBondContact O-CB 3.39Å; A7-I11 WeakPolarHBondContact O-CD1 3.36Å; A7-I11 WeakPolarHBondContact O-CG1 3.2Å; A7-I11 PolarHBondContact O-N 3.39Å |
| 8 | M | 60.7 | Low | 53.9 | Low | 125 Ų | 125 | 88.5 Ų | 88.5 | 62% | 0.616 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -60.2 | -48.8 | 174.9 | -171.5 | 166.6 | -175.4 | 0 | 0 | 111.8 | A4 G5 C10 I11 D12 | A4-M8 WeakPolarHBondContact O-CB 3.36Å; A4-M8 PolarHBondContact O-N 3.09Å; G5-M8 PolarHBondContact O-N 2.84Å; M8-C10 VanDerWaalsContact C-N 3.34Å; M8-C10 PolarHBondContact O-N 3.35Å; M8-I11 PolarHBondContact O-N 3.26Å; M8-D12 PolarHBondContact O-N 2.99Å |
| 9 | G | 55.2 | Low | 54 | Low | 33 Ų | 33 | 85.5 Ų | 85.5 | 34% | 0.34 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -66.2 | -32.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | G5 L6 T13 | G5-G9 PolarHBondContact O-N 3.49Å; L6-G9 PolarHBondContact O-N 3.01Å; G9-T13 WeakPolarHBondContact O-CB 2.88Å; G9-T13 PolarHBondContact O-N 3.3Å; G9-T13 PolarHBondContact O-OG1 2.96Å |
| 10 | C | 54.2 | Low | 54 | Low | 71 Ų | 71 | 86.1 Ų | 86.1 | 48% | 0.48 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -69.9 | -39.2 | 176.3 | -161.8 | 0 | 0 | 0 | 0 | 111.2 | L6 A7 M8 T13 V14 | L6-C10 WeakPolarHBondContact O-CB 3.32Å; L6-C10 PolarHBondContact O-N 3.27Å; A7-C10 PolarHBondContact O-N 3.19Å; M8-C10 VanDerWaalsContact C-N 3.34Å; M8-C10 PolarHBondContact O-N 3.35Å; C10-T13 PolarHBondContact O-N 3.25Å; C10-V14 VanDerWaalsContact O-CB 3.32Å; C10-V14 WeakPolarHBondContact O-CB 3.28Å; C10-V14 WeakPolarHBondContact O-CG2 3.15Å; C10-V14 PolarHBondContact O-N 3.46Å |
| 11 | I | 62 | Low | 54 | Low | 82 Ų | 82 | 92.9 Ų | 92.9 | 42% | 0.421 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.2 | -45.1 | 175.3 | -67.3 | 161.2 | 0 | 0 | 0 | 110.4 | A7 M8 T13 V14 A15 L34 | A7-I11 WeakPolarHBondContact O-CB 3.39Å; A7-I11 WeakPolarHBondContact O-CD1 3.36Å; A7-I11 WeakPolarHBondContact O-CG1 3.2Å; A7-I11 PolarHBondContact O-N 3.39Å; M8-I11 PolarHBondContact O-N 3.26Å; I11-T13 VanDerWaalsContact C-N 3.33Å; I11-T13 PolarHBondContact O-N 3.01Å; I11-V14 PolarHBondContact O-N 3.39Å; I11-A15 WeakPolarHBondContact O-CB 3.47Å; I11-A15 PolarHBondContact O-N 3.48Å; I11-L34 HydrophobicContact CG2-CD2 3.7Å |
| 12 | D | 66 | Low | 54.3 | Low | 77 Ų | 77 | 88.6 Ų | 88.6 | 41% | 0.412 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.3 | -39.1 | 176.5 | -72.4 | -13.7 | 0 | 0 | 0 | 112.1 | M8 N16 | M8-D12 PolarHBondContact O-N 2.99Å; D12-N16 WeakPolarHBondContact O-CB 3.49Å; D12-N16 VanDerWaalsContact O-CG 3.25Å; D12-N16 PolarHBondContact O-N 2.85Å; D12-N16 PolarHBondContact O-ND2 3.5Å |
| 13 | T | 59.3 | Low | 54.8 | Low | 80 Ų | 80 | 90.4 Ų | 90.4 | 49% | 0.491 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -70.7 | -43.2 | 179.3 | -56.2 | 0 | 0 | 0 | 0 | 111.9 | G9 C10 I11 N16 M17 | G9-T13 WeakPolarHBondContact O-CB 2.88Å; G9-T13 PolarHBondContact O-N 3.3Å; G9-T13 PolarHBondContact O-OG1 2.96Å; C10-T13 PolarHBondContact O-N 3.25Å; I11-T13 VanDerWaalsContact C-N 3.33Å; I11-T13 PolarHBondContact O-N 3.01Å; T13-N16 PolarHBondContact O-N 3.44Å; T13-M17 PolarHBondContact O-N 2.91Å |
| 14 | V | 61.6 | Low | 55.3 | Low | 70 Ų | 70 | 92.2 Ų | 92.2 | 42% | 0.424 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -68.2 | -40.3 | 179.4 | 169.9 | 0 | 0 | 0 | 0 | 110.7 | C10 I11 M17 Q18 | C10-V14 VanDerWaalsContact O-CB 3.32Å; C10-V14 WeakPolarHBondContact O-CB 3.28Å; C10-V14 WeakPolarHBondContact O-CG2 3.15Å; C10-V14 PolarHBondContact O-N 3.46Å; I11-V14 PolarHBondContact O-N 3.39Å; V14-M17 PolarHBondContact O-N 3.36Å; V14-Q18 HydrophobicContact CG1-CG 4.44Å; V14-Q18 WeakPolarHBondContact O-CB 3.49Å; V14-Q18 WeakPolarHBondContact O-CG 3.12Å; V14-Q18 PolarHBondContact O-N 3.3Å |
| 15 | A | 59.2 | Low | 55.3 | Low | 12 Ų | 12 | 96.6 Ų | 96.6 | 10% | 0.099 | 51% | 0.506 | C | S | . | . | H | α-helix | trans | -67.6 | -37.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | I11 L19 L31 L34 | I11-A15 WeakPolarHBondContact O-CB 3.47Å; I11-A15 PolarHBondContact O-N 3.48Å; A15-L19 VanDerWaalsContact O-CB 3.28Å; A15-L19 WeakPolarHBondContact O-CB 3.28Å; A15-L19 PolarHBondContact O-N 3.1Å; A15-L31 HydrophobicContact CB-CD1 3.27Å; A15-L31 HydrophobicContact CB-CG 4.49Å; A15-L34 HydrophobicContact CB-CD2 4.37Å |
| 16 | N | 58.9 | Low | 55.6 | Low | 83 Ų | 83 | 97.9 Ų | 97.9 | 44% | 0.444 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -66.4 | -36.8 | 171.7 | -77.4 | -33.1 | 0 | 0 | 0 | 113.5 | D12 T13 L19 V20 | D12-N16 WeakPolarHBondContact O-CB 3.49Å; D12-N16 VanDerWaalsContact O-CG 3.25Å; D12-N16 PolarHBondContact O-N 2.85Å; D12-N16 PolarHBondContact O-ND2 3.5Å; T13-N16 PolarHBondContact O-N 3.44Å; N16-L19 WeakPolarHBondContact O-CB 3.49Å; N16-V20 PolarHBondContact O-N 3.19Å |
| 17 | M | 57 | Low | 56 | Low | 131 Ų | 131 | 93.5 Ų | 93.5 | 65% | 0.645 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -72.6 | -37.4 | 175.7 | -87.7 | -177 | 169.6 | 0 | 0 | 113.1 | T13 V14 L19 R21 | T13-M17 PolarHBondContact O-N 2.91Å; V14-M17 PolarHBondContact O-N 3.36Å; M17-L19 VanDerWaalsContact C-N 3.31Å; M17-R21 WeakPolarHBondContact O-CG 3.4Å; M17-R21 PolarHBondContact O-N 3.42Å |
| 18 | Q | 50.7 | Low | 56.3 | Low | 97 Ų | 97 | 94.1 Ų | 94.1 | 45% | 0.453 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -71.9 | -29.5 | 174.6 | -73.4 | -168.7 | -23.3 | 0 | 0 | 111.6 | V14 R21 M22 | V14-Q18 HydrophobicContact CG1-CG 4.44Å; V14-Q18 WeakPolarHBondContact O-CB 3.49Å; V14-Q18 WeakPolarHBondContact O-CG 3.12Å; V14-Q18 PolarHBondContact O-N 3.3Å; Q18-R21 PolarHBondContact O-N 3.24Å; Q18-M22 HydrophobicContact CB-CE 3.91Å; Q18-M22 HydrophobicContact CG-CE 4.47Å; Q18-M22 WeakPolarHBondContact O-CB 3.48Å; Q18-M22 PolarHBondContact O-N 3.47Å |
| 19 | L | 55.5 | Low | 56.2 | Low | 31 Ų | 31 | 92.6 Ų | 92.6 | 16% | 0.162 | 48% | 0.484 | C | S | . | . | H | α-helix | trans | -51.5 | -56.3 | 170.8 | -132.4 | 58.5 | 0 | 0 | 0 | 111.7 | A15 N16 M17 R21 Y23 S27 L31 | A15-L19 VanDerWaalsContact O-CB 3.28Å; A15-L19 WeakPolarHBondContact O-CB 3.28Å; A15-L19 PolarHBondContact O-N 3.1Å; N16-L19 WeakPolarHBondContact O-CB 3.49Å; M17-L19 VanDerWaalsContact C-N 3.31Å; L19-R21 VanDerWaalsContact C-N 3.31Å; L19-R21 PolarHBondContact O-N 2.9Å; L19-Y23 PolarHBondContact O-N 3.23Å; L19-S27 VanDerWaalsContact CD1-CB 3.48Å; L19-S27 WeakPolarHBondContact CD1-O 3.42Å; L19-S27 WeakPolarHBondContact CG-OG 3.44Å; L19-S27 WeakPolarHBondContact O-CB 3.34Å; L19-L31 HydrophobicContact CD1-CB 4.21Å |
| 20 | V | 55.1 | Low | 56.1 | Low | 98 Ų | 98 | 97.6 Ų | 97.6 | 59% | 0.594 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -70.5 | -30.7 | -174.8 | 171.9 | 0 | 0 | 0 | 0 | 111.3 | N16 | N16-V20 PolarHBondContact O-N 3.19Å |
| 21 | R | 53.8 | Low | 56.5 | Low | 228 Ų | 228 | 96.5 Ų | 96.5 | 86% | 0.86 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -84.6 | -30.1 | -177.7 | -76.2 | -167.6 | 175.1 | 179 | 1.2 | 114.8 | M17 Q18 L19 | M17-R21 WeakPolarHBondContact O-CG 3.4Å; M17-R21 PolarHBondContact O-N 3.42Å; Q18-R21 PolarHBondContact O-N 3.24Å; L19-R21 VanDerWaalsContact C-N 3.31Å; L19-R21 PolarHBondContact O-N 2.9Å |
| 22 | M | 54.7 | Low | 56.6 | Low | 132 Ų | 132 | 99.5 Ų | 99.5 | 65% | 0.65 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -93.6 | -33.6 | 180 | -99.4 | 179.5 | -74.5 | 0 | 0 | 113.9 | Q18 | Q18-M22 HydrophobicContact CB-CE 3.91Å; Q18-M22 HydrophobicContact CG-CE 4.47Å; Q18-M22 WeakPolarHBondContact O-CB 3.48Å; Q18-M22 PolarHBondContact O-N 3.47Å |
| 23 | Y | 51.4 | Low | 56.3 | Low | 126 Ų | 126 | 98.9 Ų | 98.9 | 49% | 0.494 | 50% | 0.497 | S | S | . | . | trans | -148.2 | 114.7 | -173.5 | -123.3 | -79.9 | 0 | 0 | 0 | 110.3 | L19 K25 D26 S27 | L19-Y23 PolarHBondContact O-N 3.23Å; Y23-K25 HydrophobicContact CD1-CB 3.89Å; Y23-K25 HydrophobicContact CE1-CB 4.14Å; Y23-K25 PolarHBondContact O-N 2.94Å; Y23-K25 VanDerWaalsContact O-N 3.12Å; Y23-D26 HydrophobicContact CD1-CB 3.65Å; Y23-D26 HydrophobicContact CE1-CB 3.53Å; Y23-D26 WeakPolarHBondContact CE1-OD2 3.2Å; Y23-D26 HydrophobicContact CE2-CB 4.5Å; Y23-D26 HydrophobicContact CG-CB 4.15Å; Y23-S27 PolarHBondContact O-OG 3.35Å | ||
| 24 | Q | 52.3 | Low | 56.6 | Low | 177 Ų | 177 | 98.3 Ų | 98.3 | 83% | 0.827 | 49% | 0.49 | S | S | * | . | S | Bend | trans | -65.4 | -6.1 | 165.8 | -70.1 | -77.8 | -78 | 0 | 0 | 112.5 | ||
| 25 | K | 50.9 | Low | 57.1 | Low | 160 Ų | 160 | 100.3 Ų | 100.3 | 70% | 0.696 | 50% | 0.495 | S | S | * | . | S | Bend | trans | -135 | -32.1 | -168.6 | -154 | 163.2 | 67.5 | 54 | 0 | 118.9 | Y23 | Y23-K25 HydrophobicContact CD1-CB 3.89Å; Y23-K25 HydrophobicContact CE1-CB 4.14Å; Y23-K25 PolarHBondContact O-N 2.94Å; Y23-K25 VanDerWaalsContact O-N 3.12Å |
| 26 | D | 53.6 | Low | 57.5 | Low | 74 Ų | 74 | 106 Ų | 106 | 40% | 0.396 | 52% | 0.518 | S | S | . | . | S | Bend | trans | -134.2 | 32.4 | -168.9 | -65.2 | -65.4 | 0 | 0 | 0 | 113.1 | Y23 | Y23-D26 HydrophobicContact CD1-CB 3.65Å; Y23-D26 HydrophobicContact CE1-CB 3.53Å; Y23-D26 WeakPolarHBondContact CE1-OD2 3.2Å; Y23-D26 HydrophobicContact CE2-CB 4.5Å; Y23-D26 HydrophobicContact CG-CB 4.15Å |
| 27 | S | 51.5 | Low | 57.9 | Low | 28 Ų | 28 | 108 Ų | 108 | 20% | 0.196 | 52% | 0.522 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -79.8 | -30.6 | -169.4 | 48.8 | 0 | 0 | 0 | 0 | 111.8 | L19 Y23 V29 F30 | L19-S27 VanDerWaalsContact CD1-CB 3.48Å; L19-S27 WeakPolarHBondContact CD1-O 3.42Å; L19-S27 WeakPolarHBondContact CG-OG 3.44Å; L19-S27 WeakPolarHBondContact O-CB 3.34Å; Y23-S27 PolarHBondContact O-OG 3.35Å; S27-V29 PolarHBondContact O-N 3.07Å; S27-V29 VanDerWaalsContact O-N 3.08Å; S27-F30 PolarHBondContact O-N 3.02Å |
| 28 | A | 58.4 | Low | 58.7 | Low | 62 Ų | 62 | 105.7 Ų | 105.7 | 51% | 0.512 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -53.7 | -31.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | F30 L31 Q32 | A28-F30 PolarHBondContact O-N 3.04Å; A28-L31 PolarHBondContact O-N 3.03Å; A28-Q32 WeakPolarHBondContact O-CB 3.43Å; A28-Q32 PolarHBondContact O-N 3.43Å; A28-Q32 VanDerWaalsContact O-N 3.09Å |
| 29 | V | 58.9 | Low | 59.7 | Low | 92 Ų | 92 | 102.7 Ų | 102.7 | 56% | 0.558 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -67.2 | -37.8 | -176 | 177.9 | 0 | 0 | 0 | 0 | 111.9 | S27 Q32 V33 | S27-V29 PolarHBondContact O-N 3.07Å; S27-V29 VanDerWaalsContact O-N 3.08Å; V29-Q32 PolarHBondContact O-N 2.99Å; V29-V33 VanDerWaalsContact O-CG2 3.32Å; V29-V33 WeakPolarHBondContact O-CG2 3.47Å; V29-V33 PolarHBondContact O-N 3.39Å |
| 30 | F | 52.7 | Low | 60.7 | Low | 139 Ų | 139 | 106.2 Ų | 106.2 | 61% | 0.61 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -72.7 | -36.4 | -178.5 | -166.5 | -98.6 | 0 | 0 | 0 | 112 | S27 A28 Q32 V33 L34 | S27-F30 PolarHBondContact O-N 3.02Å; A28-F30 PolarHBondContact O-N 3.04Å; F30-Q32 VanDerWaalsContact C-N 3.32Å; F30-V33 PolarHBondContact O-N 3.39Å; F30-L34 PolarHBondContact O-N 3.43Å |
| 31 | L | 62.5 | Low | 61.7 | Low | 48 Ų | 48 | 103.1 Ų | 103.1 | 25% | 0.251 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.6 | -39.7 | 172.6 | 179 | 67 | 0 | 0 | 0 | 111.2 | A15 L19 A28 L34 H35 | A15-L31 HydrophobicContact CB-CD1 3.27Å; A15-L31 HydrophobicContact CB-CG 4.49Å; L19-L31 HydrophobicContact CD1-CB 4.21Å; A28-L31 PolarHBondContact O-N 3.03Å; L31-L34 WeakPolarHBondContact O-CB 3.43Å; L31-L34 PolarHBondContact O-N 2.88Å; L31-H35 PolarHBondContact O-N 3.31Å |
| 32 | Q | 63.6 | Low | 62.8 | Low | 144 Ų | 144 | 95.4 Ų | 95.4 | 67% | 0.673 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -67.3 | -37 | 178.3 | -166.6 | 164.1 | 4.3 | 0 | 0 | 112.5 | A28 V29 F30 H35 F36 | A28-Q32 WeakPolarHBondContact O-CB 3.43Å; A28-Q32 PolarHBondContact O-N 3.43Å; A28-Q32 VanDerWaalsContact O-N 3.09Å; V29-Q32 PolarHBondContact O-N 2.99Å; F30-Q32 VanDerWaalsContact C-N 3.32Å; Q32-H35 PolarHBondContact O-N 2.95Å; Q32-F36 PolarHBondContact O-N 3.33Å |
| 33 | V | 60.1 | Low | 63.7 | Low | 65 Ų | 65 | 95.8 Ų | 95.8 | 39% | 0.394 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -67.7 | -39.8 | 173.6 | 172.5 | 0 | 0 | 0 | 0 | 111.2 | V29 F30 F36 F37 | V29-V33 VanDerWaalsContact O-CG2 3.32Å; V29-V33 WeakPolarHBondContact O-CG2 3.47Å; V29-V33 PolarHBondContact O-N 3.39Å; F30-V33 PolarHBondContact O-N 3.39Å; V33-F36 WeakPolarHBondContact O-CB 3.28Å; V33-F36 PolarHBondContact O-N 3.45Å; V33-F37 HydrophobicContact CG1-CD2 3.79Å; V33-F37 HydrophobicContact CG1-CE2 3.45Å; V33-F37 VanDerWaalsContact CG1-CE2 3.45Å; V33-F37 WeakPolarHBondContact O-CD2 3.49Å; V33-F37 PolarHBondContact O-N 3.48Å; V33-F37 VanDerWaalsContact O-N 3.09Å |
| 34 | L | 66.4 | Low | 64.9 | Low | 68 Ų | 68 | 92.6 Ų | 92.6 | 36% | 0.356 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.2 | -46.1 | 174.9 | -176 | 67.4 | 0 | 0 | 0 | 111.4 | I11 A15 F30 L31 F36 F37 V38 | I11-L34 HydrophobicContact CG2-CD2 3.7Å; A15-L34 HydrophobicContact CB-CD2 4.37Å; F30-L34 PolarHBondContact O-N 3.43Å; L31-L34 WeakPolarHBondContact O-CB 3.43Å; L31-L34 PolarHBondContact O-N 2.88Å; L34-F36 VanDerWaalsContact C-N 3.28Å; L34-F36 PolarHBondContact O-N 2.92Å; L34-F37 PolarHBondContact O-N 3.45Å; L34-V38 WeakPolarHBondContact O-CG2 3Å; L34-V38 PolarHBondContact O-N 3.19Å |
| 35 | H | 70.9 | Confident | 65.9 | Low | 111 Ų | 111 | 87.7 Ų | 87.7 | 51% | 0.514 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -62.6 | -35.7 | 176.9 | -167.3 | -109.9 | 0 | 0 | 0 | 112.2 | L31 Q32 V38 G39 | L31-H35 PolarHBondContact O-N 3.31Å; Q32-H35 PolarHBondContact O-N 2.95Å; H35-V38 PolarHBondContact O-N 3.1Å; H35-G39 PolarHBondContact O-N 2.76Å |
| 36 | F | 68.4 | Low | 66.7 | Low | 133 Ų | 133 | 83.1 Ų | 83.1 | 58% | 0.583 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -61 | -45.2 | 172.9 | 173.7 | -96.4 | 0 | 0 | 0 | 112.5 | Q32 V33 L34 V38 G39 F40 | Q32-F36 PolarHBondContact O-N 3.33Å; V33-F36 WeakPolarHBondContact O-CB 3.28Å; V33-F36 PolarHBondContact O-N 3.45Å; L34-F36 VanDerWaalsContact C-N 3.28Å; L34-F36 PolarHBondContact O-N 2.92Å; F36-V38 VanDerWaalsContact C-N 3.34Å; F36-V38 PolarHBondContact O-N 2.81Å; F36-G39 PolarHBondContact O-N 3.46Å; F36-F40 WeakPolarHBondContact O-CB 3.17Å; F36-F40 PolarHBondContact O-N 3.11Å |
| 37 | F | 66.6 | Low | 67.5 | Low | 124 Ų | 124 | 85.6 Ų | 85.6 | 54% | 0.544 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -68.8 | -31.8 | 177.5 | -75.5 | -67.1 | 0 | 0 | 0 | 113 | V33 L34 G41 | V33-F37 HydrophobicContact CG1-CD2 3.79Å; V33-F37 HydrophobicContact CG1-CE2 3.45Å; V33-F37 VanDerWaalsContact CG1-CE2 3.45Å; V33-F37 WeakPolarHBondContact O-CD2 3.49Å; V33-F37 PolarHBondContact O-N 3.48Å; V33-F37 VanDerWaalsContact O-N 3.09Å; L34-F37 PolarHBondContact O-N 3.45Å; F37-G41 PolarHBondContact O-N 2.88Å |
| 38 | V | 74.4 | Confident | 68.4 | Low | 83 Ų | 83 | 88.9 Ų | 88.9 | 50% | 0.503 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.2 | -48.7 | 171.7 | 172 | 0 | 0 | 0 | 0 | 110.6 | L34 H35 F36 F40 G41 A42 | L34-V38 WeakPolarHBondContact O-CG2 3Å; L34-V38 PolarHBondContact O-N 3.19Å; H35-V38 PolarHBondContact O-N 3.1Å; F36-V38 VanDerWaalsContact C-N 3.34Å; F36-V38 PolarHBondContact O-N 2.81Å; V38-F40 VanDerWaalsContact C-N 3.35Å; V38-F40 PolarHBondContact O-N 3.34Å; V38-G41 PolarHBondContact O-N 3.07Å; V38-A42 PolarHBondContact O-N 3.19Å |
| 39 | G | 72.1 | Confident | 69.1 | Low | 34 Ų | 34 | 87.4 Ų | 87.4 | 35% | 0.351 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -61.5 | -40.7 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | H35 F36 A42 L43 | H35-G39 PolarHBondContact O-N 2.76Å; F36-G39 PolarHBondContact O-N 3.46Å; G39-A42 WeakPolarHBondContact O-CB 3.11Å; G39-A42 PolarHBondContact O-N 2.88Å; G39-L43 WeakPolarHBondContact O-CG 3.35Å; G39-L43 PolarHBondContact O-N 3.31Å; G39-L43 VanDerWaalsContact O-N 3.1Å |
| 40 | F | 77.2 | Confident | 69.3 | Low | 105 Ų | 105 | 87.5 Ų | 87.5 | 46% | 0.461 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -61.9 | -42.9 | 174.2 | 178.1 | -103.4 | 0 | 0 | 0 | 112 | F36 V38 A42 L43 L44 | F36-F40 WeakPolarHBondContact O-CB 3.17Å; F36-F40 PolarHBondContact O-N 3.11Å; V38-F40 VanDerWaalsContact C-N 3.35Å; V38-F40 PolarHBondContact O-N 3.34Å; F40-A42 VanDerWaalsContact C-N 3.3Å; F40-A42 PolarHBondContact O-N 3.08Å; F40-L43 PolarHBondContact O-N 2.91Å; F40-L44 HydrophobicContact CE1-CB 4.47Å; F40-L44 HydrophobicContact CE1-CD2 3.72Å; F40-L44 HydrophobicContact CZ-CD2 4.07Å; F40-L44 VanDerWaalsContact O-CB 3.28Å; F40-L44 WeakPolarHBondContact O-CB 3.48Å; F40-L44 PolarHBondContact O-N 2.73Å |
| 41 | G | 75.1 | Confident | 69.8 | Low | 32 Ų | 32 | 84.9 Ų | 84.9 | 33% | 0.33 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -61.3 | -37.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | F37 V38 L43 L44 S45 | F37-G41 PolarHBondContact O-N 2.88Å; V38-G41 PolarHBondContact O-N 3.07Å; G41-L43 VanDerWaalsContact C-N 3.34Å; G41-L43 PolarHBondContact O-N 3.42Å; G41-L44 PolarHBondContact O-N 3.43Å; G41-S45 WeakPolarHBondContact O-CB 3.32Å; G41-S45 PolarHBondContact O-N 3.37Å |
| 42 | A | 76.9 | Confident | 69.6 | Low | 67 Ų | 67 | 90.8 Ų | 90.8 | 55% | 0.554 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -67.4 | -31.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | V38 G39 F40 P46 | V38-A42 PolarHBondContact O-N 3.19Å; G39-A42 WeakPolarHBondContact O-CB 3.11Å; G39-A42 PolarHBondContact O-N 2.88Å; F40-A42 VanDerWaalsContact C-N 3.3Å; F40-A42 PolarHBondContact O-N 3.08Å; A42-P46 WeakPolarHBondContact O-CD 3.4Å |
| 43 | L | 74.1 | Confident | 69.4 | Low | 139 Ų | 139 | 90.7 Ų | 90.7 | 73% | 0.728 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -79 | -37.3 | 174.3 | -67.1 | 173.6 | 0 | 0 | 0 | 112.5 | G39 F40 G41 | G39-L43 WeakPolarHBondContact O-CG 3.35Å; G39-L43 PolarHBondContact O-N 3.31Å; G39-L43 VanDerWaalsContact O-N 3.1Å; F40-L43 PolarHBondContact O-N 2.91Å; G41-L43 VanDerWaalsContact C-N 3.34Å; G41-L43 PolarHBondContact O-N 3.42Å |
| 44 | L | 76.6 | Confident | 69.3 | Low | 60 Ų | 60 | 91.2 Ų | 91.2 | 31% | 0.314 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -75.8 | -31 | -178.8 | -175.8 | 62 | 0 | 0 | 0 | 112.3 | F40 G41 L47 I48 | F40-L44 HydrophobicContact CE1-CB 4.47Å; F40-L44 HydrophobicContact CE1-CD2 3.72Å; F40-L44 HydrophobicContact CZ-CD2 4.07Å; F40-L44 VanDerWaalsContact O-CB 3.28Å; F40-L44 WeakPolarHBondContact O-CB 3.48Å; F40-L44 PolarHBondContact O-N 2.73Å; G41-L44 PolarHBondContact O-N 3.43Å; L44-L47 HydrophobicContact CD1-CD2 4.23Å; L44-L47 WeakPolarHBondContact O-CB 3.24Å; L44-L47 PolarHBondContact O-N 3.45Å; L44-I48 HydrophobicContact CD1-CD1 3.95Å; L44-I48 HydrophobicContact CD1-CG1 4.16Å; L44-I48 HydrophobicContact CD2-CD1 4.03Å; L44-I48 HydrophobicContact CG-CD1 3.63Å; L44-I48 HydrophobicContact CG-CG1 4.23Å; L44-I48 WeakPolarHBondContact O-CG1 3.18Å; L44-I48 PolarHBondContact O-N 2.99Å; L44-I48 VanDerWaalsContact O-N 3.08Å |
| 45 | S | 72.1 | Confident | 68.9 | Low | 73 Ų | 73 | 95.7 Ų | 95.7 | 51% | 0.51 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -60 | -48.8 | -176.5 | 174.6 | 0 | 0 | 0 | 0 | 113.3 | G41 L47 I48 A49 | G41-S45 WeakPolarHBondContact O-CB 3.32Å; G41-S45 PolarHBondContact O-N 3.37Å; S45-L47 VanDerWaalsContact C-N 3.35Å; S45-L47 PolarHBondContact O-N 2.9Å; S45-I48 PolarHBondContact O-N 3.44Å; S45-A49 WeakPolarHBondContact O-CB 3.34Å; S45-A49 PolarHBondContact O-N 2.93Å |
| 46 | P | 68 | Low | 68.3 | Low | 64 Ų | 64 | 93.8 Ų | 93.8 | 42% | 0.416 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -60.1 | -42.1 | 172.1 | -23.3 | 33.1 | 0 | 0 | 0 | 112.5 | A42 I48 A49 D50 | A42-P46 WeakPolarHBondContact O-CD 3.4Å; P46-I48 PolarHBondContact O-N 2.87Å; P46-A49 PolarHBondContact O-N 3.29Å; P46-A49 VanDerWaalsContact O-N 3.1Å; P46-D50 VanDerWaalsContact O-CB 3.28Å; P46-D50 WeakPolarHBondContact O-CB 3.14Å; P46-D50 PolarHBondContact O-N 3.14Å |
| 47 | L | 71.4 | Confident | 67.7 | Low | 126 Ų | 126 | 94 Ų | 94 | 66% | 0.66 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -60.5 | -32.9 | -178.9 | -160 | 104 | 0 | 0 | 0 | 112.9 | L44 S45 | L44-L47 HydrophobicContact CD1-CD2 4.23Å; L44-L47 WeakPolarHBondContact O-CB 3.24Å; L44-L47 PolarHBondContact O-N 3.45Å; S45-L47 VanDerWaalsContact C-N 3.35Å; S45-L47 PolarHBondContact O-N 2.9Å |
| 48 | I | 70.7 | Confident | 67.2 | Low | 98 Ų | 98 | 92.5 Ų | 92.5 | 50% | 0.503 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -87.4 | -31.3 | 176.6 | -62.2 | 172 | 0 | 0 | 0 | 111.6 | L44 S45 P46 P51 F52 | L44-I48 HydrophobicContact CD1-CD1 3.95Å; L44-I48 HydrophobicContact CD1-CG1 4.16Å; L44-I48 HydrophobicContact CD2-CD1 4.03Å; L44-I48 HydrophobicContact CG-CD1 3.63Å; L44-I48 HydrophobicContact CG-CG1 4.23Å; L44-I48 WeakPolarHBondContact O-CG1 3.18Å; L44-I48 PolarHBondContact O-N 2.99Å; L44-I48 VanDerWaalsContact O-N 3.08Å; S45-I48 PolarHBondContact O-N 3.44Å; P46-I48 PolarHBondContact O-N 2.87Å; I48-P51 VanDerWaalsContact O-CD 3.26Å; I48-P51 WeakPolarHBondContact O-CD 3.4Å; I48-P51 VanDerWaalsContact O-CG 3.23Å; I48-P51 WeakPolarHBondContact O-CG 3.45Å; I48-F52 WeakPolarHBondContact O-CD2 3.23Å |
| 49 | A | 72.1 | Confident | 66.3 | Low | 30 Ų | 30 | 94.8 Ų | 94.8 | 25% | 0.248 | 55% | 0.55 | C | S | . | . | H | α-helix | trans | -83.4 | -25.1 | -178.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | S45 P46 F52 L53 | S45-A49 WeakPolarHBondContact O-CB 3.34Å; S45-A49 PolarHBondContact O-N 2.93Å; P46-A49 PolarHBondContact O-N 3.29Å; P46-A49 VanDerWaalsContact O-N 3.1Å; A49-F52 PolarHBondContact O-N 3.48Å; A49-L53 HydrophobicContact CB-CD1 4.31Å; A49-L53 PolarHBondContact O-N 3.29Å |
| 50 | D | 63.5 | Low | 65.5 | Low | 94 Ų | 94 | 99.3 Ų | 99.3 | 50% | 0.503 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -49 | -44.7 | 176.3 | -81 | -11.5 | 0 | 0 | 0 | 113.5 | P46 F52 L53 S54 | P46-D50 VanDerWaalsContact O-CB 3.28Å; P46-D50 WeakPolarHBondContact O-CB 3.14Å; P46-D50 PolarHBondContact O-N 3.14Å; D50-F52 VanDerWaalsContact C-N 3.25Å; D50-F52 PolarHBondContact O-N 3.34Å; D50-L53 PolarHBondContact O-N 3.21Å; D50-S54 WeakPolarHBondContact O-CB 3.14Å; D50-S54 PolarHBondContact O-N 3.4Å |
| 51 | P | 63 | Low | 64.6 | Low | 84 Ų | 84 | 98.4 Ų | 98.4 | 55% | 0.545 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -69 | -17.1 | 176.5 | 24.3 | -34.4 | 0 | 0 | 0 | 114.8 | I48 | I48-P51 VanDerWaalsContact O-CD 3.26Å; I48-P51 WeakPolarHBondContact O-CD 3.4Å; I48-P51 VanDerWaalsContact O-CG 3.23Å; I48-P51 WeakPolarHBondContact O-CG 3.45Å |
| 52 | F | 59.2 | Low | 63.5 | Low | 173 Ų | 173 | 103.6 Ų | 103.6 | 76% | 0.759 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -97 | -22.3 | 178.1 | -61.6 | -78.8 | 0 | 0 | 0 | 113.1 | I48 A49 D50 | I48-F52 WeakPolarHBondContact O-CD2 3.23Å; A49-F52 PolarHBondContact O-N 3.48Å; D50-F52 VanDerWaalsContact C-N 3.25Å; D50-F52 PolarHBondContact O-N 3.34Å |
| 53 | L | 58.2 | Low | 62.4 | Low | 141 Ų | 141 | 105.7 Ų | 105.7 | 74% | 0.738 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -101.7 | -25.3 | -179.8 | -66.9 | 176.7 | 0 | 0 | 0 | 113.5 | A49 D50 E55 | A49-L53 HydrophobicContact CB-CD1 4.31Å; A49-L53 PolarHBondContact O-N 3.29Å; D50-L53 PolarHBondContact O-N 3.21Å; L53-E55 PolarHBondContact O-N 3.34Å |
| 54 | S | 57.5 | Low | 61.4 | Low | 76 Ų | 76 | 105 Ų | 105 | 53% | 0.531 | 62% | 0.617 | S | S | . | * | S | Bend | trans | -71.5 | 118.7 | 170.2 | 178.3 | 0 | 0 | 0 | 0 | 108.3 | D50 A56 | D50-S54 WeakPolarHBondContact O-CB 3.14Å; D50-S54 PolarHBondContact O-N 3.4Å; S54-A56 PolarHBondContact O-N 2.9Å |
| 55 | E | 59.1 | Low | 60.3 | Low | 162 Ų | 162 | 107 Ų | 107 | 76% | 0.757 | 64% | 0.643 | S | S | * | * | trans | -65.6 | 55.2 | 174.4 | -65.9 | -148.6 | 137.4 | 0 | 0 | 112.8 | L53 N57 | L53-E55 PolarHBondContact O-N 3.34Å; E55-N57 PolarHBondContact O-N 3.04Å; E55-N57 VanDerWaalsContact O-N 3.11Å | ||
| 56 | A | 57.7 | Low | 59.5 | Low | 72 Ų | 72 | 110.1 Ų | 110.1 | 60% | 0.595 | 65% | 0.654 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73 | 10.5 | 167.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | S54 | S54-A56 PolarHBondContact O-N 2.9Š|
| 57 | N | 55.4 | Low | 58.6 | Low | 137 Ų | 137 | 113.2 Ų | 113.2 | 73% | 0.733 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.1 | 23.3 | 175.4 | -64.1 | -60.8 | 0 | 0 | 0 | 113.3 | E55 L59 | E55-N57 PolarHBondContact O-N 3.04Å; E55-N57 VanDerWaalsContact O-N 3.11Å; N57-L59 PolarHBondContact O-N 3.45Å |
| 58 | C | 56.6 | Low | 57.9 | Low | 93 Ų | 93 | 113.6 Ų | 113.6 | 63% | 0.628 | 68% | 0.68 | S | S | * | * | trans | -73.7 | 48.6 | 152.5 | -53.1 | 0 | 0 | 0 | 0 | 110.6 | P60 | C58-P60 VanDerWaalsContact O-CD 3.29Å; C58-P60 WeakPolarHBondContact O-CD 3.44Å | ||
| 59 | L | 56.4 | Low | 57 | Low | 130 Ų | 130 | 113.2 Ų | 113.2 | 68% | 0.681 | 69% | 0.685 | S | S | * | * | trans | -85.1 | 114.1 | 162.2 | -69 | -176.8 | 0 | 0 | 0 | 106.8 | N57 A61 | N57-L59 PolarHBondContact O-N 3.45Å; L59-A61 HydrophobicContact CB-CB 4.18Å; L59-A61 PolarHBondContact O-N 3.29Å | ||
| 60 | P | 55.2 | Low | 56 | Low | 130 Ų | 130 | 122.8 Ų | 122.8 | 84% | 0.844 | 72% | 0.715 | S | S | * | * | trans | -71.6 | 78.3 | 165.9 | 32.2 | -35.2 | 0 | 0 | 0 | 108 | C58 | C58-P60 VanDerWaalsContact O-CD 3.29Å; C58-P60 WeakPolarHBondContact O-CD 3.44Å | ||
| 61 | A | 58.6 | Low | 55.6 | Low | 85 Ų | 85 | 121.5 Ų | 121.5 | 70% | 0.702 | 72% | 0.724 | S | S | * | * | trans | -114.4 | 47.5 | -176.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | L59 | L59-A61 HydrophobicContact CB-CB 4.18Å; L59-A61 PolarHBondContact O-N 3.29Å | ||
| 62 | N | 50.3 | Low | 55 | Low | 141 Ų | 141 | 123.8 Ų | 123.8 | 75% | 0.754 | 73% | 0.727 | S | S | * | * | trans | -169.9 | 92.8 | 139.9 | -145.2 | 3.7 | 0 | 0 | 0 | 109.8 | ||||
| 63 | S | 54.7 | Low | 54.9 | Low | 112 Ų | 112 | 122.3 Ų | 122.3 | 78% | 0.783 | 73% | 0.727 | S | S | * | * | trans | -139.1 | 89.6 | 159.7 | -74.7 | 0 | 0 | 0 | 0 | 106.7 | A65 | S63-A65 PolarHBondContact O-N 3.02Š| ||
| 64 | T | 52.5 | Low | 54.6 | Low | 123 Ų | 123 | 123.3 Ų | 123.3 | 76% | 0.755 | 73% | 0.725 | S | S | * | * | trans | -50.5 | 109.7 | 162.5 | -49.3 | 0 | 0 | 0 | 0 | 106.7 | N66 | T64-N66 PolarHBondContact O-N 2.92Š| ||
| 65 | A | 54.9 | Low | 54.2 | Low | 104 Ų | 104 | 126.2 Ų | 126.2 | 86% | 0.86 | 73% | 0.73 | S | S | * | * | trans | -63.3 | 89.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 108.7 | S63 | S63-A65 PolarHBondContact O-N 3.02Š| ||
| 66 | N | 54.6 | Low | 53.8 | Low | 137 Ų | 137 | 122.4 Ų | 122.4 | 73% | 0.733 | 72% | 0.718 | S | S | * | * | trans | -143.9 | 94.5 | 160.9 | -166.4 | 20.7 | 0 | 0 | 0 | 108.3 | T64 | T64-N66 PolarHBondContact O-N 2.92Š| ||
| 67 | T | 48.8 | Very low | 53.5 | Low | 130 Ų | 130 | 123.8 Ų | 123.8 | 80% | 0.798 | 72% | 0.723 | S | S | * | * | trans | -173.6 | 106 | 148.5 | 24.3 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 68 | T | 56.2 | Low | 53.2 | Low | 134 Ų | 134 | 127.3 Ų | 127.3 | 82% | 0.822 | 73% | 0.726 | S | S | * | * | S | Bend | trans | -25.9 | 136.1 | 155.1 | 40.6 | 0 | 0 | 0 | 0 | 114.2 | ||
| 69 | S | 52.8 | Low | 52.9 | Low | 89 Ų | 89 | 127.4 Ų | 127.4 | 62% | 0.622 | 72% | 0.723 | S | S | * | * | trans | 85.4 | 64.5 | 164.6 | -154.2 | 0 | 0 | 0 | 0 | 118.3 | G71 | S69-G71 PolarHBondContact O-N 3.47Š| ||
| 70 | R | 51.6 | Low | 52.8 | Low | 231 Ų | 231 | 129 Ų | 129 | 87% | 0.872 | 73% | 0.732 | S | S | * | * | S | Bend | trans | -76.2 | 5.3 | 161.4 | -167.7 | 170.8 | 160 | 121 | -2.6 | 113.6 | ||
| 71 | G | 53.6 | Low | 52.4 | Low | 67 Ų | 67 | 126.3 Ų | 126.3 | 69% | 0.691 | 73% | 0.728 | S | S | * | * | S | Bend | trans | -99.2 | -23.1 | -175.9 | 0 | 0 | 0 | 0 | 0 | 116.1 | S69 | S69-G71 PolarHBondContact O-N 3.47Š|
| 72 | H | 51.7 | Low | 51.9 | Low | 133 Ų | 133 | 129.9 Ų | 129.9 | 62% | 0.616 | 73% | 0.73 | S | S | * | * | S | Bend | trans | -105.9 | -23.4 | -164.3 | -162.2 | -102.9 | 0 | 0 | 0 | 115.1 | ||
| 73 | L | 55.4 | Low | 51.3 | Low | 142 Ų | 142 | 132.1 Ų | 132.1 | 74% | 0.743 | 74% | 0.736 | S | S | * | * | H | α-helix | trans | -81.4 | -22.5 | -173 | -140.4 | 148.4 | 0 | 0 | 0 | 113.5 | H75 | L73-H75 VanDerWaalsContact C-N 3.33Å; L73-H75 PolarHBondContact O-N 2.96Å |
| 74 | F | 53.7 | Low | 50.4 | Low | 162 Ų | 162 | 135 Ų | 135 | 71% | 0.711 | 74% | 0.736 | S | S | * | * | H | α-helix | trans | -76.5 | -16.1 | 177.3 | -74.2 | -79.3 | 0 | 0 | 0 | 114 | ||
| 75 | H | 47.5 | Very low | 49.6 | Very low | 136 Ų | 136 | 134 Ų | 134 | 63% | 0.63 | 73% | 0.73 | S | S | * | * | H | α-helix | trans | -92.1 | -30.7 | -179.8 | -161 | -92.1 | 0 | 0 | 0 | 113.2 | L73 | L73-H75 VanDerWaalsContact C-N 3.33Å; L73-H75 PolarHBondContact O-N 2.96Å |
| 76 | V | 51 | Low | 48.7 | Very low | 82 Ų | 82 | 135.9 Ų | 135.9 | 50% | 0.497 | 73% | 0.725 | S | S | . | * | H | α-helix | trans | -74.9 | -33.7 | -177.4 | -178 | 0 | 0 | 0 | 0 | 112 | R78 V79 | V76-R78 VanDerWaalsContact C-N 3.26Å; V76-R78 PolarHBondContact O-N 3.49Å; V76-V79 PolarHBondContact O-N 2.91Å |
| 77 | S | 52.8 | Low | 47.7 | Very low | 102 Ų | 102 | 134.5 Ų | 134.5 | 71% | 0.713 | 73% | 0.733 | S | S | * | * | H | α-helix | trans | -70.6 | -20.3 | -179.8 | -143.9 | 0 | 0 | 0 | 0 | 113.5 | ||
| 78 | R | 47.9 | Very low | 47.3 | Very low | 210 Ų | 210 | 137.6 Ų | 137.6 | 79% | 0.792 | 74% | 0.736 | S | S | * | * | H | α-helix | trans | -80.8 | -26.3 | 174.2 | -80.4 | -85.6 | 179.3 | 127.5 | -3.3 | 113.2 | V76 | V76-R78 VanDerWaalsContact C-N 3.26Å; V76-R78 PolarHBondContact O-N 3.49Å |
| 79 | V | 51.7 | Low | 47.1 | Very low | 95 Ų | 95 | 135.7 Ų | 135.7 | 58% | 0.576 | 73% | 0.725 | S | S | * | * | H | α-helix | trans | -89.9 | -22.7 | -172.9 | 173.5 | 0 | 0 | 0 | 0 | 112.9 | V76 | V76-V79 PolarHBondContact O-N 2.91Å |
| 80 | L | 53.6 | Low | 45.9 | Very low | 164 Ų | 164 | 142.9 Ų | 142.9 | 86% | 0.859 | 74% | 0.739 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.5 | 4.1 | -178.5 | -140.4 | 75.5 | 0 | 0 | 0 | 115 | ||
| 81 | G | 46.6 | Very low | 45 | Very low | 74 Ų | 74 | 135.5 Ų | 135.5 | 76% | 0.763 | 72% | 0.723 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.3 | 7.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||
| 82 | Q | 48.3 | Very low | 44.8 | Very low | 160 Ų | 160 | 139.8 Ų | 139.8 | 75% | 0.748 | 73% | 0.73 | S | S | * | * | trans | -129.2 | 43 | -160.3 | -139.8 | 174.8 | -5.4 | 0 | 0 | 114.8 | ||||
| 83 | H | 38.1 | Very low | 44.2 | Very low | 187 Ų | 187 | 141.7 Ų | 141.7 | 87% | 0.866 | 74% | 0.739 | S | S | * | * | trans | -129.8 | 117.3 | 167.2 | -111.8 | -110 | 0 | 0 | 0 | 112.3 | ||||
| 84 | H | 35 | Very low | 43.2 | Very low | 173 Ų | 173 | 141.4 Ų | 141.4 | 80% | 0.801 | 74% | 0.743 | S | S | * | * | trans | 77.1 | 124.9 | 160.4 | -123.1 | -150.8 | 0 | 0 | 0 | 116.4 | ||||
| 85 | V | 36.3 | Very low | 42.5 | Very low | 101 Ų | 101 | 143.1 Ų | 143.1 | 61% | 0.612 | 75% | 0.751 | S | S | * | * | cis | -157.9 | 134.5 | 27.8 | 171.1 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 86 | D | 35.1 | Very low | 42.8 | Very low | 144 Ų | 144 | 142.6 Ų | 142.6 | 77% | 0.77 | 76% | 0.76 | S | S | * | * | trans | 41.7 | 110.3 | 149.8 | -49.9 | -32.1 | 0 | 0 | 0 | 123.5 | ||||
| 87 | A | 35.2 | Very low | 41.8 | Very low | 109 Ų | 109 | 142.7 Ų | 142.7 | 90% | 0.901 | 78% | 0.777 | S | S | * | * | 171.4 | 130 | 101.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 88 | K | 38.9 | Very low | 41.1 | Very low | 195 Ų | 195 | 145.4 Ų | 145.4 | 85% | 0.848 | 78% | 0.783 | S | S | * | * | trans | -124.5 | 168.9 | 178.2 | 175.9 | 175.8 | 176.4 | -176.9 | 0 | 107.6 | ||||
| 89 | P | 52.2 | Low | 40.9 | Very low | 93 Ų | 93 | 141.2 Ų | 141.2 | 60% | 0.604 | 78% | 0.781 | S | S | * | * | cis | -128.3 | -169.8 | -30 | 30.2 | -11.1 | 0 | 0 | 0 | 112.4 | ||||
| 90 | W | 27.1 | Very low | 41.3 | Very low | 241 Ų | 241 | 142 Ų | 142 | 91% | 0.913 | 79% | 0.788 | S | S | * | * | trans | 125 | 128.9 | 140.4 | -156.7 | -79.9 | 0 | 0 | 0 | 112.4 | ||||
| 91 | S | 33.8 | Very low | 40.7 | Very low | 75 Ų | 75 | 143.6 Ų | 143.6 | 52% | 0.524 | 79% | 0.788 | S | S | . | * | cis | -161.9 | 155.8 | -0.8 | 48.9 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 92 | N | 48.9 | Very low | 40.7 | Very low | 158 Ų | 158 | 146.5 Ų | 146.5 | 85% | 0.845 | 79% | 0.786 | S | S | * | * | trans | -62 | 129.2 | 169.1 | -39.6 | -58.8 | 0 | 0 | 0 | 112.3 | ||||
| 93 | Q | 40.1 | Very low | 40.8 | Very low | 173 Ų | 173 | 141.5 Ų | 141.5 | 81% | 0.808 | 78% | 0.777 | S | S | * | * | trans | -152.1 | 111.2 | 151.4 | -66.6 | -164.4 | -8.6 | 0 | 0 | 112.2 | ||||
| 94 | T | 33.2 | Very low | 41.3 | Very low | 135 Ų | 135 | 136.7 Ų | 136.7 | 83% | 0.828 | 77% | 0.769 | S | S | * | * | trans | 58.5 | 122.9 | 130.2 | -27.3 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 95 | F | 40.2 | Very low | 42 | Very low | 199 Ų | 199 | 131.3 Ų | 131.3 | 87% | 0.873 | 76% | 0.761 | S | S | * | * | trans | -53.3 | 173.9 | 160 | -72.3 | -95.5 | 0 | 0 | 0 | 113.2 | ||||
| 96 | P | 52.4 | Low | 43 | Very low | 125 Ų | 125 | 130 Ų | 130 | 81% | 0.812 | 75% | 0.753 | S | S | * | * | cis | -128.7 | 157.2 | -16.6 | 35.5 | -18.2 | 0 | 0 | 0 | 113.1 | ||||
| 97 | G | 29.6 | Very low | 43.9 | Very low | 83 Ų | 83 | 133 Ų | 133 | 86% | 0.856 | 75% | 0.753 | S | S | * | * | trans | -164.5 | 124.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 98 | L | 39.6 | Very low | 45 | Very low | 160 Ų | 160 | 133 Ų | 133 | 84% | 0.838 | 74% | 0.742 | S | S | * | * | trans | -71.4 | 130.8 | -178.4 | -83.7 | 142.8 | 0 | 0 | 0 | 114.5 | ||||
| 99 | T | 42.5 | Very low | 45.9 | Very low | 122 Ų | 122 | 126.6 Ų | 126.6 | 75% | 0.748 | 72% | 0.722 | S | S | * | * | trans | 65.2 | 169.5 | 142.8 | 71 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 100 | P | 60.4 | Low | 46.5 | Very low | 112 Ų | 112 | 129.7 Ų | 129.7 | 73% | 0.727 | 72% | 0.723 | S | S | * | * | -134.4 | 146.4 | -62.2 | 37.2 | -21.3 | 0 | 0 | 0 | 112 | |||||
| 101 | K | 40.9 | Very low | 48.4 | Very low | 197 Ų | 197 | 120.7 Ų | 120.7 | 86% | 0.857 | 70% | 0.7 | S | S | * | * | trans | 177.5 | 145.6 | 163.5 | -110.2 | -166.9 | 155.5 | 168.8 | 0 | 108.9 | ||||
| 102 | D | 48 | Very low | 50.1 | Low | 135 Ų | 135 | 123.7 Ų | 123.7 | 72% | 0.722 | 70% | 0.704 | S | S | * | * | cis | -175.4 | 153 | -5 | -150.1 | -21.3 | 0 | 0 | 0 | 105.6 | ||||
| 103 | G | 48.7 | Very low | 51.1 | Low | 55 Ų | 55 | 123.6 Ų | 123.6 | 57% | 0.567 | 69% | 0.692 | S | S | * | * | S | Bend | trans | 102.1 | -4.1 | 146.4 | 0 | 0 | 0 | 0 | 0 | 121 | ||
| 104 | A | 48.9 | Very low | 52.8 | Low | 85 Ų | 85 | 119.9 Ų | 119.9 | 70% | 0.702 | 68% | 0.676 | S | S | * | * | S | Bend | trans | -115.5 | -25.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | ||
| 105 | G | 49.6 | Very low | 54.4 | Low | 60 Ų | 60 | 119.3 Ų | 119.3 | 62% | 0.619 | 67% | 0.666 | S | S | * | * | S | Bend | trans | -84.8 | -20.7 | -175.2 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||
| 106 | T | 56.8 | Low | 55.9 | Low | 73 Ų | 73 | 112 Ų | 112 | 45% | 0.448 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -76.8 | -41.5 | -170.9 | 45.9 | 0 | 0 | 0 | 0 | 112.6 | V108 S109 Y110 | T106-V108 PolarHBondContact O-N 3.29Å; T106-S109 PolarHBondContact O-N 3.33Å; T106-Y110 WeakPolarHBondContact O-CD2 3.34Å; T106-Y110 PolarHBondContact O-N 2.92Å |
| 107 | R | 55.5 | Low | 56.7 | Low | 207 Ų | 207 | 112.2 Ų | 112.2 | 78% | 0.781 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -64.7 | -36.8 | -176.2 | -73.8 | -178.2 | 149.2 | -96.8 | -3.3 | 113.8 | A111 | R107-A111 PolarHBondContact O-N 3.04Å |
| 108 | V | 58.6 | Low | 58.8 | Low | 110 Ų | 110 | 114 Ų | 114 | 67% | 0.667 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -75.2 | -35.6 | 179.1 | -170.5 | 0 | 0 | 0 | 0 | 110.7 | T106 A111 F112 | T106-V108 PolarHBondContact O-N 3.29Å; V108-A111 PolarHBondContact O-N 3.09Å; V108-F112 PolarHBondContact O-N 2.85Å; V108-F112 VanDerWaalsContact O-N 3.09Å |
| 109 | S | 57.3 | Low | 59.8 | Low | 60 Ų | 60 | 112.4 Ų | 112.4 | 42% | 0.42 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -66.4 | -42.9 | 176.7 | -158.7 | 0 | 0 | 0 | 0 | 111.6 | T106 A111 F112 W113 | T106-S109 PolarHBondContact O-N 3.33Å; S109-A111 PolarHBondContact O-N 2.91Å; S109-F112 PolarHBondContact O-N 3.39Å; S109-W113 PolarHBondContact O-N 3.28Å; S109-W113 VanDerWaalsContact O-N 3.14Å |
| 110 | Y | 64 | Low | 60.2 | Low | 158 Ų | 158 | 113.1 Ų | 113.1 | 62% | 0.62 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -62.5 | -40.4 | 173.6 | -71.3 | -66.2 | 0 | 0 | 0 | 112.5 | T106 F112 W113 I114 | T106-Y110 WeakPolarHBondContact O-CD2 3.34Å; T106-Y110 PolarHBondContact O-N 2.92Å; Y110-F112 VanDerWaalsContact C-N 3.31Å; Y110-F112 PolarHBondContact O-N 3.39Å; Y110-W113 PolarHBondContact O-N 3.24Å; Y110-I114 WeakPolarHBondContact O-CB 3.38Å; Y110-I114 WeakPolarHBondContact O-CD1 3.23Å; Y110-I114 WeakPolarHBondContact O-CG1 3.26Å; Y110-I114 PolarHBondContact O-N 3.4Å |
| 111 | A | 66.9 | Low | 59.7 | Low | 52 Ų | 52 | 116 Ų | 116 | 43% | 0.43 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -61.5 | -39.1 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | R107 V108 S109 M115 | R107-A111 PolarHBondContact O-N 3.04Å; V108-A111 PolarHBondContact O-N 3.09Å; S109-A111 PolarHBondContact O-N 2.91Å; A111-M115 WeakPolarHBondContact O-CB 2.95Å; A111-M115 VanDerWaalsContact O-CG 3.24Å; A111-M115 WeakPolarHBondContact O-CG 3.37Å; A111-M115 PolarHBondContact O-N 2.69Å |
| 112 | F | 69.9 | Low | 60.6 | Low | 139 Ų | 139 | 112 Ų | 112 | 61% | 0.61 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -62.4 | -48.9 | 174.3 | 176.2 | -96.8 | 0 | 0 | 0 | 112.1 | V108 S109 Y110 I114 M115 A116 | V108-F112 PolarHBondContact O-N 2.85Å; V108-F112 VanDerWaalsContact O-N 3.09Å; S109-F112 PolarHBondContact O-N 3.39Å; Y110-F112 VanDerWaalsContact C-N 3.31Å; Y110-F112 PolarHBondContact O-N 3.39Å; F112-I114 PolarHBondContact O-N 3.16Å; F112-M115 PolarHBondContact O-N 3.11Å; F112-A116 WeakPolarHBondContact O-CB 3.29Å; F112-A116 PolarHBondContact O-N 2.8Å |
| 113 | W | 70.9 | Confident | 61.3 | Low | 156 Ų | 156 | 110.8 Ų | 110.8 | 59% | 0.591 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -66.7 | -36.1 | 180 | -74.8 | 108.9 | 0 | 0 | 0 | 113.2 | S109 Y110 A116 L117 | S109-W113 PolarHBondContact O-N 3.28Å; S109-W113 VanDerWaalsContact O-N 3.14Å; Y110-W113 PolarHBondContact O-N 3.24Å; W113-A116 PolarHBondContact O-N 2.96Å; W113-L117 WeakPolarHBondContact O-CB 3.15Å; W113-L117 PolarHBondContact O-N 3.47Å |
| 114 | I | 74.9 | Confident | 62 | Low | 95 Ų | 95 | 113.9 Ų | 113.9 | 49% | 0.487 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -66.5 | -43.2 | 176 | -67.2 | 162.8 | 0 | 0 | 0 | 110.3 | Y110 F112 A116 L117 I118 | Y110-I114 WeakPolarHBondContact O-CB 3.38Å; Y110-I114 WeakPolarHBondContact O-CD1 3.23Å; Y110-I114 WeakPolarHBondContact O-CG1 3.26Å; Y110-I114 PolarHBondContact O-N 3.4Å; F112-I114 PolarHBondContact O-N 3.16Å; I114-A116 VanDerWaalsContact C-N 3.31Å; I114-A116 PolarHBondContact O-N 2.94Å; I114-L117 PolarHBondContact O-N 3.36Å; I114-I118 HydrophobicContact CG2-CD1 3.69Å; I114-I118 WeakPolarHBondContact O-CD1 3.34Å; I114-I118 VanDerWaalsContact O-CG1 3.23Å; I114-I118 WeakPolarHBondContact O-CG1 3.18Å; I114-I118 PolarHBondContact O-N 3.32Å; I114-I118 VanDerWaalsContact O-N 3.11Å |
| 115 | M | 67.5 | Low | 62.8 | Low | 123 Ų | 123 | 115.6 Ų | 115.6 | 61% | 0.606 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -65.7 | -33.9 | 175 | -69.8 | -67.5 | -84.2 | 0 | 0 | 112.2 | A111 F112 N119 | A111-M115 WeakPolarHBondContact O-CB 2.95Å; A111-M115 VanDerWaalsContact O-CG 3.24Å; A111-M115 WeakPolarHBondContact O-CG 3.37Å; A111-M115 PolarHBondContact O-N 2.69Å; F112-M115 PolarHBondContact O-N 3.11Å; M115-N119 PolarHBondContact O-N 3.35Å; M115-N119 PolarHBondContact O-ND2 3.44Å |
| 116 | A | 70.8 | Confident | 63.6 | Low | 44 Ų | 44 | 119.1 Ų | 119.1 | 36% | 0.364 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -69.2 | -40.3 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | F112 W113 I114 N119 | F112-A116 WeakPolarHBondContact O-CB 3.29Å; F112-A116 PolarHBondContact O-N 2.8Å; W113-A116 PolarHBondContact O-N 2.96Å; I114-A116 VanDerWaalsContact C-N 3.31Å; I114-A116 PolarHBondContact O-N 2.94Å; A116-N119 PolarHBondContact O-N 2.79Å |
| 117 | L | 70.3 | Confident | 64 | Low | 130 Ų | 130 | 122.1 Ų | 122.1 | 68% | 0.681 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -70.7 | -33.3 | 178.8 | -84.1 | 156.5 | 0 | 0 | 0 | 113.2 | W113 I114 N119 | W113-L117 WeakPolarHBondContact O-CB 3.15Å; W113-L117 PolarHBondContact O-N 3.47Å; I114-L117 PolarHBondContact O-N 3.36Å; L117-N119 VanDerWaalsContact C-N 3.27Å; L117-N119 PolarHBondContact O-N 3.26Å |
| 118 | I | 73.8 | Confident | 64.6 | Low | 122 Ų | 122 | 116.1 Ų | 116.1 | 63% | 0.626 | 62% | 0.615 | S | S | * | * | H | α-helix | trans | -73.3 | -21.7 | 178 | -66.6 | 165.7 | 0 | 0 | 0 | 111.8 | I114 | I114-I118 HydrophobicContact CG2-CD1 3.69Å; I114-I118 WeakPolarHBondContact O-CD1 3.34Å; I114-I118 VanDerWaalsContact O-CG1 3.23Å; I114-I118 WeakPolarHBondContact O-CG1 3.18Å; I114-I118 PolarHBondContact O-N 3.32Å; I114-I118 VanDerWaalsContact O-N 3.11Å |
| 119 | N | 60.1 | Low | 65.1 | Low | 126 Ų | 126 | 116.5 Ų | 116.5 | 67% | 0.674 | 61% | 0.611 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -97.3 | 8.1 | -178.7 | -79.6 | -75.1 | 0 | 0 | 0 | 114.2 | M115 A116 L117 | M115-N119 PolarHBondContact O-N 3.35Å; M115-N119 PolarHBondContact O-ND2 3.44Å; A116-N119 PolarHBondContact O-N 2.79Å; L117-N119 VanDerWaalsContact C-N 3.27Å; L117-N119 PolarHBondContact O-N 3.26Å |
| 120 | L | 50.5 | Low | 65.8 | Low | 137 Ų | 137 | 121.3 Ų | 121.3 | 72% | 0.717 | 63% | 0.627 | S | S | * | * | trans | -92.5 | 128.2 | 174.3 | -140.5 | 79.6 | 0 | 0 | 0 | 109.6 | ||||
| 121 | P | 49.7 | Very low | 65.9 | Low | 173 Ų | 173 | 117.9 Ų | 117.9 | 100% | 1.123 | 63% | 0.628 | S | S | * | * | trans | -66.8 | 0 | 179.4 | 28.4 | -36.2 | 0 | 0 | 0 | 113.7 |
Retrieved 121 of 121 residues in 219.1 ms
(Link to these results)