| 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 | I | 91 | Very high | 96.6 | Very high | 152 Ų | 152 | 108.4 Ų | 108.4 | 78% | 0.779 | 53% | 0.528 | S | S | * | . | 0 | 146.6 | 0 | 49.2 | 166.9 | 0 | 0 | 0 | 109.1 | Y6 Y7 | I1-Y6 HydrophobicContact CB-CD2 4.06Å; I1-Y6 HydrophobicContact CB-CE2 4.37Å; I1-Y6 HydrophobicContact CD1-CD2 4.44Å; I1-Y6 HydrophobicContact CD1-CG 4.13Å; I1-Y6 HydrophobicContact CG2-CE2 4.49Å; I1-Y7 HydrophobicContact CD1-CD2 4.26Å; I1-Y7 HydrophobicContact CD1-CE2 3.58Å; I1-Y7 HydrophobicContact CG1-CE2 3.93Å | |||
| 2 | T | 95.9 | Very high | 96.8 | Very high | 95 Ų | 95 | 104 Ų | 104 | 58% | 0.583 | 52% | 0.522 | S | S | * | . | trans | -65.1 | 151.6 | 172.5 | 48.7 | 0 | 0 | 0 | 0 | 110 | H4 | T2-H4 VanDerWaalsContact CB-O 3.32Å; T2-H4 WeakPolarHBondContact CB-O 3.3Å; T2-H4 PolarHBondContact OG1-O 2.87Å | ||
| 3 | F | 97.1 | Very high | 96.9 | Very high | 128 Ų | 128 | 104.2 Ų | 104.2 | 56% | 0.561 | 53% | 0.525 | S | S | * | . | S | Bend | trans | -61.1 | -51.1 | 179.3 | -175.9 | -94.3 | 0 | 0 | 0 | 111.2 | Y6 Y7 | F3-Y6 PolarHBondContact O-N 2.79Å; F3-Y7 HydrophobicContact CD2-CD2 4.04Å; F3-Y7 HydrophobicContact CD2-CG 4.05Å; F3-Y7 VanDerWaalsContact CE2-CB 3.42Å; F3-Y7 HydrophobicContact CE2-CG 4.11Å; F3-Y7 PolarHBondContact O-N 3.24Å |
| 4 | H | 95.7 | Very high | 97 | Very high | 129 Ų | 129 | 99.5 Ų | 99.5 | 60% | 0.597 | 52% | 0.516 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.6 | 137.6 | 171.3 | -170.4 | 71.3 | 0 | 0 | 0 | 110.2 | T2 T8 | T2-H4 VanDerWaalsContact CB-O 3.32Å; T2-H4 WeakPolarHBondContact CB-O 3.3Å; T2-H4 PolarHBondContact OG1-O 2.87Å; H4-T8 PolarHBondContact ND1-OG1 3.25Å |
| 5 | P | 95.2 | Very high | 97.1 | Very high | 55 Ų | 55 | 100 Ų | 100 | 36% | 0.357 | 52% | 0.519 | S | S | . | . | T | Hydrogen-bonded Turn | cis | -88.5 | -9.7 | 0.9 | 34.9 | -35.5 | 0 | 0 | 0 | 115.1 | T8 I9 | P5-T8 PolarHBondContact O-N 3.04Å; P5-I9 HydrophobicContact CB-CD1 4.18Å; P5-I9 WeakPolarHBondContact O-CG1 3.49Å; P5-I9 PolarHBondContact O-N 3.38Å |
| 6 | Y | 97.6 | Very high | 97.2 | Very high | 139 Ų | 139 | 100.4 Ų | 100.4 | 55% | 0.545 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.7 | -54.9 | -164.8 | -62.2 | -79.1 | 0 | 0 | 0 | 114.4 | I1 F3 K10 | I1-Y6 HydrophobicContact CB-CD2 4.06Å; I1-Y6 HydrophobicContact CB-CE2 4.37Å; I1-Y6 HydrophobicContact CD1-CD2 4.44Å; I1-Y6 HydrophobicContact CD1-CG 4.13Å; I1-Y6 HydrophobicContact CG2-CE2 4.49Å; F3-Y6 PolarHBondContact O-N 2.79Å; Y6-K10 PolarHBondContact O-N 2.88Å |
| 7 | Y | 97.9 | Very high | 97.3 | Very high | 99 Ų | 99 | 100.2 Ų | 100.2 | 39% | 0.388 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -76.5 | -30.7 | 179.5 | -70.9 | -78.9 | 0 | 0 | 0 | 111.6 | I1 F3 I9 K10 D11 | I1-Y7 HydrophobicContact CD1-CD2 4.26Å; I1-Y7 HydrophobicContact CD1-CE2 3.58Å; I1-Y7 HydrophobicContact CG1-CE2 3.93Å; F3-Y7 HydrophobicContact CD2-CD2 4.04Å; F3-Y7 HydrophobicContact CD2-CG 4.05Å; F3-Y7 VanDerWaalsContact CE2-CB 3.42Å; F3-Y7 HydrophobicContact CE2-CG 4.11Å; F3-Y7 PolarHBondContact O-N 3.24Å; Y7-I9 PolarHBondContact O-N 2.98Å; Y7-K10 HydrophobicContact CD1-CD 4.35Å; Y7-K10 PolarHBondContact O-N 2.96Å; Y7-D11 VanDerWaalsContact O-CB 3.31Å; Y7-D11 WeakPolarHBondContact O-CB 3.43Å; Y7-D11 PolarHBondContact O-N 2.95Å |
| 8 | T | 98 | Very high | 97.4 | Very high | 55 Ų | 55 | 102.1 Ų | 102.1 | 34% | 0.337 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -57.9 | -46.4 | 175.1 | -45.9 | 0 | 0 | 0 | 0 | 112.1 | H4 P5 A12 | H4-T8 PolarHBondContact ND1-OG1 3.25Å; P5-T8 PolarHBondContact O-N 3.04Å; T8-A12 WeakPolarHBondContact O-CB 3.42Å; T8-A12 PolarHBondContact O-N 3.31Å |
| 9 | I | 98.3 | Very high | 97.4 | Very high | 117 Ų | 117 | 100.9 Ų | 100.9 | 60% | 0.6 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -68.4 | -40.7 | 178.4 | -66.5 | 169.1 | 0 | 0 | 0 | 110.8 | P5 Y7 A12 L13 | P5-I9 HydrophobicContact CB-CD1 4.18Å; P5-I9 WeakPolarHBondContact O-CG1 3.49Å; P5-I9 PolarHBondContact O-N 3.38Å; Y7-I9 PolarHBondContact O-N 2.98Å; I9-A12 PolarHBondContact O-N 3.26Å; I9-L13 PolarHBondContact O-N 3.36Å |
| 10 | K | 98.1 | Very high | 97.5 | Very high | 138 Ų | 138 | 101.1 Ų | 101.1 | 60% | 0.6 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -61.5 | -44.8 | 176.9 | -176.7 | -175.8 | 173.4 | -173.2 | 0 | 111.9 | Y6 Y7 L13 G14 | Y6-K10 PolarHBondContact O-N 2.88Å; Y7-K10 HydrophobicContact CD1-CD 4.35Å; Y7-K10 PolarHBondContact O-N 2.96Å; K10-L13 PolarHBondContact O-N 2.92Å; K10-G14 PolarHBondContact O-N 3.23Å |
| 11 | D | 98.2 | Very high | 97.5 | Very high | 85 Ų | 85 | 99.3 Ų | 99.3 | 46% | 0.455 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -68.9 | -39.3 | -179.5 | -67 | -8.9 | 0 | 0 | 0 | 110.7 | Y7 L13 G14 L15 | Y7-D11 VanDerWaalsContact O-CB 3.31Å; Y7-D11 WeakPolarHBondContact O-CB 3.43Å; Y7-D11 PolarHBondContact O-N 2.95Å; D11-L13 VanDerWaalsContact C-N 3.33Å; D11-L13 PolarHBondContact O-N 3.37Å; D11-G14 PolarHBondContact O-N 3.44Å; D11-L15 WeakPolarHBondContact O-CB 3.42Å; D11-L15 PolarHBondContact O-N 3.05Å |
| 12 | A | 98.4 | Very high | 97.9 | Very high | 56 Ų | 56 | 95.8 Ų | 95.8 | 46% | 0.463 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.3 | -41.8 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | T8 I9 L15 L16 | T8-A12 WeakPolarHBondContact O-CB 3.42Å; T8-A12 PolarHBondContact O-N 3.31Å; I9-A12 PolarHBondContact O-N 3.26Å; A12-L15 PolarHBondContact O-N 3.39Å; A12-L16 WeakPolarHBondContact O-CB 3.35Å; A12-L16 PolarHBondContact O-N 2.93Å |
| 13 | L | 98.6 | Very high | 98 | Very high | 106 Ų | 106 | 95.4 Ų | 95.4 | 56% | 0.555 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -63 | -45.1 | 173.3 | 178.7 | 65.1 | 0 | 0 | 0 | 111.5 | I9 K10 D11 L15 L16 L17 | I9-L13 PolarHBondContact O-N 3.36Å; K10-L13 PolarHBondContact O-N 2.92Å; D11-L13 VanDerWaalsContact C-N 3.33Å; D11-L13 PolarHBondContact O-N 3.37Å; L13-L15 VanDerWaalsContact C-N 3.34Å; L13-L15 PolarHBondContact O-N 3Å; L13-L16 PolarHBondContact O-N 3.2Å; L13-L17 HydrophobicContact CG-CD1 4.49Å; L13-L17 WeakPolarHBondContact O-CG 3.33Å; L13-L17 PolarHBondContact O-N 3.22Å |
| 14 | G | 98.4 | Very high | 98.1 | Very high | 39 Ų | 39 | 92.4 Ų | 92.4 | 40% | 0.402 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -59.9 | -42.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | K10 D11 L17 F18 | K10-G14 PolarHBondContact O-N 3.23Å; D11-G14 PolarHBondContact O-N 3.44Å; G14-L17 PolarHBondContact O-N 3.43Å; G14-F18 PolarHBondContact O-N 3.07Å |
| 15 | L | 98.6 | Very high | 98.2 | Very high | 107 Ų | 107 | 88.6 Ų | 88.6 | 56% | 0.56 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -65.6 | -40.3 | 176.6 | -178.2 | 134.2 | 0 | 0 | 0 | 112 | D11 A12 L13 L17 F18 I19 | D11-L15 WeakPolarHBondContact O-CB 3.42Å; D11-L15 PolarHBondContact O-N 3.05Å; A12-L15 PolarHBondContact O-N 3.39Å; L13-L15 VanDerWaalsContact C-N 3.34Å; L13-L15 PolarHBondContact O-N 3Å; L15-L17 VanDerWaalsContact C-N 3.35Å; L15-L17 PolarHBondContact O-N 3.18Å; L15-F18 PolarHBondContact O-N 3.48Å; L15-I19 HydrophobicContact CD2-CD1 3.51Å; L15-I19 HydrophobicContact CD2-CG1 4.45Å; L15-I19 HydrophobicContact CG-CD1 4.09Å; L15-I19 WeakPolarHBondContact O-CG1 3.4Å; L15-I19 PolarHBondContact O-N 2.82Å |
| 16 | L | 98.7 | Very high | 98.3 | Very high | 107 Ų | 107 | 89.1 Ų | 89.1 | 56% | 0.56 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -61 | -43.8 | 175.4 | -176.3 | 147.1 | 0 | 0 | 0 | 111.5 | A12 L13 I19 L20 | A12-L16 WeakPolarHBondContact O-CB 3.35Å; A12-L16 PolarHBondContact O-N 2.93Å; L13-L16 PolarHBondContact O-N 3.2Å; L16-I19 PolarHBondContact O-N 2.95Å; L16-L20 WeakPolarHBondContact O-CB 3.34Å; L16-L20 PolarHBondContact O-N 2.88Å |
| 17 | L | 98.6 | Very high | 98.4 | Very high | 97 Ų | 97 | 88.1 Ų | 88.1 | 51% | 0.508 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -64.9 | -39.6 | 176.6 | -68.3 | 174.1 | 0 | 0 | 0 | 112.3 | L13 G14 L15 L20 S21 | L13-L17 HydrophobicContact CG-CD1 4.49Å; L13-L17 WeakPolarHBondContact O-CG 3.33Å; L13-L17 PolarHBondContact O-N 3.22Å; G14-L17 PolarHBondContact O-N 3.43Å; L15-L17 VanDerWaalsContact C-N 3.35Å; L15-L17 PolarHBondContact O-N 3.18Å; L17-L20 PolarHBondContact O-N 3.36Å; L17-S21 PolarHBondContact O-N 3.01Å; L17-S21 PolarHBondContact O-OG 3.49Å |
| 18 | F | 98.4 | Very high | 98.4 | Very high | 133 Ų | 133 | 91.6 Ų | 91.6 | 58% | 0.583 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -64.1 | -44.7 | 175 | 173.7 | -99.1 | 0 | 0 | 0 | 112.4 | G14 L15 L20 S21 L22 | G14-F18 PolarHBondContact O-N 3.07Å; L15-F18 PolarHBondContact O-N 3.48Å; F18-L20 VanDerWaalsContact C-N 3.31Å; F18-L20 PolarHBondContact O-N 3.45Å; F18-S21 PolarHBondContact O-N 3.49Å; F18-S21 PolarHBondContact O-OG 3.37Å; F18-L22 HydrophobicContact CE1-CD2 4.29Å; F18-L22 WeakPolarHBondContact O-CB 3.39Å; F18-L22 PolarHBondContact O-N 3.05Å |
| 19 | I | 98.6 | Very high | 98.4 | Very high | 81 Ų | 81 | 91 Ų | 91 | 42% | 0.415 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64 | -41.1 | 176.7 | -69.7 | 172.2 | 0 | 0 | 0 | 110.1 | L15 L16 S21 L22 M23 | L15-I19 HydrophobicContact CD2-CD1 3.51Å; L15-I19 HydrophobicContact CD2-CG1 4.45Å; L15-I19 HydrophobicContact CG-CD1 4.09Å; L15-I19 WeakPolarHBondContact O-CG1 3.4Å; L15-I19 PolarHBondContact O-N 2.82Å; L16-I19 PolarHBondContact O-N 2.95Å; I19-S21 PolarHBondContact O-N 3.48Å; I19-L22 PolarHBondContact O-N 3.43Å; I19-M23 HydrophobicContact CG2-CG 3.94Å; I19-M23 VanDerWaalsContact O-CB 3.29Å; I19-M23 WeakPolarHBondContact O-CB 3.35Å; I19-M23 WeakPolarHBondContact O-CG 3.42Å; I19-M23 PolarHBondContact O-N 3.47Å |
| 20 | L | 98.5 | Very high | 98.3 | Very high | 104 Ų | 104 | 89.2 Ų | 89.2 | 55% | 0.545 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -58.5 | -50.4 | 177.2 | -175.1 | 71.2 | 0 | 0 | 0 | 111.1 | L16 L17 F18 L22 M23 T24 | L16-L20 WeakPolarHBondContact O-CB 3.34Å; L16-L20 PolarHBondContact O-N 2.88Å; L17-L20 PolarHBondContact O-N 3.36Å; F18-L20 VanDerWaalsContact C-N 3.31Å; F18-L20 PolarHBondContact O-N 3.45Å; L20-L22 PolarHBondContact O-N 2.94Å; L20-M23 PolarHBondContact O-N 2.98Å; L20-T24 WeakPolarHBondContact O-CG2 3.31Å; L20-T24 PolarHBondContact O-N 3.18Å; L20-T24 PolarHBondContact O-OG1 3.44Å |
| 21 | S | 98.2 | Very high | 98.2 | Very high | 64 Ų | 64 | 87.3 Ų | 87.3 | 45% | 0.448 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -63.7 | -42.6 | 179.6 | 64.8 | 0 | 0 | 0 | 0 | 112.1 | L17 F18 I19 T24 L25 | L17-S21 PolarHBondContact O-N 3.01Å; L17-S21 PolarHBondContact O-OG 3.49Å; F18-S21 PolarHBondContact O-N 3.49Å; F18-S21 PolarHBondContact O-OG 3.37Å; I19-S21 PolarHBondContact O-N 3.48Å; S21-T24 WeakPolarHBondContact CA-OG1 3.32Å; S21-T24 PolarHBondContact O-N 3Å; S21-T24 PolarHBondContact O-OG1 3.37Å; S21-L25 PolarHBondContact O-N 3.05Å |
| 22 | L | 98.5 | Very high | 98.2 | Very high | 77 Ų | 77 | 89.1 Ų | 89.1 | 40% | 0.403 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.3 | -48.4 | 176.2 | -178.1 | 65.9 | 0 | 0 | 0 | 111.6 | F18 I19 L20 T24 L25 T26 | F18-L22 HydrophobicContact CE1-CD2 4.29Å; F18-L22 WeakPolarHBondContact O-CB 3.39Å; F18-L22 PolarHBondContact O-N 3.05Å; I19-L22 PolarHBondContact O-N 3.43Å; L20-L22 PolarHBondContact O-N 2.94Å; L22-T24 VanDerWaalsContact C-N 3.31Å; L22-T24 PolarHBondContact O-N 3.46Å; L22-L25 PolarHBondContact O-N 2.86Å; L22-T26 HydrophobicContact CD1-CG2 4.24Å; L22-T26 HydrophobicContact CG-CG2 4.47Å; L22-T26 WeakPolarHBondContact O-CG2 3.42Å; L22-T26 PolarHBondContact O-N 3.44Å; L22-T26 PolarHBondContact O-OG1 3Å |
| 23 | M | 98.4 | Very high | 98.1 | Very high | 88 Ų | 88 | 90.8 Ų | 90.8 | 43% | 0.433 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.8 | -36.2 | 179.5 | -70.4 | -59.8 | -73.5 | 0 | 0 | 111.8 | I19 L20 T26 L27 | I19-M23 HydrophobicContact CG2-CG 3.94Å; I19-M23 VanDerWaalsContact O-CB 3.29Å; I19-M23 WeakPolarHBondContact O-CB 3.35Å; I19-M23 WeakPolarHBondContact O-CG 3.42Å; I19-M23 PolarHBondContact O-N 3.47Å; L20-M23 PolarHBondContact O-N 2.98Å; M23-T26 WeakPolarHBondContact CA-OG1 3.46Å; M23-T26 PolarHBondContact O-OG1 3.47Å; M23-L27 HydrophobicContact CE-CD1 3.7Å; M23-L27 HydrophobicContact CE-CD2 4.46Å; M23-L27 HydrophobicContact CE-CG 4.12Å; M23-L27 VanDerWaalsContact O-CB 3.22Å; M23-L27 WeakPolarHBondContact O-CB 3.41Å; M23-L27 VanDerWaalsContact O-CG 3.31Å; M23-L27 WeakPolarHBondContact O-CG 3.45Å; M23-L27 PolarHBondContact O-N 3Å |
| 24 | T | 98.3 | Very high | 97.9 | Very high | 65 Ų | 65 | 88 Ų | 88 | 40% | 0.399 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63.9 | -42.2 | 174.4 | 54 | 0 | 0 | 0 | 0 | 112 | L20 S21 L22 F28 | L20-T24 WeakPolarHBondContact O-CG2 3.31Å; L20-T24 PolarHBondContact O-N 3.18Å; L20-T24 PolarHBondContact O-OG1 3.44Å; S21-T24 WeakPolarHBondContact CA-OG1 3.32Å; S21-T24 PolarHBondContact O-N 3Å; S21-T24 PolarHBondContact O-OG1 3.37Å; L22-T24 VanDerWaalsContact C-N 3.31Å; L22-T24 PolarHBondContact O-N 3.46Å; T24-F28 WeakPolarHBondContact O-CB 3.48Å; T24-F28 WeakPolarHBondContact O-CD2 3.37Å; T24-F28 PolarHBondContact O-N 2.79Å; T24-F28 VanDerWaalsContact O-N 3.12Å |
| 25 | L | 98.4 | Very high | 97.7 | Very high | 49 Ų | 49 | 87.4 Ų | 87.4 | 26% | 0.257 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -63.6 | -50.4 | 176.7 | -178.2 | 73.3 | 0 | 0 | 0 | 110.9 | S21 L22 S29 P30 L32 L33 | S21-L25 PolarHBondContact O-N 3.05Å; L22-L25 PolarHBondContact O-N 2.86Å; L25-S29 CarbonylContact O-C 3.59Å; L25-S29 WeakPolarHBondContact O-CA 3.41Å; L25-S29 PolarHBondContact O-N 3.22Å; L25-S29 VanDerWaalsContact O-O 3.05Å; L25-S29 PolarHBondContact O-OG 3.06Å; L25-P30 VanDerWaalsContact O-N 3.14Å; L25-L32 HydrophobicContact CD1-CB 4.09Å; L25-L32 HydrophobicContact CD1-CD2 3.98Å; L25-L33 HydrophobicContact CD1-CD1 4.35Å; L25-L33 HydrophobicContact CD1-CG 4.27Å; L25-L33 HydrophobicContact CD2-CD1 3.74Å; L25-L33 HydrophobicContact CD2-CG 4.42Å |
| 26 | T | 98.1 | Very high | 97.5 | Very high | 66 Ų | 66 | 86.8 Ų | 86.8 | 41% | 0.405 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -72.1 | -36 | -173.4 | 57.2 | 0 | 0 | 0 | 0 | 113.5 | L22 M23 | L22-T26 HydrophobicContact CD1-CG2 4.24Å; L22-T26 HydrophobicContact CG-CG2 4.47Å; L22-T26 WeakPolarHBondContact O-CG2 3.42Å; L22-T26 PolarHBondContact O-N 3.44Å; L22-T26 PolarHBondContact O-OG1 3Å; M23-T26 WeakPolarHBondContact CA-OG1 3.46Å; M23-T26 PolarHBondContact O-OG1 3.47Å |
| 27 | L | 98.3 | Very high | 97.3 | Very high | 118 Ų | 118 | 84.5 Ų | 84.5 | 62% | 0.618 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -84.7 | -35.3 | -177.4 | -64.8 | 179.2 | 0 | 0 | 0 | 113.3 | M23 | M23-L27 HydrophobicContact CE-CD1 3.7Å; M23-L27 HydrophobicContact CE-CD2 4.46Å; M23-L27 HydrophobicContact CE-CG 4.12Å; M23-L27 VanDerWaalsContact O-CB 3.22Å; M23-L27 WeakPolarHBondContact O-CB 3.41Å; M23-L27 VanDerWaalsContact O-CG 3.31Å; M23-L27 WeakPolarHBondContact O-CG 3.45Å; M23-L27 PolarHBondContact O-N 3Å |
| 28 | F | 98.3 | Very high | 97.1 | Very high | 171 Ų | 171 | 85.9 Ų | 85.9 | 75% | 0.75 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -103.2 | -27.1 | -175.3 | -62.1 | -71 | 0 | 0 | 0 | 113.9 | T24 | T24-F28 WeakPolarHBondContact O-CB 3.48Å; T24-F28 WeakPolarHBondContact O-CD2 3.37Å; T24-F28 PolarHBondContact O-N 2.79Å; T24-F28 VanDerWaalsContact O-N 3.12Å |
| 29 | S | 97.8 | Very high | 96.9 | Very high | 42 Ų | 42 | 87.1 Ų | 87.1 | 29% | 0.294 | 48% | 0.476 | S | S | . | . | trans | -150.3 | 60 | -174.7 | 66.2 | 0 | 0 | 0 | 0 | 112.6 | L25 D31 L32 | L25-S29 CarbonylContact O-C 3.59Å; L25-S29 WeakPolarHBondContact O-CA 3.41Å; L25-S29 PolarHBondContact O-N 3.22Å; L25-S29 VanDerWaalsContact O-O 3.05Å; L25-S29 PolarHBondContact O-OG 3.06Å; S29-D31 PolarHBondContact O-N 3.03Å; S29-L32 VanDerWaalsContact O-CB 3.29Å; S29-L32 WeakPolarHBondContact O-CB 3.49Å; S29-L32 PolarHBondContact O-N 3.39Å | ||
| 30 | P | 96.6 | Very high | 96.7 | Very high | 81 Ų | 81 | 87.9 Ų | 87.9 | 53% | 0.526 | 48% | 0.484 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.9 | -33.5 | -170.5 | 22.5 | -33.6 | 0 | 0 | 0 | 113.4 | L25 | L25-P30 VanDerWaalsContact O-N 3.14Š|
| 31 | D | 96.6 | Very high | 96.5 | Very high | 98 Ų | 98 | 91 Ų | 91 | 52% | 0.524 | 50% | 0.501 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.1 | 4.1 | -174.1 | -52 | -32.4 | 0 | 0 | 0 | 112.9 | S29 L33 G34 Y39 | S29-D31 PolarHBondContact O-N 3.03Å; D31-L33 PolarHBondContact O-N 3.4Å; D31-L33 VanDerWaalsContact O-N 3.16Å; D31-G34 PolarHBondContact O-N 2.72Å; D31-Y39 PolarHBondContact OD1-OH 3.29Å |
| 32 | L | 97.2 | Very high | 96.3 | Very high | 123 Ų | 123 | 92.9 Ų | 92.9 | 64% | 0.644 | 52% | 0.52 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.7 | -33.9 | -175 | -178.6 | 65 | 0 | 0 | 0 | 113.3 | L25 S29 | L25-L32 HydrophobicContact CD1-CB 4.09Å; L25-L32 HydrophobicContact CD1-CD2 3.98Å; S29-L32 VanDerWaalsContact O-CB 3.29Å; S29-L32 WeakPolarHBondContact O-CB 3.49Å; S29-L32 PolarHBondContact O-N 3.39Å |
| 33 | L | 96.9 | Very high | 96.2 | Very high | 90 Ų | 90 | 93.4 Ų | 93.4 | 47% | 0.471 | 52% | 0.523 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -101.8 | 1.7 | -179.3 | -60.4 | -178.1 | 0 | 0 | 0 | 113.1 | L25 D31 W55 | L25-L33 HydrophobicContact CD1-CD1 4.35Å; L25-L33 HydrophobicContact CD1-CG 4.27Å; L25-L33 HydrophobicContact CD2-CD1 3.74Å; L25-L33 HydrophobicContact CD2-CG 4.42Å; D31-L33 PolarHBondContact O-N 3.4Å; D31-L33 VanDerWaalsContact O-N 3.16Å; L33-W55 HydrophobicContact CD1-CZ2 4.18Å |
| 34 | G | 94.9 | Very high | 96 | Very high | 48 Ų | 48 | 95.4 Ų | 95.4 | 50% | 0.495 | 54% | 0.543 | S | S | . | . | S | Bend | trans | -89.3 | 168.9 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | D31 | D31-G34 PolarHBondContact O-N 2.72Š|
| 35 | D | 94.9 | Very high | 95.9 | Very high | 27 Ų | 27 | 100.1 Ų | 100.1 | 14% | 0.144 | 57% | 0.565 | C | S | . | * | trans | -106.6 | 124.2 | 171.7 | -161.7 | -53 | 0 | 0 | 0 | 110 | D37 N38 K52 | D35-D37 PolarHBondContact O-N 3.29Å; D35-D37 WeakPolarHBondContact OD1-CB 3.49Å; D35-D37 PolarHBondContact OD1-N 2.86Å; D35-N38 WeakPolarHBondContact O-CB 3.47Å; D35-N38 PolarHBondContact O-N 2.84Å; D35-K52 WeakPolarHBondContact OD2-CE 3.31Å; D35-K52 WeakPolarHBondContact OD2-CG 3.38Å | ||
| 36 | P | 94.1 | Very high | 95.7 | Very high | 94 Ų | 94 | 102.8 Ų | 102.8 | 61% | 0.61 | 58% | 0.579 | S | S | * | * | G | 310 helix | trans | -60.7 | -26.4 | 179.4 | 25.3 | -35.5 | 0 | 0 | 0 | 113.6 | N38 Y39 | P36-N38 PolarHBondContact O-N 3.04Å; P36-Y39 PolarHBondContact O-N 3.11Å |
| 37 | D | 92.8 | Very high | 95.3 | Very high | 59 Ų | 59 | 104.8 Ų | 104.8 | 32% | 0.316 | 59% | 0.592 | S | S | . | * | G | 310 helix | trans | -63.2 | -26.2 | 179.5 | -74.7 | -12.1 | 0 | 0 | 0 | 111.6 | D35 Y39 T40 P48 | D35-D37 PolarHBondContact O-N 3.29Å; D35-D37 WeakPolarHBondContact OD1-CB 3.49Å; D35-D37 PolarHBondContact OD1-N 2.86Å; D37-Y39 PolarHBondContact O-N 3.34Å; D37-T40 PolarHBondContact O-N 3.49Å; D37-T40 VanDerWaalsContact O-N 3.11Å; D37-T40 PolarHBondContact O-OG1 2.94Å; D37-P48 WeakPolarHBondContact OD2-CB 3.48Å |
| 38 | N | 95.1 | Very high | 95.1 | Very high | 125 Ų | 125 | 101.2 Ų | 101.2 | 67% | 0.668 | 58% | 0.575 | S | S | * | * | G | 310 helix | trans | -72.6 | -9.6 | 179 | -74.8 | -19 | 0 | 0 | 0 | 114.4 | D35 P36 T40 | D35-N38 WeakPolarHBondContact O-CB 3.47Å; D35-N38 PolarHBondContact O-N 2.84Å; P36-N38 PolarHBondContact O-N 3.04Å; N38-T40 VanDerWaalsContact C-N 3.29Å |
| 39 | Y | 94.9 | Very high | 94.7 | Very high | 159 Ų | 159 | 98.9 Ų | 98.9 | 62% | 0.624 | 58% | 0.577 | S | S | * | * | G | 310 helix | trans | -81.9 | -10.3 | 170.3 | -66.4 | -85.4 | 0 | 0 | 0 | 112.7 | D31 P36 D37 | D31-Y39 PolarHBondContact OD1-OH 3.29Å; P36-Y39 PolarHBondContact O-N 3.11Å; D37-Y39 PolarHBondContact O-N 3.34Å |
| 40 | T | 94.1 | Very high | 94.4 | Very high | 97 Ų | 97 | 104.4 Ų | 104.4 | 60% | 0.595 | 60% | 0.598 | S | S | * | * | S | Bend | trans | -86.6 | 145 | 172.8 | 69.3 | 0 | 0 | 0 | 0 | 110.6 | D37 N38 | D37-T40 PolarHBondContact O-N 3.49Å; D37-T40 VanDerWaalsContact O-N 3.11Å; D37-T40 PolarHBondContact O-OG1 2.94Å; N38-T40 VanDerWaalsContact C-N 3.29Å |
| 41 | L | 94.4 | Very high | 94.2 | Very high | 170 Ų | 170 | 105.1 Ų | 105.1 | 89% | 0.89 | 60% | 0.596 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 141 | 177.3 | -68.2 | 173.4 | 0 | 0 | 0 | 110.4 | N43 | L41-N43 PolarHBondContact O-N 3.01Š|
| 42 | A | 94.3 | Very high | 94.1 | Very high | 103 Ų | 103 | 106.2 Ų | 106.2 | 85% | 0.851 | 60% | 0.597 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 128.5 | -179 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||
| 43 | N | 95.8 | Very high | 94 | Very high | 88 Ų | 88 | 102 Ų | 102 | 47% | 0.471 | 58% | 0.576 | S | S | . | * | trans | -119.8 | 106.3 | 173.6 | -176.4 | -8.5 | 0 | 0 | 0 | 109.9 | L41 L45 N46 | L41-N43 PolarHBondContact O-N 3.01Å; N43-L45 PolarHBondContact O-N 2.94Å; N43-L45 VanDerWaalsContact O-N 3.13Å; N43-L45 PolarHBondContact OD1-N 3.26Å; N43-N46 HydrophobicContact CB-CB 4.42Å; N43-N46 PolarHBondContact O-N 3.1Å | ||
| 44 | P | 94.6 | Very high | 94 | Very high | 130 Ų | 130 | 101.8 Ų | 101.8 | 84% | 0.844 | 57% | 0.573 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.3 | -14.9 | -176.8 | 28 | -35 | 0 | 0 | 0 | 113.8 | ||
| 45 | L | 95.7 | Very high | 94.1 | Very high | 164 Ų | 164 | 106.4 Ų | 106.4 | 86% | 0.859 | 58% | 0.576 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.4 | -8.5 | -179.8 | -59 | 178.4 | 0 | 0 | 0 | 113.1 | N43 | N43-L45 PolarHBondContact O-N 2.94Å; N43-L45 VanDerWaalsContact O-N 3.13Å; N43-L45 PolarHBondContact OD1-N 3.26Å |
| 46 | N | 93.8 | Very high | 94.2 | Very high | 106 Ų | 106 | 110.6 Ų | 110.6 | 57% | 0.567 | 59% | 0.59 | S | S | * | * | trans | -138.4 | 119.3 | -176.2 | -172.2 | 27.4 | 0 | 0 | 0 | 111.8 | N43 | N43-N46 HydrophobicContact CB-CB 4.42Å; N43-N46 PolarHBondContact O-N 3.1Å | ||
| 47 | T | 91.3 | Very high | 94.3 | Very high | 108 Ų | 108 | 111.1 Ų | 111.1 | 66% | 0.663 | 58% | 0.583 | S | S | * | * | trans | -94.2 | 129.3 | 172.4 | 51.8 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 48 | P | 92.9 | Very high | 94.5 | Very high | 42 Ų | 42 | 111.3 Ų | 111.3 | 27% | 0.273 | 58% | 0.584 | S | S | . | * | trans | -56.3 | 141.5 | 174 | -25.8 | 34.4 | 0 | 0 | 0 | 112.2 | D37 H50 I51 | D37-P48 WeakPolarHBondContact OD2-CB 3.48Å; P48-H50 VanDerWaalsContact C-N 3.26Å; P48-H50 PolarHBondContact O-N 3.19Å; P48-I51 PolarHBondContact O-N 3.41Å | ||
| 49 | P | 89.8 | Confident | 94.6 | Very high | 122 Ų | 122 | 108.2 Ų | 108.2 | 79% | 0.792 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.4 | -26.3 | -177.1 | 26 | -34.3 | 0 | 0 | 0 | 113.5 | ||
| 50 | H | 92.1 | Very high | 94.7 | Very high | 158 Ų | 158 | 101 Ų | 101 | 73% | 0.731 | 54% | 0.538 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.3 | 25.1 | -178.3 | -62.5 | -62.2 | 0 | 0 | 0 | 113.4 | P48 K52 | P48-H50 VanDerWaalsContact C-N 3.26Å; P48-H50 PolarHBondContact O-N 3.19Å; H50-K52 PolarHBondContact O-N 2.95Å |
| 51 | I | 93 | Very high | 94.8 | Very high | 96 Ų | 96 | 98.9 Ų | 98.9 | 49% | 0.492 | 52% | 0.519 | S | S | . | . | trans | -56 | 123.8 | -178.2 | -167.3 | 170.5 | 0 | 0 | 0 | 112.1 | P48 Y61 | P48-I51 PolarHBondContact O-N 3.41Å; I51-Y61 PolarHBondContact O-OH 3.12Å | ||
| 52 | K | 93.3 | Very high | 94.9 | Very high | 122 Ų | 122 | 93.1 Ų | 93.1 | 53% | 0.53 | 49% | 0.491 | S | S | . | . | trans | -138.7 | 154.4 | 176.7 | 63.1 | -178.9 | 179.2 | 179.6 | 0 | 109.1 | D35 H50 | D35-K52 WeakPolarHBondContact OD2-CE 3.31Å; D35-K52 WeakPolarHBondContact OD2-CG 3.38Å; H50-K52 PolarHBondContact O-N 2.95Å | ||
| 53 | P | 96.3 | Very high | 95 | Very high | 33 Ų | 33 | 89.8 Ų | 89.8 | 21% | 0.214 | 46% | 0.459 | C | S | . | . | trans | -77 | 174.1 | 172 | 35.7 | -36.9 | 0 | 0 | 0 | 110.8 | F57 L58 Y61 | P53-F57 HydrophobicContact CB-CB 4.01Å; P53-F57 HydrophobicContact CG-CB 4.35Å; P53-L58 HydrophobicContact CG-CD2 3.95Å; P53-Y61 HydrophobicContact CG-CD1 4.08Å; P53-Y61 HydrophobicContact CG-CD2 4.13Å; P53-Y61 HydrophobicContact CG-CG 3.79Å | ||
| 54 | E | 96.6 | Very high | 95 | Very high | 87 Ų | 87 | 88.3 Ų | 88.3 | 41% | 0.407 | 45% | 0.451 | S | S | . | . | trans | -60.5 | 153.4 | 170.8 | -56.9 | 88.6 | 161.3 | 0 | 0 | 111.4 | Y56 F57 | E54-Y56 VanDerWaalsContact C-N 3.27Å; E54-Y56 HydrophobicContact CB-CD1 4.32Å; E54-Y56 HydrophobicContact CB-CE1 3.75Å; E54-Y56 HydrophobicContact CB-CE2 4.01Å; E54-Y56 HydrophobicContact CG-CE1 4.44Å; E54-Y56 PolarHBondContact O-N 3.47Å; E54-Y56 VanDerWaalsContact O-N 3.14Å; E54-F57 HydrophobicContact CB-CD2 4.42Å; E54-F57 PolarHBondContact O-N 2.97Å; E54-F57 WeakPolarHBondContact OE2-CD2 3.18Å | ||
| 55 | W | 96.6 | Very high | 95.1 | Very high | 144 Ų | 144 | 90.1 Ų | 90.1 | 55% | 0.545 | 44% | 0.44 | S | S | . | . | G | 310 helix | trans | -56.1 | -36.8 | -169.7 | 58.9 | -90.9 | 0 | 0 | 0 | 114.1 | L33 F57 L58 | L33-W55 HydrophobicContact CD1-CZ2 4.18Å; W55-F57 PolarHBondContact O-N 3.05Å; W55-L58 HydrophobicContact CB-CD1 4.32Å; W55-L58 WeakPolarHBondContact O-CB 3.22Å; W55-L58 WeakPolarHBondContact O-CG 3.5Å; W55-L58 PolarHBondContact O-N 3.36Å |
| 56 | Y | 96.3 | Very high | 95.1 | Very high | 115 Ų | 115 | 86.3 Ų | 86.3 | 45% | 0.451 | 43% | 0.428 | S | S | . | . | G | 310 helix | trans | -73.6 | -10.1 | 179.3 | 47.1 | -98.3 | 0 | 0 | 0 | 114 | E54 | E54-Y56 VanDerWaalsContact C-N 3.27Å; E54-Y56 HydrophobicContact CB-CD1 4.32Å; E54-Y56 HydrophobicContact CB-CE1 3.75Å; E54-Y56 HydrophobicContact CB-CE2 4.01Å; E54-Y56 HydrophobicContact CG-CE1 4.44Å; E54-Y56 PolarHBondContact O-N 3.47Å; E54-Y56 VanDerWaalsContact O-N 3.14Å |
| 57 | F | 96.9 | Very high | 95.3 | Very high | 106 Ų | 106 | 83.6 Ų | 83.6 | 47% | 0.465 | 42% | 0.415 | S | S | . | . | G | 310 helix | trans | -101.1 | -4.7 | 174 | -70.9 | -50.6 | 0 | 0 | 0 | 113.8 | P53 E54 W55 F59 A60 Y61 | P53-F57 HydrophobicContact CB-CB 4.01Å; P53-F57 HydrophobicContact CG-CB 4.35Å; E54-F57 HydrophobicContact CB-CD2 4.42Å; E54-F57 PolarHBondContact O-N 2.97Å; E54-F57 WeakPolarHBondContact OE2-CD2 3.18Å; W55-F57 PolarHBondContact O-N 3.05Å; F57-F59 PolarHBondContact O-N 3.38Å; F57-A60 PolarHBondContact O-N 3.22Å; F57-Y61 WeakPolarHBondContact O-CB 3.46Å; F57-Y61 PolarHBondContact O-N 2.71Å |
| 58 | L | 96.9 | Very high | 95.5 | Very high | 62 Ų | 62 | 85 Ų | 85 | 33% | 0.325 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -58.1 | -45.6 | -174.8 | -71.7 | 172.1 | 0 | 0 | 0 | 112.6 | P53 W55 A60 Y61 T62 | P53-L58 HydrophobicContact CG-CD2 3.95Å; W55-L58 HydrophobicContact CB-CD1 4.32Å; W55-L58 WeakPolarHBondContact O-CB 3.22Å; W55-L58 WeakPolarHBondContact O-CG 3.5Å; W55-L58 PolarHBondContact O-N 3.36Å; L58-A60 VanDerWaalsContact C-N 3.31Å; L58-A60 PolarHBondContact O-N 3.26Å; L58-Y61 CarbonylContact O-C 2.88Å; L58-Y61 WeakPolarHBondContact O-CB 3.29Å; L58-Y61 PolarHBondContact O-N 3.32Å; L58-Y61 VanDerWaalsContact O-N 3.08Å; L58-T62 WeakPolarHBondContact O-CG2 3.39Å; L58-T62 PolarHBondContact O-N 3.44Å; L58-T62 PolarHBondContact O-OG1 2.93Å |
| 59 | F | 97.3 | Very high | 95.7 | Very high | 61 Ų | 61 | 87.5 Ų | 87.5 | 27% | 0.268 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -58.3 | -41.1 | 179.9 | 84.5 | -82.7 | 0 | 0 | 0 | 113 | F57 T62 I63 L115 L118 | F57-F59 PolarHBondContact O-N 3.38Å; F59-T62 WeakPolarHBondContact CA-OG1 3.37Å; F59-T62 PolarHBondContact O-OG1 3.47Å; F59-I63 HydrophobicContact CD2-CD1 4.23Å; F59-I63 WeakPolarHBondContact O-CD1 3.37Å; F59-I63 VanDerWaalsContact O-CG1 3.25Å; F59-I63 WeakPolarHBondContact O-CG1 3.38Å; F59-I63 PolarHBondContact O-N 3.41Å; F59-I63 VanDerWaalsContact O-N 3.16Å; F59-L115 HydrophobicContact CD2-CD2 4.05Å; F59-L115 HydrophobicContact CG-CD2 4.48Å; F59-L118 HydrophobicContact CB-CB 3.92Å |
| 60 | A | 95.9 | Very high | 95.9 | Very high | 8 Ų | 8 | 90.9 Ų | 90.9 | 7% | 0.066 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -72.8 | -35.2 | 179.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | F57 L58 L64 L77 | F57-A60 PolarHBondContact O-N 3.22Å; L58-A60 VanDerWaalsContact C-N 3.31Å; L58-A60 PolarHBondContact O-N 3.26Å; A60-L64 WeakPolarHBondContact O-CB 3.29Å; A60-L64 PolarHBondContact O-N 2.83Å; A60-L77 HydrophobicContact CB-CD1 4.27Å; A60-L77 HydrophobicContact CB-CG 4.38Å |
| 61 | Y | 96.4 | Very high | 96.1 | Very high | 52 Ų | 52 | 89.1 Ų | 89.1 | 20% | 0.204 | 43% | 0.434 | C | S | . | . | H | α-helix | trans | -69.2 | -38.4 | 177.1 | 174.6 | -105.1 | 0 | 0 | 0 | 113 | I51 P53 F57 L58 L64 R65 | I51-Y61 PolarHBondContact O-OH 3.12Å; P53-Y61 HydrophobicContact CG-CD1 4.08Å; P53-Y61 HydrophobicContact CG-CD2 4.13Å; P53-Y61 HydrophobicContact CG-CG 3.79Å; F57-Y61 WeakPolarHBondContact O-CB 3.46Å; F57-Y61 PolarHBondContact O-N 2.71Å; L58-Y61 CarbonylContact O-C 2.88Å; L58-Y61 WeakPolarHBondContact O-CB 3.29Å; L58-Y61 PolarHBondContact O-N 3.32Å; L58-Y61 VanDerWaalsContact O-N 3.08Å; Y61-L64 WeakPolarHBondContact O-CB 3.37Å; Y61-L64 PolarHBondContact O-N 3.49Å; Y61-R65 PolarHBondContact O-N 3.39Å; Y61-R65 PolarHBondContact OH-NE 2.96Å; Y61-R65 PolarHBondContact OH-NH1 3.3Å; Y61-R65 PolarHBondContact OH-NH2 2.96Å |
| 62 | T | 96.6 | Very high | 96.3 | Very high | 49 Ų | 49 | 85.6 Ų | 85.6 | 30% | 0.301 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -67.7 | -41 | 174.4 | 51.5 | 0 | 0 | 0 | 0 | 111.2 | L58 F59 L64 R65 S66 L118 | L58-T62 WeakPolarHBondContact O-CG2 3.39Å; L58-T62 PolarHBondContact O-N 3.44Å; L58-T62 PolarHBondContact O-OG1 2.93Å; F59-T62 WeakPolarHBondContact CA-OG1 3.37Å; F59-T62 PolarHBondContact O-OG1 3.47Å; T62-L64 PolarHBondContact O-N 3.5Å; T62-R65 PolarHBondContact O-N 3.4Å; T62-S66 WeakPolarHBondContact O-CB 3.42Å; T62-S66 PolarHBondContact O-N 3.04Å; T62-L118 VanDerWaalsContact CB-O 3.31Å; T62-L118 WeakPolarHBondContact CB-O 3.35Å; T62-L118 WeakPolarHBondContact CG2-O 3.41Å; T62-L118 PolarHBondContact OG1-O 3.13Å |
| 63 | I | 96.8 | Very high | 96.5 | Very high | 33 Ų | 33 | 79.9 Ų | 79.9 | 17% | 0.169 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -57.2 | -48.6 | 170.1 | -68 | 167 | 0 | 0 | 0 | 111 | F59 R65 S66 A76 L118 | F59-I63 HydrophobicContact CD2-CD1 4.23Å; F59-I63 WeakPolarHBondContact O-CD1 3.37Å; F59-I63 VanDerWaalsContact O-CG1 3.25Å; F59-I63 WeakPolarHBondContact O-CG1 3.38Å; F59-I63 PolarHBondContact O-N 3.41Å; F59-I63 VanDerWaalsContact O-N 3.16Å; I63-R65 VanDerWaalsContact C-N 3.33Å; I63-R65 PolarHBondContact O-N 2.9Å; I63-S66 PolarHBondContact O-N 3.24Å; I63-S66 PolarHBondContact O-OG 3.14Å; I63-A76 HydrophobicContact CG2-CB 3.97Å; I63-L118 HydrophobicContact CD1-CD1 4.21Å; I63-L118 HydrophobicContact CG1-CD1 4.22Å; I63-L118 HydrophobicContact CG1-CD2 4.34Å |
| 64 | L | 96.5 | Very high | 96.6 | Very high | 57 Ų | 57 | 81.9 Ų | 81.9 | 30% | 0.298 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -56.9 | -44.2 | 178.6 | 179 | 69.3 | 0 | 0 | 0 | 112.3 | A60 Y61 T62 G73 V74 L77 | A60-L64 WeakPolarHBondContact O-CB 3.29Å; A60-L64 PolarHBondContact O-N 2.83Å; Y61-L64 WeakPolarHBondContact O-CB 3.37Å; Y61-L64 PolarHBondContact O-N 3.49Å; T62-L64 PolarHBondContact O-N 3.5Å; L64-G73 WeakPolarHBondContact CD1-O 2.93Å; L64-V74 HydrophobicContact CD1-CG2 4.32Å; L64-L77 HydrophobicContact CB-CD1 4.12Å; L64-L77 HydrophobicContact CD1-CB 4.38Å; L64-L77 HydrophobicContact CD1-CD1 4.43Å; L64-L77 HydrophobicContact CD2-CD1 4.3Å |
| 65 | R | 95.5 | Very high | 96.6 | Very high | 167 Ų | 167 | 81.9 Ų | 81.9 | 63% | 0.63 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -77.8 | -21.5 | -178.4 | -77 | -174.6 | 161.3 | -171.5 | -3.5 | 114.2 | Y61 T62 I63 V67 | Y61-R65 PolarHBondContact O-N 3.39Å; Y61-R65 PolarHBondContact OH-NE 2.96Å; Y61-R65 PolarHBondContact OH-NH1 3.3Å; Y61-R65 PolarHBondContact OH-NH2 2.96Å; T62-R65 PolarHBondContact O-N 3.4Å; I63-R65 VanDerWaalsContact C-N 3.33Å; I63-R65 PolarHBondContact O-N 2.9Å; R65-V67 PolarHBondContact O-N 3.28Å |
| 66 | S | 96.4 | Very high | 96.7 | Very high | 85 Ų | 85 | 76.3 Ų | 76.3 | 59% | 0.594 | 40% | 0.396 | S | S | * | . | H | α-helix | trans | -66.4 | -23 | 178.2 | 74 | 0 | 0 | 0 | 0 | 113.2 | T62 I63 P68 | T62-S66 WeakPolarHBondContact O-CB 3.42Å; T62-S66 PolarHBondContact O-N 3.04Å; I63-S66 PolarHBondContact O-N 3.24Å; I63-S66 PolarHBondContact O-OG 3.14Å; S66-P68 WeakPolarHBondContact O-CD 3.4Å |
| 67 | V | 97.2 | Very high | 96.7 | Very high | 48 Ų | 48 | 73.1 Ų | 73.1 | 29% | 0.291 | 39% | 0.386 | S | S | . | . | S | Bend | trans | -98 | 113.6 | -178.8 | -175.5 | 0 | 0 | 0 | 0 | 109.8 | R65 N69 A76 | R65-V67 PolarHBondContact O-N 3.28Å; V67-N69 HydrophobicContact CG1-CB 4.13Å; V67-N69 PolarHBondContact O-N 2.93Å; V67-A76 HydrophobicContact CG2-CB 4.13Å |
| 68 | P | 96.4 | Very high | 96.7 | Very high | 139 Ų | 139 | 72.3 Ų | 72.3 | 90% | 0.903 | 39% | 0.387 | S | S | * | . | S | Bend | trans | -77.8 | 41.2 | -179.9 | 34.2 | -37.3 | 0 | 0 | 0 | 112.4 | S66 | S66-P68 WeakPolarHBondContact O-CD 3.4Š|
| 69 | N | 97.4 | Very high | 96.7 | Very high | 94 Ų | 94 | 74.5 Ų | 74.5 | 50% | 0.503 | 40% | 0.398 | S | S | . | . | S | Bend | trans | -143.8 | 130.8 | 176.8 | -176.5 | -72.4 | 0 | 0 | 0 | 109.8 | V67 L71 G72 G73 | V67-N69 HydrophobicContact CG1-CB 4.13Å; V67-N69 PolarHBondContact O-N 2.93Å; N69-L71 PolarHBondContact O-N 3.4Å; N69-L71 PolarHBondContact OD1-N 3.45Å; N69-G72 PolarHBondContact O-N 3.27Å; N69-G72 PolarHBondContact OD1-N 3.05Å; N69-G73 PolarHBondContact O-N 3.03Å |
| 70 | K | 93.7 | Very high | 96.6 | Very high | 193 Ų | 193 | 73 Ų | 73 | 84% | 0.839 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -59.7 | -48.1 | -176.8 | -172.5 | 177.2 | -177.4 | 178.4 | 0 | 113.1 | V74 | K70-V74 WeakPolarHBondContact O-CG2 3.34Å; K70-V74 PolarHBondContact O-N 3.29Å |
| 71 | L | 97.1 | Very high | 96.6 | Very high | 120 Ų | 120 | 77.1 Ų | 77.1 | 63% | 0.628 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -74.2 | -41.7 | -179.4 | -179 | 147.4 | 0 | 0 | 0 | 110.8 | N69 G73 V74 L75 | N69-L71 PolarHBondContact O-N 3.4Å; N69-L71 PolarHBondContact OD1-N 3.45Å; L71-G73 PolarHBondContact O-N 3.2Å; L71-V74 PolarHBondContact O-N 2.94Å; L71-L75 HydrophobicContact CD2-CD1 3.48Å; L71-L75 VanDerWaalsContact CD2-CD1 3.48Å; L71-L75 HydrophobicContact CD2-CG 4.11Å; L71-L75 HydrophobicContact CG-CD1 4.43Å; L71-L75 WeakPolarHBondContact O-CG 3.47Å; L71-L75 PolarHBondContact O-N 3.04Å |
| 72 | G | 97.4 | Very high | 96.6 | Very high | 22 Ų | 22 | 79.7 Ų | 79.7 | 23% | 0.227 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -60 | -44.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | N69 L75 A76 | N69-G72 PolarHBondContact O-N 3.27Å; N69-G72 PolarHBondContact OD1-N 3.05Å; G72-L75 PolarHBondContact O-N 3.35Å; G72-A76 WeakPolarHBondContact O-CB 2.98Å; G72-A76 PolarHBondContact O-N 3.16Å |
| 73 | G | 96.9 | Very high | 96.7 | Very high | 2 Ų | 2 | 81.5 Ų | 81.5 | 2% | 0.021 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -62.9 | -44.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | L64 N69 L71 L75 A76 L77 | L64-G73 WeakPolarHBondContact CD1-O 2.93Å; N69-G73 PolarHBondContact O-N 3.03Å; L71-G73 PolarHBondContact O-N 3.2Å; G73-L75 VanDerWaalsContact C-N 3.35Å; G73-L75 PolarHBondContact O-N 3.19Å; G73-A76 PolarHBondContact O-N 3.16Å; G73-L77 PolarHBondContact O-N 3.31Å |
| 74 | V | 97.3 | Very high | 96.6 | Very high | 75 Ų | 75 | 85.2 Ų | 85.2 | 46% | 0.455 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -63.4 | -42.3 | 178.1 | 173.7 | 0 | 0 | 0 | 0 | 111 | L64 K70 L71 L77 L78 | L64-V74 HydrophobicContact CD1-CG2 4.32Å; K70-V74 WeakPolarHBondContact O-CG2 3.34Å; K70-V74 PolarHBondContact O-N 3.29Å; L71-V74 PolarHBondContact O-N 2.94Å; V74-L77 PolarHBondContact O-N 2.92Å; V74-L78 HydrophobicContact CG1-CD1 4.3Å; V74-L78 WeakPolarHBondContact O-CG 3.49Å; V74-L78 PolarHBondContact O-N 3.3Å |
| 75 | L | 97.8 | Very high | 96.6 | Very high | 88 Ų | 88 | 86 Ų | 86 | 46% | 0.461 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -63.5 | -42.9 | 174.5 | -71.3 | -178.8 | 0 | 0 | 0 | 111.8 | L71 G72 G73 L77 L78 L79 | L71-L75 HydrophobicContact CD2-CD1 3.48Å; L71-L75 VanDerWaalsContact CD2-CD1 3.48Å; L71-L75 HydrophobicContact CD2-CG 4.11Å; L71-L75 HydrophobicContact CG-CD1 4.43Å; L71-L75 WeakPolarHBondContact O-CG 3.47Å; L71-L75 PolarHBondContact O-N 3.04Å; G72-L75 PolarHBondContact O-N 3.35Å; G73-L75 VanDerWaalsContact C-N 3.35Å; G73-L75 PolarHBondContact O-N 3.19Å; L75-L77 PolarHBondContact O-N 3.14Å; L75-L78 PolarHBondContact O-N 2.63Å; L75-L79 VanDerWaalsContact O-CB 3.31Å; L75-L79 WeakPolarHBondContact O-CB 3.39Å; L75-L79 VanDerWaalsContact O-CG 3.22Å; L75-L79 WeakPolarHBondContact O-CG 3.49Å; L75-L79 PolarHBondContact O-N 2.84Å |
| 76 | A | 97.1 | Very high | 96.7 | Very high | 27 Ų | 27 | 82.3 Ų | 82.3 | 22% | 0.223 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -61.2 | -43.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | I63 V67 G72 G73 L79 S80 | I63-A76 HydrophobicContact CG2-CB 3.97Å; V67-A76 HydrophobicContact CG2-CB 4.13Å; G72-A76 WeakPolarHBondContact O-CB 2.98Å; G72-A76 PolarHBondContact O-N 3.16Å; G73-A76 PolarHBondContact O-N 3.16Å; A76-L79 PolarHBondContact O-N 3.08Å; A76-S80 PolarHBondContact O-N 2.93Å |
| 77 | L | 96.5 | Very high | 96.6 | Very high | 47 Ų | 47 | 82.9 Ų | 82.9 | 25% | 0.246 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -60.1 | -49.6 | 174.9 | 178.6 | 151 | 0 | 0 | 0 | 111.4 | A60 L64 G73 V74 L75 L79 S80 | A60-L77 HydrophobicContact CB-CD1 4.27Å; A60-L77 HydrophobicContact CB-CG 4.38Å; L64-L77 HydrophobicContact CB-CD1 4.12Å; L64-L77 HydrophobicContact CD1-CB 4.38Å; L64-L77 HydrophobicContact CD1-CD1 4.43Å; L64-L77 HydrophobicContact CD2-CD1 4.3Å; G73-L77 PolarHBondContact O-N 3.31Å; V74-L77 PolarHBondContact O-N 2.92Å; L75-L77 PolarHBondContact O-N 3.14Å; L77-L79 VanDerWaalsContact C-N 3.33Å; L77-L79 PolarHBondContact O-N 3.28Å; L77-S80 WeakPolarHBondContact O-CB 3.42Å; L77-S80 PolarHBondContact O-N 3.3Å; L77-S80 PolarHBondContact O-OG 2.92Å |
| 78 | L | 96.9 | Very high | 96.5 | Very high | 89 Ų | 89 | 85.3 Ų | 85.3 | 47% | 0.466 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -61.2 | -43.6 | 178.7 | -71.1 | 172.6 | 0 | 0 | 0 | 111.5 | V74 L75 S80 I81 L82 | V74-L78 HydrophobicContact CG1-CD1 4.3Å; V74-L78 WeakPolarHBondContact O-CG 3.49Å; V74-L78 PolarHBondContact O-N 3.3Å; L75-L78 PolarHBondContact O-N 2.63Å; L78-S80 VanDerWaalsContact C-N 3.3Å; L78-S80 PolarHBondContact O-N 3.46Å; L78-I81 PolarHBondContact O-N 2.63Å; L78-L82 WeakPolarHBondContact O-CG 3.31Å; L78-L82 PolarHBondContact O-N 3.15Å |
| 79 | L | 96.9 | Very high | 96.6 | Very high | 109 Ų | 109 | 84.3 Ų | 84.3 | 57% | 0.571 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -65.6 | -31.6 | 178.9 | -72.3 | 175.4 | 0 | 0 | 0 | 112.7 | L75 A76 L77 I81 L82 I83 | L75-L79 VanDerWaalsContact O-CB 3.31Å; L75-L79 WeakPolarHBondContact O-CB 3.39Å; L75-L79 VanDerWaalsContact O-CG 3.22Å; L75-L79 WeakPolarHBondContact O-CG 3.49Å; L75-L79 PolarHBondContact O-N 2.84Å; A76-L79 PolarHBondContact O-N 3.08Å; L77-L79 VanDerWaalsContact C-N 3.33Å; L77-L79 PolarHBondContact O-N 3.28Å; L79-I81 PolarHBondContact O-N 2.68Å; L79-L82 PolarHBondContact O-N 3.37Å; L79-I83 WeakPolarHBondContact O-CB 3.49Å; L79-I83 PolarHBondContact O-N 3.16Å |
| 80 | S | 96 | Very high | 96.5 | Very high | 29 Ų | 29 | 84.8 Ų | 84.8 | 20% | 0.203 | 46% | 0.464 | C | S | . | . | H | α-helix | trans | -59.3 | -27.6 | 177.2 | 77 | 0 | 0 | 0 | 0 | 113.3 | A76 L77 L78 I83 | A76-S80 PolarHBondContact O-N 2.93Å; L77-S80 WeakPolarHBondContact O-CB 3.42Å; L77-S80 PolarHBondContact O-N 3.3Å; L77-S80 PolarHBondContact O-OG 2.92Å; L78-S80 VanDerWaalsContact C-N 3.3Å; L78-S80 PolarHBondContact O-N 3.46Å; S80-I83 WeakPolarHBondContact O-CG2 3.46Å |
| 81 | I | 96.8 | Very high | 96.6 | Very high | 95 Ų | 95 | 79.6 Ų | 79.6 | 49% | 0.487 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -95 | -45.2 | 176.1 | -58.3 | 173.2 | 0 | 0 | 0 | 110.3 | L78 L79 I83 L84 | L78-I81 PolarHBondContact O-N 2.63Å; L79-I81 PolarHBondContact O-N 2.68Å; I81-I83 PolarHBondContact O-N 3.18Å; I81-L84 WeakPolarHBondContact O-CB 3.32Å; I81-L84 WeakPolarHBondContact O-CG 3.35Å; I81-L84 PolarHBondContact O-N 3.14Å; I81-L84 VanDerWaalsContact O-N 3.09Å |
| 82 | L | 96.5 | Very high | 96.5 | Very high | 105 Ų | 105 | 81.6 Ų | 81.6 | 55% | 0.55 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -63.3 | -25.5 | -177.5 | -70.6 | 175 | 0 | 0 | 0 | 113.2 | L78 L79 L84 A85 | L78-L82 WeakPolarHBondContact O-CG 3.31Å; L78-L82 PolarHBondContact O-N 3.15Å; L79-L82 PolarHBondContact O-N 3.37Å; L82-L84 PolarHBondContact O-N 3.09Å; L82-L84 VanDerWaalsContact O-N 3.14Å; L82-A85 WeakPolarHBondContact O-CB 3.25Å; L82-A85 PolarHBondContact O-N 3.27Å |
| 83 | I | 96.6 | Very high | 96.4 | Very high | 87 Ų | 87 | 82.2 Ų | 82.2 | 45% | 0.446 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -57.5 | -27 | 175.3 | -163.4 | 66.7 | 0 | 0 | 0 | 112.4 | L79 S80 I81 A85 M86 I87 L90 | L79-I83 WeakPolarHBondContact O-CB 3.49Å; L79-I83 PolarHBondContact O-N 3.16Å; S80-I83 WeakPolarHBondContact O-CG2 3.46Å; I81-I83 PolarHBondContact O-N 3.18Å; I83-A85 VanDerWaalsContact C-N 3.27Å; I83-A85 PolarHBondContact O-N 3.29Å; I83-M86 HydrophobicContact CD1-CB 4.34Å; I83-M86 WeakPolarHBondContact O-CB 3.38Å; I83-M86 PolarHBondContact O-N 3.34Å; I83-I87 PolarHBondContact O-N 2.93Å; I83-L90 HydrophobicContact CD1-CD1 4.43Å |
| 84 | L | 96.4 | Very high | 96.3 | Very high | 111 Ų | 111 | 92.6 Ų | 92.6 | 58% | 0.581 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -60.7 | -36.8 | 176.3 | -63.2 | 177.9 | 0 | 0 | 0 | 112.2 | I81 L82 M86 I87 | I81-L84 WeakPolarHBondContact O-CB 3.32Å; I81-L84 WeakPolarHBondContact O-CG 3.35Å; I81-L84 PolarHBondContact O-N 3.14Å; I81-L84 VanDerWaalsContact O-N 3.09Å; L82-L84 PolarHBondContact O-N 3.09Å; L82-L84 VanDerWaalsContact O-N 3.14Å; L84-M86 PolarHBondContact O-N 3.37Å; L84-I87 HydrophobicContact CB-CD1 4.46Å; L84-I87 HydrophobicContact CD2-CD1 3.74Å; L84-I87 WeakPolarHBondContact O-CB 3.35Å; L84-I87 WeakPolarHBondContact O-CG1 3.41Å; L84-I87 PolarHBondContact O-N 3.02Å |
| 85 | A | 96.5 | Very high | 96.2 | Very high | 75 Ų | 75 | 93.4 Ų | 93.4 | 62% | 0.62 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -69.5 | -22.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | L82 I83 P88 | L82-A85 WeakPolarHBondContact O-CB 3.25Å; L82-A85 PolarHBondContact O-N 3.27Å; I83-A85 VanDerWaalsContact C-N 3.27Å; I83-A85 PolarHBondContact O-N 3.29Å; A85-P88 WeakPolarHBondContact O-CD 3.46Å |
| 86 | M | 96.1 | Very high | 96 | Very high | 89 Ų | 89 | 98 Ų | 98 | 44% | 0.438 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -83.4 | -16.6 | 178.2 | -62.4 | -62.2 | -70 | 0 | 0 | 112.9 | I83 L84 P88 I89 L90 | I83-M86 HydrophobicContact CD1-CB 4.34Å; I83-M86 WeakPolarHBondContact O-CB 3.38Å; I83-M86 PolarHBondContact O-N 3.34Å; L84-M86 PolarHBondContact O-N 3.37Å; M86-P88 VanDerWaalsContact C-CD 3.46Å; M86-I89 HydrophobicContact CE-CD1 4.38Å; M86-I89 PolarHBondContact O-N 3.2Å; M86-I89 HydrophobicContact SD-CD1 4.27Å; M86-L90 HydrophobicContact CB-CD1 4.06Å; M86-L90 HydrophobicContact CB-CG 4.43Å; M86-L90 WeakPolarHBondContact O-CG 3.45Å; M86-L90 PolarHBondContact O-N 3.04Å |
| 87 | I | 95.9 | Very high | 95.9 | Very high | 97 Ų | 97 | 100 Ų | 100 | 50% | 0.497 | 53% | 0.526 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -50.4 | -45.9 | -177 | -67.7 | 175.6 | 0 | 0 | 0 | 113.3 | I83 L84 I89 L90 H91 | I83-I87 PolarHBondContact O-N 2.93Å; L84-I87 HydrophobicContact CB-CD1 4.46Å; L84-I87 HydrophobicContact CD2-CD1 3.74Å; L84-I87 WeakPolarHBondContact O-CB 3.35Å; L84-I87 WeakPolarHBondContact O-CG1 3.41Å; L84-I87 PolarHBondContact O-N 3.02Å; I87-I89 VanDerWaalsContact C-N 3.29Å; I87-I89 PolarHBondContact O-N 3.34Å; I87-L90 PolarHBondContact O-N 3.32Å; I87-H91 PolarHBondContact O-N 2.74Å |
| 88 | P | 94.8 | Very high | 95.9 | Very high | 98 Ų | 98 | 101.7 Ų | 101.7 | 64% | 0.636 | 53% | 0.534 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -62.1 | -36.2 | -179.7 | -23.3 | 35.2 | 0 | 0 | 0 | 113.1 | A85 M86 H91 | A85-P88 WeakPolarHBondContact O-CD 3.46Å; M86-P88 VanDerWaalsContact C-CD 3.46Å; P88-H91 WeakPolarHBondContact O-CB 3.4Å; P88-H91 PolarHBondContact O-N 2.94Å |
| 89 | I | 97.1 | Very high | 95.9 | Very high | 118 Ų | 118 | 103.4 Ų | 103.4 | 61% | 0.605 | 54% | 0.541 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76 | -31.8 | -178.4 | -55.1 | 169.5 | 0 | 0 | 0 | 110.5 | M86 I87 H91 | M86-I89 HydrophobicContact CE-CD1 4.38Å; M86-I89 PolarHBondContact O-N 3.2Å; M86-I89 HydrophobicContact SD-CD1 4.27Å; I87-I89 VanDerWaalsContact C-N 3.29Å; I87-I89 PolarHBondContact O-N 3.34Å; I89-H91 PolarHBondContact O-N 3.24Å |
| 90 | L | 96.2 | Very high | 95.8 | Very high | 104 Ų | 104 | 105.2 Ų | 105.2 | 55% | 0.545 | 55% | 0.545 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -77.2 | -6.5 | 177.2 | -64.7 | 172.8 | 0 | 0 | 0 | 113.2 | I83 M86 I87 M92 | I83-L90 HydrophobicContact CD1-CD1 4.43Å; M86-L90 HydrophobicContact CB-CD1 4.06Å; M86-L90 HydrophobicContact CB-CG 4.43Å; M86-L90 WeakPolarHBondContact O-CG 3.45Å; M86-L90 PolarHBondContact O-N 3.04Å; I87-L90 PolarHBondContact O-N 3.32Å; L90-M92 PolarHBondContact O-N 3.37Å; L90-M92 VanDerWaalsContact O-N 3.1Å |
| 91 | H | 96.2 | Very high | 95.8 | Very high | 84 Ų | 84 | 106.4 Ų | 106.4 | 39% | 0.389 | 55% | 0.545 | S | S | . | . | trans | -76.4 | 98 | -178.9 | -170.7 | 89.7 | 0 | 0 | 0 | 112.1 | I87 P88 I89 S93 Q95 | I87-H91 PolarHBondContact O-N 2.74Å; P88-H91 WeakPolarHBondContact O-CB 3.4Å; P88-H91 PolarHBondContact O-N 2.94Å; I89-H91 PolarHBondContact O-N 3.24Å; H91-S93 PolarHBondContact CD2-O 3.18Å; H91-S93 PolarHBondContact NE2-O 3.31Å; H91-Q95 PolarHBondContact CE1-O 3.39Å; H91-Q95 PolarHBondContact NE2-O 2.78Å | ||
| 92 | M | 94.9 | Very high | 95.8 | Very high | 163 Ų | 163 | 106.6 Ų | 106.6 | 80% | 0.803 | 55% | 0.552 | S | S | * | * | trans | -95.6 | -3.5 | 179.2 | -58.5 | -57.6 | 171.4 | 0 | 0 | 114.5 | L90 | L90-M92 PolarHBondContact O-N 3.37Å; L90-M92 VanDerWaalsContact O-N 3.1Å | ||
| 93 | S | 95.1 | Very high | 95.8 | Very high | 35 Ų | 35 | 108.3 Ų | 108.3 | 25% | 0.245 | 56% | 0.561 | C | S | . | * | trans | -77.3 | 145.4 | -176.8 | 169.9 | 0 | 0 | 0 | 0 | 111.7 | H91 Q95 R101 | H91-S93 PolarHBondContact CD2-O 3.18Å; H91-S93 PolarHBondContact NE2-O 3.31Å; S93-Q95 PolarHBondContact O-N 3.24Å; S93-Q95 PolarHBondContact OG-N 3.33Å; S93-Q95 PolarHBondContact OG-O 2.99Å; S93-R101 PolarHBondContact OG-NE 2.96Å; S93-R101 PolarHBondContact OG-NH1 3.33Å | ||
| 94 | K | 94.4 | Very high | 95.8 | Very high | 219 Ų | 219 | 105.4 Ų | 105.4 | 95% | 0.952 | 55% | 0.548 | S | S | * | . | S | Bend | trans | -74.5 | -18 | 171.1 | -60.7 | -173.9 | -177.8 | -177.3 | 0 | 112.9 | ||
| 95 | Q | 95.2 | Very high | 95.8 | Very high | 93 Ų | 93 | 103.5 Ų | 103.5 | 44% | 0.435 | 54% | 0.537 | S | S | . | . | trans | -105.3 | 125.3 | 177.9 | -65.2 | 174.8 | -17.5 | 0 | 0 | 110 | H91 S93 R101 | H91-Q95 PolarHBondContact CE1-O 3.39Å; H91-Q95 PolarHBondContact NE2-O 2.78Å; S93-Q95 PolarHBondContact O-N 3.24Å; S93-Q95 PolarHBondContact OG-N 3.33Å; S93-Q95 PolarHBondContact OG-O 2.99Å; Q95-R101 PolarHBondContact O-NH1 2.82Å; Q95-R101 VanDerWaalsContact OE1-CG 3.29Å | ||
| 96 | Q | 93.8 | Very high | 95.9 | Very high | 184 Ų | 184 | 102.6 Ų | 102.6 | 86% | 0.86 | 53% | 0.526 | S | S | * | . | S | Bend | trans | -64.1 | -50.3 | 179.3 | -171.8 | -149.7 | -8.1 | 0 | 0 | 111.8 | ||
| 97 | S | 95.7 | Very high | 96 | Very high | 68 Ų | 68 | 103.7 Ų | 103.7 | 48% | 0.476 | 53% | 0.533 | S | S | . | . | S | Bend | trans | -80.4 | 152.2 | -178 | -179.9 | 0 | 0 | 0 | 0 | 112.3 | M99 R101 | S97-M99 VanDerWaalsContact C-N 3.33Å; S97-M99 WeakPolarHBondContact OG-CB 3.48Å; S97-M99 PolarHBondContact OG-N 3.03Å; S97-R101 WeakPolarHBondContact O-CD 3.45Å |
| 98 | M | 96.3 | Very high | 96.1 | Very high | 83 Ų | 83 | 105 Ų | 105 | 41% | 0.409 | 53% | 0.533 | S | S | . | . | S | Bend | trans | -83 | -7 | 170 | -60.4 | -170.2 | -168.2 | 0 | 0 | 113.1 | F100 R101 Q105 Y108 | M98-F100 PolarHBondContact O-N 3.34Å; M98-R101 PolarHBondContact O-N 3.24Å; M98-Q105 HydrophobicContact CB-CG 4.21Å; M98-Q105 VanDerWaalsContact O-CG 3.3Å; M98-Q105 WeakPolarHBondContact O-CG 3.45Å; M98-Q105 PolarHBondContact O-NE2 2.9Å; M98-Y108 HydrophobicContact SD-CG 4.42Å |
| 99 | M | 96.3 | Very high | 96.2 | Very high | 126 Ų | 126 | 108.5 Ų | 108.5 | 62% | 0.621 | 53% | 0.533 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.8 | -34.6 | -174.7 | -175.5 | 179.2 | 177.5 | 0 | 0 | 114 | S97 Q105 | S97-M99 VanDerWaalsContact C-N 3.33Å; S97-M99 WeakPolarHBondContact OG-CB 3.48Å; S97-M99 PolarHBondContact OG-N 3.03Å; M99-Q105 VanDerWaalsContact C-NE2 3.25Å; M99-Q105 PolarHBondContact O-NE2 3.42Å |
| 100 | F | 95.5 | Very high | 96.3 | Very high | 147 Ų | 147 | 108.3 Ų | 108.3 | 65% | 0.645 | 53% | 0.533 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -111.3 | 22.3 | -179.7 | -53.9 | -63.6 | 0 | 0 | 0 | 113.3 | M98 P102 | M98-F100 PolarHBondContact O-N 3.34Å; F100-P102 WeakPolarHBondContact O-CD 3.44Å |
| 101 | R | 96.3 | Very high | 96.4 | Very high | 54 Ų | 54 | 108.1 Ų | 108.1 | 20% | 0.204 | 53% | 0.532 | C | S | . | . | trans | -123.9 | 79.6 | -177.5 | -64.8 | 171.8 | 54.2 | -168.8 | -1.5 | 110.6 | S93 Q95 S97 M98 L103 S104 Q105 | S93-R101 PolarHBondContact OG-NE 2.96Å; S93-R101 PolarHBondContact OG-NH1 3.33Å; Q95-R101 PolarHBondContact O-NH1 2.82Å; Q95-R101 VanDerWaalsContact OE1-CG 3.29Å; S97-R101 WeakPolarHBondContact O-CD 3.45Å; M98-R101 PolarHBondContact O-N 3.24Å; R101-L103 VanDerWaalsContact C-N 3.34Å; R101-L103 PolarHBondContact O-N 3.48Å; R101-S104 PolarHBondContact NE-OG 3.48Å; R101-S104 PolarHBondContact NH2-OG 3.25Å; R101-S104 PolarHBondContact O-N 3Å; R101-Q105 PolarHBondContact O-N 3.36Å | ||
| 102 | P | 96.1 | Very high | 96.4 | Very high | 99 Ų | 99 | 105.6 Ų | 105.6 | 64% | 0.643 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -54.5 | -44.2 | -172.2 | -27 | 34.6 | 0 | 0 | 0 | 114 | F100 S104 Q105 S106 | F100-P102 WeakPolarHBondContact O-CD 3.44Å; P102-S104 VanDerWaalsContact C-N 3.31Å; P102-S104 PolarHBondContact O-N 3.37Å; P102-Q105 PolarHBondContact O-N 2.94Å; P102-S106 PolarHBondContact O-N 3.47Å |
| 103 | L | 96.8 | Very high | 96.6 | Very high | 140 Ų | 140 | 99.9 Ų | 99.9 | 73% | 0.733 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -63.8 | -34.8 | 177.4 | -66.3 | 174.8 | 0 | 0 | 0 | 112.8 | R101 S106 L107 | R101-L103 VanDerWaalsContact C-N 3.34Å; R101-L103 PolarHBondContact O-N 3.48Å; L103-S106 PolarHBondContact O-OG 3.38Å; L103-L107 WeakPolarHBondContact O-CG 3.4Å; L103-L107 PolarHBondContact O-N 2.87Å |
| 104 | S | 96.4 | Very high | 96.7 | Very high | 26 Ų | 26 | 102.1 Ų | 102.1 | 18% | 0.182 | 51% | 0.513 | C | S | . | . | H | α-helix | trans | -75.8 | -33.2 | 177.8 | -55.8 | 0 | 0 | 0 | 0 | 111.7 | R101 P102 L107 Y108 | R101-S104 PolarHBondContact NE-OG 3.48Å; R101-S104 PolarHBondContact NH2-OG 3.25Å; R101-S104 PolarHBondContact O-N 3Å; P102-S104 VanDerWaalsContact C-N 3.31Å; P102-S104 PolarHBondContact O-N 3.37Å; S104-L107 PolarHBondContact O-N 3.02Å; S104-Y108 WeakPolarHBondContact O-CB 3.42Å; S104-Y108 PolarHBondContact O-N 3.32Å |
| 105 | Q | 97.2 | Very high | 96.9 | Very high | 71 Ų | 71 | 95.6 Ų | 95.6 | 33% | 0.332 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -63.4 | -45.4 | 172.2 | -67.6 | 178.3 | 12.3 | 0 | 0 | 111.4 | M98 M99 R101 P102 L107 Y108 W109 | M98-Q105 HydrophobicContact CB-CG 4.21Å; M98-Q105 VanDerWaalsContact O-CG 3.3Å; M98-Q105 WeakPolarHBondContact O-CG 3.45Å; M98-Q105 PolarHBondContact O-NE2 2.9Å; M99-Q105 VanDerWaalsContact C-NE2 3.25Å; M99-Q105 PolarHBondContact O-NE2 3.42Å; R101-Q105 PolarHBondContact O-N 3.36Å; P102-Q105 PolarHBondContact O-N 2.94Å; Q105-L107 VanDerWaalsContact C-N 3.33Å; Q105-L107 PolarHBondContact O-N 3.42Å; Q105-Y108 PolarHBondContact O-N 3.24Å; Q105-W109 PolarHBondContact O-N 2.88Å |
| 106 | S | 97.8 | Very high | 96.9 | Very high | 57 Ų | 57 | 98.5 Ų | 98.5 | 40% | 0.399 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -62.2 | -41.5 | 178.2 | 59.4 | 0 | 0 | 0 | 0 | 111.9 | P102 L103 W109 L110 | P102-S106 PolarHBondContact O-N 3.47Å; L103-S106 PolarHBondContact O-OG 3.38Å; S106-W109 PolarHBondContact O-N 3.47Å; S106-L110 WeakPolarHBondContact O-CG 3.37Å; S106-L110 PolarHBondContact O-N 2.7Å |
| 107 | L | 97.7 | Very high | 97.1 | Very high | 112 Ų | 112 | 96.5 Ų | 96.5 | 59% | 0.586 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -65.7 | -37.3 | 175.7 | -71.2 | 172.2 | 0 | 0 | 0 | 112.7 | L103 S104 Q105 L110 L111 | L103-L107 WeakPolarHBondContact O-CG 3.4Å; L103-L107 PolarHBondContact O-N 2.87Å; S104-L107 PolarHBondContact O-N 3.02Å; Q105-L107 VanDerWaalsContact C-N 3.33Å; Q105-L107 PolarHBondContact O-N 3.42Å; L107-L110 HydrophobicContact CD2-CD1 4.29Å; L107-L110 PolarHBondContact O-N 3.11Å; L107-L111 PolarHBondContact O-N 3.28Å |
| 108 | Y | 97.5 | Very high | 97 | Very high | 124 Ų | 124 | 96.2 Ų | 96.2 | 49% | 0.486 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.4 | -44.6 | 174.3 | 173.3 | -96.8 | 0 | 0 | 0 | 111.8 | M98 S104 Q105 L111 A112 | M98-Y108 HydrophobicContact SD-CG 4.42Å; S104-Y108 WeakPolarHBondContact O-CB 3.42Å; S104-Y108 PolarHBondContact O-N 3.32Å; Q105-Y108 PolarHBondContact O-N 3.24Å; Y108-L111 WeakPolarHBondContact O-CB 3.47Å; Y108-L111 PolarHBondContact O-N 3.07Å; Y108-A112 PolarHBondContact O-N 3.21Å |
| 109 | W | 98.1 | Very high | 97.1 | Very high | 172 Ų | 172 | 96.9 Ų | 96.9 | 65% | 0.652 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -68.4 | -34.1 | 176.9 | -71.8 | 117.2 | 0 | 0 | 0 | 112.9 | Q105 S106 A112 A113 | Q105-W109 PolarHBondContact O-N 2.88Å; S106-W109 PolarHBondContact O-N 3.47Å; W109-A112 HydrophobicContact CE3-CB 4.36Å; W109-A112 PolarHBondContact O-N 2.88Å; W109-A113 WeakPolarHBondContact O-CB 3.43Å; W109-A113 PolarHBondContact O-N 3.39Å |
| 110 | L | 98.4 | Very high | 97.1 | Very high | 113 Ų | 113 | 95.4 Ų | 95.4 | 59% | 0.592 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -62 | -43.7 | 170.5 | -76.5 | 167.5 | 0 | 0 | 0 | 111.4 | S106 L107 A113 D114 | S106-L110 WeakPolarHBondContact O-CG 3.37Å; S106-L110 PolarHBondContact O-N 2.7Å; L107-L110 HydrophobicContact CD2-CD1 4.29Å; L107-L110 PolarHBondContact O-N 3.11Å; L110-A113 PolarHBondContact O-N 3.32Å; L110-D114 WeakPolarHBondContact O-CB 3.35Å; L110-D114 PolarHBondContact O-N 3.43Å |
| 111 | L | 97.8 | Very high | 97.2 | Very high | 101 Ų | 101 | 92.5 Ų | 92.5 | 53% | 0.529 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -62.3 | -41.9 | 174.8 | -179.8 | 69 | 0 | 0 | 0 | 111.9 | L107 Y108 A113 D114 L115 | L107-L111 PolarHBondContact O-N 3.28Å; Y108-L111 WeakPolarHBondContact O-CB 3.47Å; Y108-L111 PolarHBondContact O-N 3.07Å; L111-A113 VanDerWaalsContact C-N 3.33Å; L111-A113 PolarHBondContact O-N 2.88Å; L111-D114 PolarHBondContact O-N 2.94Å; L111-L115 WeakPolarHBondContact O-CG 3.35Å; L111-L115 PolarHBondContact O-N 3.17Å |
| 112 | A | 97.9 | Very high | 97.2 | Very high | 30 Ų | 30 | 94.8 Ų | 94.8 | 25% | 0.248 | 50% | 0.498 | C | S | . | . | H | α-helix | trans | -63.8 | -38.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | Y108 W109 L116 | Y108-A112 PolarHBondContact O-N 3.21Å; W109-A112 HydrophobicContact CE3-CB 4.36Å; W109-A112 PolarHBondContact O-N 2.88Å; A112-L116 WeakPolarHBondContact O-CG 3.31Å; A112-L116 PolarHBondContact O-N 3.44Å |
| 113 | A | 98.3 | Very high | 97.3 | Very high | 43 Ų | 43 | 94.5 Ų | 94.5 | 36% | 0.355 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -68.7 | -39.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | W109 L110 L111 L116 I117 | W109-A113 WeakPolarHBondContact O-CB 3.43Å; W109-A113 PolarHBondContact O-N 3.39Å; L110-A113 PolarHBondContact O-N 3.32Å; L111-A113 VanDerWaalsContact C-N 3.33Å; L111-A113 PolarHBondContact O-N 2.88Å; A113-L116 WeakPolarHBondContact O-CB 3.22Å; A113-L116 PolarHBondContact O-N 3.45Å; A113-L116 VanDerWaalsContact O-N 3.14Å; A113-I117 WeakPolarHBondContact O-CG1 3.4Å; A113-I117 PolarHBondContact O-N 3.33Å; A113-I117 VanDerWaalsContact O-N 3.11Å |
| 114 | D | 97.8 | Very high | 97.3 | Very high | 82 Ų | 82 | 91.5 Ų | 91.5 | 44% | 0.439 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -60.3 | -45.5 | 175.5 | -172.9 | 68.2 | 0 | 0 | 0 | 111.3 | L110 L111 L116 I117 L118 | L110-D114 WeakPolarHBondContact O-CB 3.35Å; L110-D114 PolarHBondContact O-N 3.43Å; L111-D114 PolarHBondContact O-N 2.94Å; D114-L116 PolarHBondContact O-N 2.99Å; D114-I117 PolarHBondContact O-N 3.04Å; D114-L118 WeakPolarHBondContact O-CG 3.43Å; D114-L118 PolarHBondContact O-N 3.19Å |
| 115 | L | 97.1 | Very high | 97.4 | Very high | 83 Ų | 83 | 96.1 Ų | 96.1 | 44% | 0.435 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.1 | -24.1 | 174.5 | -74.3 | 173.9 | 0 | 0 | 0 | 114.4 | F59 L111 L118 | F59-L115 HydrophobicContact CD2-CD2 4.05Å; F59-L115 HydrophobicContact CG-CD2 4.48Å; L111-L115 WeakPolarHBondContact O-CG 3.35Å; L111-L115 PolarHBondContact O-N 3.17Å; L115-L118 HydrophobicContact CD2-CD1 4.45Å |
| 116 | L | 96.6 | Very high | 97.4 | Very high | 153 Ų | 153 | 98.1 Ų | 98.1 | 80% | 0.801 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -81.9 | -24.3 | 174 | -73.4 | 170.8 | 0 | 0 | 0 | 112.5 | A112 A113 D114 | A112-L116 WeakPolarHBondContact O-CG 3.31Å; A112-L116 PolarHBondContact O-N 3.44Å; A113-L116 WeakPolarHBondContact O-CB 3.22Å; A113-L116 PolarHBondContact O-N 3.45Å; A113-L116 VanDerWaalsContact O-N 3.14Å; D114-L116 PolarHBondContact O-N 2.99Å |
| 117 | I | 96.4 | Very high | 97.4 | Very high | 143 Ų | 143 | 101.5 Ų | 101.5 | 73% | 0.733 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -83.1 | -34.7 | 176.8 | -68 | 166.4 | 0 | 0 | 0 | 110.6 | A113 D114 | A113-I117 WeakPolarHBondContact O-CG1 3.4Å; A113-I117 PolarHBondContact O-N 3.33Å; A113-I117 VanDerWaalsContact O-N 3.11Å; D114-I117 PolarHBondContact O-N 3.04Å |
| 118 | L | 95.1 | Very high | 97.4 | Very high | 62 Ų | 62 | 100.5 Ų | 100.5 | 33% | 0.325 | 51% | 0.509 | S | S | . | . | trans | -67.9 | 0 | 173.8 | -71.9 | 173.6 | 0 | 0 | 0 | 112.4 | F59 T62 I63 D114 L115 | F59-L118 HydrophobicContact CB-CB 3.92Å; T62-L118 VanDerWaalsContact CB-O 3.31Å; T62-L118 WeakPolarHBondContact CB-O 3.35Å; T62-L118 WeakPolarHBondContact CG2-O 3.41Å; T62-L118 PolarHBondContact OG1-O 3.13Å; I63-L118 HydrophobicContact CD1-CD1 4.21Å; I63-L118 HydrophobicContact CG1-CD1 4.22Å; I63-L118 HydrophobicContact CG1-CD2 4.34Å; D114-L118 WeakPolarHBondContact O-CG 3.43Å; D114-L118 PolarHBondContact O-N 3.19Å; L115-L118 HydrophobicContact CD2-CD1 4.45Å |
Retrieved 118 of 118 residues in 77.6 ms
(Link to these results)