| 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 | 35.9 | Very low | 44.8 | Very low | 214 Ų | 214 | 119.1 Ų | 119.1 | 100% | 1.054 | 60% | 0.596 | S | S | * | * | 0 | 49.1 | 0 | -166.4 | 173.7 | 158.9 | 0 | 0 | 110.9 | |||||
| 2 | I | 40.8 | Very low | 45.2 | Very low | 124 Ų | 124 | 114.9 Ų | 114.9 | 64% | 0.636 | 58% | 0.576 | S | S | * | * | trans | -122.6 | -19.6 | 179.4 | -76.7 | 168.3 | 0 | 0 | 0 | 110.6 | L4 L5 | I2-L4 PolarHBondContact O-N 3.31Å; I2-L5 PolarHBondContact O-N 2.71Å | ||
| 3 | M | 31.5 | Very low | 45.9 | Very low | 151 Ų | 151 | 113.7 Ų | 113.7 | 74% | 0.744 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -67.2 | -37.2 | -179.3 | -149.6 | 159.3 | 179.5 | 0 | 0 | 112.3 | L5 R6 E7 | M3-L5 VanDerWaalsContact C-N 3.33Å; M3-L5 PolarHBondContact O-N 3.48Å; M3-R6 PolarHBondContact O-N 3.33Å; M3-E7 PolarHBondContact O-N 3.23Å |
| 4 | L | 41.4 | Very low | 46.6 | Very low | 124 Ų | 124 | 116.1 Ų | 116.1 | 65% | 0.649 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -66.9 | -28.6 | 177.3 | -70.9 | 164.1 | 0 | 0 | 0 | 113.8 | I2 Y8 | I2-L4 PolarHBondContact O-N 3.31Å; L4-Y8 WeakPolarHBondContact O-CB 3.44Å; L4-Y8 PolarHBondContact O-N 3.18Å; L4-Y8 VanDerWaalsContact O-N 3.17Å |
| 5 | L | 39.5 | Very low | 46.9 | Very low | 110 Ų | 110 | 109.5 Ų | 109.5 | 58% | 0.576 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -74.6 | -33.1 | -179 | -84.8 | 155.8 | 0 | 0 | 0 | 112.4 | I2 M3 S9 | I2-L5 PolarHBondContact O-N 2.71Å; M3-L5 VanDerWaalsContact C-N 3.33Å; M3-L5 PolarHBondContact O-N 3.48Å; L5-S9 PolarHBondContact O-N 3.31Å |
| 6 | R | 42.1 | Very low | 47.3 | Very low | 196 Ų | 196 | 110.4 Ų | 110.4 | 74% | 0.74 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -72.3 | -40.5 | 176.5 | -77.6 | -176.2 | 168.3 | 160 | -2.7 | 112 | M3 Y8 S9 A10 | M3-R6 PolarHBondContact O-N 3.33Å; R6-Y8 VanDerWaalsContact C-N 3.33Å; R6-S9 PolarHBondContact O-N 3.04Å; R6-A10 WeakPolarHBondContact O-CB 3.35Å; R6-A10 PolarHBondContact O-N 3.48Å |
| 7 | E | 49.1 | Very low | 47.8 | Very low | 110 Ų | 110 | 113.6 Ų | 113.6 | 51% | 0.514 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -64.8 | -39.4 | 176.5 | -68.2 | 173.8 | 179.5 | 0 | 0 | 111.2 | M3 A10 T11 | M3-E7 PolarHBondContact O-N 3.23Å; E7-A10 PolarHBondContact O-N 3.41Å; E7-T11 WeakPolarHBondContact O-CB 3.36Å; E7-T11 PolarHBondContact O-N 3.27Å; E7-T11 PolarHBondContact O-OG1 3.34Å |
| 8 | Y | 50.2 | Low | 47.9 | Very low | 119 Ų | 119 | 113.9 Ų | 113.9 | 47% | 0.467 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -64.2 | -40.7 | 175.9 | -168.2 | -104.5 | 0 | 0 | 0 | 112.6 | L4 R6 T11 L12 | L4-Y8 WeakPolarHBondContact O-CB 3.44Å; L4-Y8 PolarHBondContact O-N 3.18Å; L4-Y8 VanDerWaalsContact O-N 3.17Å; R6-Y8 VanDerWaalsContact C-N 3.33Å; Y8-T11 PolarHBondContact O-N 3.45Å; Y8-L12 HydrophobicContact CD1-CD1 3.51Å; Y8-L12 HydrophobicContact CE1-CD1 3.27Å; Y8-L12 HydrophobicContact CE1-CG 4.26Å; Y8-L12 HydrophobicContact CG-CD1 4.41Å; Y8-L12 WeakPolarHBondContact O-CB 3.39Å; Y8-L12 PolarHBondContact O-N 3.07Å |
| 9 | S | 50.2 | Low | 47.9 | Very low | 61 Ų | 61 | 110.6 Ų | 110.6 | 43% | 0.427 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -68.4 | -43.8 | 177.1 | -163.6 | 0 | 0 | 0 | 0 | 112.3 | L5 R6 T11 L12 D13 | L5-S9 PolarHBondContact O-N 3.31Å; R6-S9 PolarHBondContact O-N 3.04Å; S9-T11 VanDerWaalsContact C-N 3.28Å; S9-T11 PolarHBondContact O-N 3.44Å; S9-L12 WeakPolarHBondContact O-CB 3.36Å; S9-L12 PolarHBondContact O-N 3.5Å; S9-D13 PolarHBondContact O-N 2.93Å |
| 10 | A | 57.8 | Low | 48.1 | Very low | 60 Ų | 60 | 113.1 Ų | 113.1 | 50% | 0.496 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -64.4 | -35.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | R6 E7 W14 | R6-A10 WeakPolarHBondContact O-CB 3.35Å; R6-A10 PolarHBondContact O-N 3.48Å; E7-A10 PolarHBondContact O-N 3.41Å; A10-W14 VanDerWaalsContact O-CB 3.27Å; A10-W14 WeakPolarHBondContact O-CB 3.41Å; A10-W14 PolarHBondContact O-N 3.22Å |
| 11 | T | 53.9 | Low | 48 | Very low | 41 Ų | 41 | 117.6 Ų | 117.6 | 25% | 0.252 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -70.3 | -36.7 | 174.4 | -51.9 | 0 | 0 | 0 | 0 | 111.5 | E7 Y8 S9 L15 Y26 | E7-T11 WeakPolarHBondContact O-CB 3.36Å; E7-T11 PolarHBondContact O-N 3.27Å; E7-T11 PolarHBondContact O-OG1 3.34Å; Y8-T11 PolarHBondContact O-N 3.45Å; S9-T11 VanDerWaalsContact C-N 3.28Å; S9-T11 PolarHBondContact O-N 3.44Å; T11-L15 HydrophobicContact CG2-CD1 4Å; T11-L15 HydrophobicContact CG2-CG 4.42Å; T11-L15 VanDerWaalsContact O-CB 3.23Å; T11-L15 WeakPolarHBondContact O-CB 3.33Å; T11-L15 WeakPolarHBondContact O-CD1 3.47Å; T11-L15 WeakPolarHBondContact O-CG 3.45Å; T11-L15 PolarHBondContact O-N 2.81Å; T11-Y26 HydrophobicContact CG2-CE1 3.92Å |
| 12 | L | 50.3 | Low | 48.6 | Very low | 69 Ų | 69 | 109.8 Ų | 109.8 | 36% | 0.361 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -66.1 | -42.2 | 174.1 | -93.3 | 160.3 | 0 | 0 | 0 | 112.7 | Y8 S9 L15 N16 | Y8-L12 HydrophobicContact CD1-CD1 3.51Å; Y8-L12 HydrophobicContact CE1-CD1 3.27Å; Y8-L12 HydrophobicContact CE1-CG 4.26Å; Y8-L12 HydrophobicContact CG-CD1 4.41Å; Y8-L12 WeakPolarHBondContact O-CB 3.39Å; Y8-L12 PolarHBondContact O-N 3.07Å; S9-L12 WeakPolarHBondContact O-CB 3.36Å; S9-L12 PolarHBondContact O-N 3.5Å; L12-L15 PolarHBondContact O-N 3.44Å; L12-N16 WeakPolarHBondContact O-CB 3.27Å; L12-N16 PolarHBondContact O-N 2.87Å |
| 13 | D | 53.9 | Low | 49.1 | Very low | 99 Ų | 99 | 107.2 Ų | 107.2 | 53% | 0.529 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65.8 | -44.4 | 175.2 | -79 | -17.3 | 0 | 0 | 0 | 110.8 | S9 L15 N16 E17 | S9-D13 PolarHBondContact O-N 2.93Å; D13-L15 VanDerWaalsContact C-N 3.33Å; D13-L15 PolarHBondContact O-N 2.72Å; D13-N16 WeakPolarHBondContact O-CB 3.34Å; D13-N16 PolarHBondContact O-N 3.17Å; D13-N16 VanDerWaalsContact O-N 3.13Å; D13-E17 PolarHBondContact O-N 3.42Å; D13-E17 VanDerWaalsContact O-N 3.16Å |
| 14 | W | 56.4 | Low | 49.7 | Very low | 147 Ų | 147 | 103.5 Ų | 103.5 | 56% | 0.557 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -61.9 | -38.6 | 174.3 | -175.8 | 77.9 | 0 | 0 | 0 | 112.7 | A10 N16 E17 | A10-W14 VanDerWaalsContact O-CB 3.27Å; A10-W14 WeakPolarHBondContact O-CB 3.41Å; A10-W14 PolarHBondContact O-N 3.22Å; W14-N16 VanDerWaalsContact C-N 3.3Å; W14-N16 PolarHBondContact O-N 2.95Å; W14-E17 PolarHBondContact O-N 3.44Å |
| 15 | L | 50 | Low | 50 | Low | 18 Ų | 18 | 103.1 Ų | 103.1 | 9% | 0.094 | 51% | 0.506 | C | S | . | . | H | α-helix | trans | -69.5 | -25.4 | 175.3 | -78.3 | 166.9 | 0 | 0 | 0 | 113.2 | T11 L12 D13 F23 Y26 | T11-L15 HydrophobicContact CG2-CD1 4Å; T11-L15 HydrophobicContact CG2-CG 4.42Å; T11-L15 VanDerWaalsContact O-CB 3.23Å; T11-L15 WeakPolarHBondContact O-CB 3.33Å; T11-L15 WeakPolarHBondContact O-CD1 3.47Å; T11-L15 WeakPolarHBondContact O-CG 3.45Å; T11-L15 PolarHBondContact O-N 2.81Å; L12-L15 PolarHBondContact O-N 3.44Å; D13-L15 VanDerWaalsContact C-N 3.33Å; D13-L15 PolarHBondContact O-N 2.72Å; L15-F23 HydrophobicContact CB-CD2 4.21Å; L15-F23 HydrophobicContact CD1-CD2 4.11Å; L15-F23 HydrophobicContact CD1-CE2 4.36Å; L15-F23 HydrophobicContact CD2-CD2 4.47Å; L15-Y26 HydrophobicContact CD1-CD1 4.03Å; L15-Y26 HydrophobicContact CD1-CE1 4.47Å; L15-Y26 HydrophobicContact CD1-CG 4.42Å; L15-Y26 HydrophobicContact CD2-CG 4.48Å |
| 16 | N | 54.7 | Low | 50.4 | Low | 124 Ų | 124 | 102.6 Ų | 102.6 | 66% | 0.663 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -78.6 | -29.9 | 177.4 | -167.6 | 38.3 | 0 | 0 | 0 | 112 | L12 D13 W14 | L12-N16 WeakPolarHBondContact O-CB 3.27Å; L12-N16 PolarHBondContact O-N 2.87Å; D13-N16 WeakPolarHBondContact O-CB 3.34Å; D13-N16 PolarHBondContact O-N 3.17Å; D13-N16 VanDerWaalsContact O-N 3.13Å; W14-N16 VanDerWaalsContact C-N 3.3Å; W14-N16 PolarHBondContact O-N 2.95Å |
| 17 | E | 54.6 | Low | 50.8 | Low | 165 Ų | 165 | 96.8 Ų | 96.8 | 77% | 0.771 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -82.1 | -28.3 | -177.4 | -84.1 | -174.9 | 155.1 | 0 | 0 | 114.5 | D13 W14 | D13-E17 PolarHBondContact O-N 3.42Å; D13-E17 VanDerWaalsContact O-N 3.16Å; W14-E17 PolarHBondContact O-N 3.44Å |
| 18 | D | 50.3 | Low | 50.7 | Low | 118 Ų | 118 | 97.2 Ų | 97.2 | 63% | 0.631 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -133.2 | -3.2 | -159 | -116.4 | -25.7 | 0 | 0 | 0 | 120.1 | ||
| 19 | S | 48.1 | Very low | 50.4 | Low | 52 Ų | 52 | 98.4 Ų | 98.4 | 36% | 0.364 | 49% | 0.494 | S | S | . | . | trans | -171.5 | 104.3 | 174.2 | -89.1 | 0 | 0 | 0 | 0 | 115.2 | W21 T22 | S19-W21 PolarHBondContact O-N 3.33Å; S19-T22 WeakPolarHBondContact CB-OG1 3.36Å; S19-T22 PolarHBondContact O-N 2.69Å; S19-T22 PolarHBondContact O-OG1 3.08Å; S19-T22 VanDerWaalsContact O-OG1 3.06Å | ||
| 20 | F | 50.5 | Low | 50.2 | Low | 160 Ų | 160 | 99.4 Ų | 99.4 | 70% | 0.702 | 49% | 0.494 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.1 | -26.1 | 168 | -167.7 | -97.8 | 0 | 0 | 0 | 113.2 | ||
| 21 | W | 46.1 | Very low | 49.8 | Very low | 208 Ų | 208 | 98.5 Ų | 98.5 | 79% | 0.788 | 48% | 0.484 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.8 | -16.7 | -176 | -54.4 | 97.2 | 0 | 0 | 0 | 114.8 | S19 | S19-W21 PolarHBondContact O-N 3.33Š|
| 22 | T | 49 | Very low | 49.4 | Very low | 50 Ų | 50 | 102.2 Ų | 102.2 | 31% | 0.307 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -91 | -23.5 | -178.7 | 55.3 | 0 | 0 | 0 | 0 | 112.4 | S19 L25 Y26 | S19-T22 WeakPolarHBondContact CB-OG1 3.36Å; S19-T22 PolarHBondContact O-N 2.69Å; S19-T22 PolarHBondContact O-OG1 3.08Å; S19-T22 VanDerWaalsContact O-OG1 3.06Å; T22-L25 PolarHBondContact O-N 2.74Å; T22-Y26 WeakPolarHBondContact O-CB 3.31Å; T22-Y26 PolarHBondContact O-N 3Å |
| 23 | F | 50.9 | Low | 49.3 | Very low | 70 Ų | 70 | 108.5 Ų | 108.5 | 31% | 0.307 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -58 | -46.3 | 179 | -169.2 | -94.7 | 0 | 0 | 0 | 113.3 | L15 L25 Y26 V27 Y52 | L15-F23 HydrophobicContact CB-CD2 4.21Å; L15-F23 HydrophobicContact CD1-CD2 4.11Å; L15-F23 HydrophobicContact CD1-CE2 4.36Å; L15-F23 HydrophobicContact CD2-CD2 4.47Å; F23-L25 PolarHBondContact O-N 3.45Å; F23-Y26 PolarHBondContact O-N 3.39Å; F23-V27 HydrophobicContact CD1-CG2 4.07Å; F23-V27 HydrophobicContact CE1-CG2 3.81Å; F23-V27 HydrophobicContact CZ-CG2 4.15Å; F23-V27 VanDerWaalsContact O-CG2 3.32Å; F23-V27 WeakPolarHBondContact O-CG2 3.32Å; F23-V27 PolarHBondContact O-N 3.37Å; F23-Y52 WeakPolarHBondContact CD1-OH 3.44Å; F23-Y52 WeakPolarHBondContact CE1-OH 3.5Å |
| 24 | P | 45 | Very low | 49 | Very low | 73 Ų | 73 | 107.1 Ų | 107.1 | 47% | 0.474 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64.8 | -36.7 | 177.7 | -19.8 | 33.5 | 0 | 0 | 0 | 113.1 | Y26 M28 | P24-Y26 VanDerWaalsContact C-N 3.34Å; P24-M28 WeakPolarHBondContact O-CB 3.39Å; P24-M28 PolarHBondContact O-N 3.15Å |
| 25 | L | 48.2 | Very low | 48.3 | Very low | 115 Ų | 115 | 107.7 Ų | 107.7 | 60% | 0.602 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -68.9 | -33.2 | 176.2 | -78.5 | 162.9 | 0 | 0 | 0 | 112.1 | T22 F23 K29 | T22-L25 PolarHBondContact O-N 2.74Å; F23-L25 PolarHBondContact O-N 3.45Å; L25-K29 PolarHBondContact O-N 3.25Å |
| 26 | Y | 47.1 | Very low | 48 | Very low | 99 Ų | 99 | 115.7 Ų | 115.7 | 39% | 0.388 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -74.7 | -40.5 | 177.5 | -152.3 | -94.8 | 0 | 0 | 0 | 111.6 | T11 L15 T22 F23 P24 M28 K29 L30 | T11-Y26 HydrophobicContact CG2-CE1 3.92Å; L15-Y26 HydrophobicContact CD1-CD1 4.03Å; L15-Y26 HydrophobicContact CD1-CE1 4.47Å; L15-Y26 HydrophobicContact CD1-CG 4.42Å; L15-Y26 HydrophobicContact CD2-CG 4.48Å; T22-Y26 WeakPolarHBondContact O-CB 3.31Å; T22-Y26 PolarHBondContact O-N 3Å; F23-Y26 PolarHBondContact O-N 3.39Å; P24-Y26 VanDerWaalsContact C-N 3.34Å; Y26-M28 VanDerWaalsContact C-N 3.31Å; Y26-M28 PolarHBondContact O-N 3.04Å; Y26-K29 PolarHBondContact O-N 3.13Å; Y26-L30 HydrophobicContact CD1-CD1 3.54Å; Y26-L30 HydrophobicContact CD1-CG 4.25Å; Y26-L30 HydrophobicContact CE1-CD1 3.76Å; Y26-L30 HydrophobicContact CE1-CG 4.28Å; Y26-L30 WeakPolarHBondContact O-CB 3.37Å; Y26-L30 WeakPolarHBondContact O-CG 3.36Å; Y26-L30 PolarHBondContact O-N 3.11Å |
| 27 | V | 49.8 | Very low | 47.6 | Very low | 74 Ų | 74 | 113.1 Ų | 113.1 | 45% | 0.448 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -62.2 | -39.1 | 171.4 | 173.8 | 0 | 0 | 0 | 0 | 111 | F23 L30 S31 | F23-V27 HydrophobicContact CD1-CG2 4.07Å; F23-V27 HydrophobicContact CE1-CG2 3.81Å; F23-V27 HydrophobicContact CZ-CG2 4.15Å; F23-V27 VanDerWaalsContact O-CG2 3.32Å; F23-V27 WeakPolarHBondContact O-CG2 3.32Å; F23-V27 PolarHBondContact O-N 3.37Å; V27-L30 PolarHBondContact O-N 3.07Å; V27-S31 WeakPolarHBondContact O-CB 3.46Å; V27-S31 PolarHBondContact O-N 3.48Å |
| 28 | M | 48.1 | Very low | 47.3 | Very low | 120 Ų | 120 | 108.9 Ų | 108.9 | 59% | 0.591 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -67.4 | -40.7 | 174.7 | -167.4 | 178.6 | 179.9 | 0 | 0 | 112.2 | P24 Y26 S31 I32 | P24-M28 WeakPolarHBondContact O-CB 3.39Å; P24-M28 PolarHBondContact O-N 3.15Å; Y26-M28 VanDerWaalsContact C-N 3.31Å; Y26-M28 PolarHBondContact O-N 3.04Å; M28-S31 WeakPolarHBondContact CA-OG 3.37Å; M28-S31 PolarHBondContact O-N 3.02Å; M28-S31 PolarHBondContact O-OG 3.39Å; M28-I32 WeakPolarHBondContact O-CG1 3.32Å; M28-I32 PolarHBondContact O-N 2.78Å |
| 29 | K | 43.6 | Very low | 46.9 | Very low | 143 Ų | 143 | 109.2 Ų | 109.2 | 62% | 0.622 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -64.3 | -41.5 | 172.9 | -83 | -176.5 | 175.6 | 179.9 | 0 | 112 | L25 Y26 S31 I32 Y33 | L25-K29 PolarHBondContact O-N 3.25Å; Y26-K29 PolarHBondContact O-N 3.13Å; K29-S31 VanDerWaalsContact C-N 3.28Å; K29-S31 PolarHBondContact O-N 3.35Å; K29-I32 PolarHBondContact O-N 2.81Å; K29-Y33 WeakPolarHBondContact O-CD2 3.42Å; K29-Y33 PolarHBondContact O-N 3.27Å |
| 30 | L | 46.7 | Very low | 46.6 | Very low | 83 Ų | 83 | 109.6 Ų | 109.6 | 44% | 0.435 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -63.1 | -34.4 | 174.4 | -78.9 | 160.2 | 0 | 0 | 0 | 112.3 | Y26 V27 I32 Y33 D34 | Y26-L30 HydrophobicContact CD1-CD1 3.54Å; Y26-L30 HydrophobicContact CD1-CG 4.25Å; Y26-L30 HydrophobicContact CE1-CD1 3.76Å; Y26-L30 HydrophobicContact CE1-CG 4.28Å; Y26-L30 WeakPolarHBondContact O-CB 3.37Å; Y26-L30 WeakPolarHBondContact O-CG 3.36Å; Y26-L30 PolarHBondContact O-N 3.11Å; V27-L30 PolarHBondContact O-N 3.07Å; L30-I32 PolarHBondContact O-N 3.27Å; L30-Y33 PolarHBondContact O-N 2.88Å; L30-D34 PolarHBondContact O-N 3.32Å |
| 31 | S | 48.1 | Very low | 46.5 | Very low | 40 Ų | 40 | 105.9 Ų | 105.9 | 28% | 0.28 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -67 | -21.4 | 176.6 | 74.5 | 0 | 0 | 0 | 0 | 114.3 | V27 M28 K29 | V27-S31 WeakPolarHBondContact O-CB 3.46Å; V27-S31 PolarHBondContact O-N 3.48Å; M28-S31 WeakPolarHBondContact CA-OG 3.37Å; M28-S31 PolarHBondContact O-N 3.02Å; M28-S31 PolarHBondContact O-OG 3.39Å; K29-S31 VanDerWaalsContact C-N 3.28Å; K29-S31 PolarHBondContact O-N 3.35Å |
| 32 | I | 46.4 | Very low | 46.5 | Very low | 119 Ų | 119 | 101.4 Ų | 101.4 | 61% | 0.61 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -85 | -34.2 | 177.5 | -66.3 | 166.1 | 0 | 0 | 0 | 111.4 | M28 K29 L30 | M28-I32 WeakPolarHBondContact O-CG1 3.32Å; M28-I32 PolarHBondContact O-N 2.78Å; K29-I32 PolarHBondContact O-N 2.81Å; L30-I32 PolarHBondContact O-N 3.27Å |
| 33 | Y | 47.7 | Very low | 46.6 | Very low | 201 Ų | 201 | 101.7 Ų | 101.7 | 79% | 0.788 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -85.9 | -16.2 | -174 | -81.5 | -81 | 0 | 0 | 0 | 114.5 | K29 L30 | K29-Y33 WeakPolarHBondContact O-CD2 3.42Å; K29-Y33 PolarHBondContact O-N 3.27Å; L30-Y33 PolarHBondContact O-N 2.88Å |
| 34 | D | 48.5 | Very low | 46.6 | Very low | 71 Ų | 71 | 102.3 Ų | 102.3 | 38% | 0.38 | 52% | 0.519 | S | S | . | . | trans | -146.7 | 65.3 | -174.3 | -145 | -25.7 | 0 | 0 | 0 | 113.4 | L30 K36 V37 L38 | L30-D34 PolarHBondContact O-N 3.32Å; D34-K36 PolarHBondContact O-N 3.33Å; D34-K36 PolarHBondContact OD1-N 2.88Å; D34-V37 HydrophobicContact CB-CB 3.92Å; D34-V37 HydrophobicContact CB-CG2 4.15Å; D34-V37 PolarHBondContact O-N 3.36Å; D34-V37 WeakPolarHBondContact OD1-CG2 3.35Å; D34-V37 PolarHBondContact OD1-N 2.9Å; D34-V37 WeakPolarHBondContact OD2-CG2 3.49Å; D34-L38 PolarHBondContact O-N 3.37Å | ||
| 35 | M | 41.9 | Very low | 46.7 | Very low | 159 Ų | 159 | 105.3 Ų | 105.3 | 78% | 0.783 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -52.8 | -20.2 | 168.3 | -91.2 | -170.4 | 153.7 | 0 | 0 | 112.9 | ||
| 36 | K | 43.5 | Very low | 46.6 | Very low | 186 Ų | 186 | 107 Ų | 107 | 81% | 0.809 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -81.3 | -37 | 177.4 | -67.8 | -179.2 | 178.2 | 178.7 | 0 | 112.1 | D34 | D34-K36 PolarHBondContact O-N 3.33Å; D34-K36 PolarHBondContact OD1-N 2.88Å |
| 37 | V | 46 | Very low | 46.8 | Very low | 70 Ų | 70 | 104.4 Ų | 104.4 | 42% | 0.424 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -71.6 | -36.9 | 170.7 | 170.6 | 0 | 0 | 0 | 0 | 111.1 | D34 N39 C40 F41 | D34-V37 HydrophobicContact CB-CB 3.92Å; D34-V37 HydrophobicContact CB-CG2 4.15Å; D34-V37 PolarHBondContact O-N 3.36Å; D34-V37 WeakPolarHBondContact OD1-CG2 3.35Å; D34-V37 PolarHBondContact OD1-N 2.9Å; D34-V37 WeakPolarHBondContact OD2-CG2 3.49Å; V37-N39 PolarHBondContact O-N 3.4Å; V37-N39 VanDerWaalsContact O-N 3.15Å; V37-C40 PolarHBondContact O-N 2.97Å; V37-F41 HydrophobicContact CG1-CD2 3.73Å; V37-F41 HydrophobicContact CG1-CE2 3.56Å; V37-F41 VanDerWaalsContact O-CD2 3.32Å; V37-F41 WeakPolarHBondContact O-CD2 3.2Å; V37-F41 PolarHBondContact O-N 3.48Å |
| 38 | L | 47 | Very low | 46.8 | Very low | 76 Ų | 76 | 103.6 Ų | 103.6 | 40% | 0.398 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -60.6 | -24.9 | 177.7 | -160.8 | 73.1 | 0 | 0 | 0 | 113.6 | D34 C40 F41 T42 | D34-L38 PolarHBondContact O-N 3.37Å; L38-C40 VanDerWaalsContact C-N 3.27Å; L38-C40 PolarHBondContact O-N 3.16Å; L38-F41 HydrophobicContact CD1-CB 4.46Å; L38-F41 CarbonylContact O-C 3.04Å; L38-F41 WeakPolarHBondContact O-CA 3.14Å; L38-F41 PolarHBondContact O-N 2.92Å; L38-T42 PolarHBondContact O-N 3.1Å |
| 39 | N | 42.5 | Very low | 47 | Very low | 125 Ų | 125 | 102.8 Ų | 102.8 | 67% | 0.668 | 52% | 0.521 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -68.3 | -27 | 177.6 | -132.2 | 5.8 | 0 | 0 | 0 | 112.7 | V37 T42 | V37-N39 PolarHBondContact O-N 3.4Å; V37-N39 VanDerWaalsContact O-N 3.15Å; N39-T42 PolarHBondContact O-OG1 3.11Å |
| 40 | C | 41.5 | Very low | 47.1 | Very low | 60 Ų | 60 | 99.8 Ų | 99.8 | 41% | 0.405 | 51% | 0.512 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.3 | -25.7 | 167.3 | -88.4 | 0 | 0 | 0 | 0 | 112.6 | V37 L38 T42 | V37-C40 PolarHBondContact O-N 2.97Å; L38-C40 VanDerWaalsContact C-N 3.27Å; L38-C40 PolarHBondContact O-N 3.16Å; C40-T42 VanDerWaalsContact C-N 3.33Å; C40-T42 PolarHBondContact O-N 3.33Å |
| 41 | F | 48.5 | Very low | 47.5 | Very low | 82 Ų | 82 | 97.4 Ų | 97.4 | 36% | 0.36 | 50% | 0.499 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -95.1 | 42.4 | 173.6 | -67.5 | -85.4 | 0 | 0 | 0 | 112.1 | V37 L38 L43 L70 | V37-F41 HydrophobicContact CG1-CD2 3.73Å; V37-F41 HydrophobicContact CG1-CE2 3.56Å; V37-F41 VanDerWaalsContact O-CD2 3.32Å; V37-F41 WeakPolarHBondContact O-CD2 3.2Å; V37-F41 PolarHBondContact O-N 3.48Å; L38-F41 HydrophobicContact CD1-CB 4.46Å; L38-F41 CarbonylContact O-C 3.04Å; L38-F41 WeakPolarHBondContact O-CA 3.14Å; L38-F41 PolarHBondContact O-N 2.92Å; F41-L43 HydrophobicContact CD1-CD1 4.19Å; F41-L43 PolarHBondContact O-N 3.01Å; F41-L70 HydrophobicContact CD1-CD2 4.15Å; F41-L70 HydrophobicContact CE1-CD2 3.84Å |
| 42 | T | 46.5 | Very low | 47.5 | Very low | 113 Ų | 113 | 100.4 Ų | 100.4 | 69% | 0.693 | 51% | 0.505 | S | S | * | . | trans | -68.7 | 42.5 | 162.7 | 36.2 | 0 | 0 | 0 | 0 | 111.3 | L38 N39 C40 D44 | L38-T42 PolarHBondContact O-N 3.1Å; N39-T42 PolarHBondContact O-OG1 3.11Å; C40-T42 VanDerWaalsContact C-N 3.33Å; C40-T42 PolarHBondContact O-N 3.33Å; T42-D44 VanDerWaalsContact C-N 3.33Å; T42-D44 PolarHBondContact O-N 2.96Å; T42-D44 VanDerWaalsContact O-N 3.08Å | ||
| 43 | L | 50.5 | Low | 47.5 | Very low | 57 Ų | 57 | 98.8 Ų | 98.8 | 30% | 0.298 | 50% | 0.5 | S | S | . | . | trans | -66.8 | 101 | 154.5 | -82.7 | 148 | 0 | 0 | 0 | 105.6 | F41 L45 V48 I51 L70 | F41-L43 HydrophobicContact CD1-CD1 4.19Å; F41-L43 PolarHBondContact O-N 3.01Å; L43-L45 PolarHBondContact O-N 3.05Å; L43-V48 HydrophobicContact CB-CG2 4.25Å; L43-I51 HydrophobicContact CD2-CD1 4.24Å; L43-L70 HydrophobicContact CD1-CD2 3.67Å; L43-L70 HydrophobicContact CD1-CG 4.48Å | ||
| 44 | D | 51.8 | Low | 47.5 | Very low | 83 Ų | 83 | 90.3 Ų | 90.3 | 44% | 0.444 | 47% | 0.474 | S | S | . | . | trans | -38 | 137.3 | 163.4 | -174.2 | -0.5 | 0 | 0 | 0 | 108.4 | T42 K46 S47 V48 | T42-D44 VanDerWaalsContact C-N 3.33Å; T42-D44 PolarHBondContact O-N 2.96Å; T42-D44 VanDerWaalsContact O-N 3.08Å; D44-K46 HydrophobicContact CB-CB 4.34Å; D44-K46 CarbonylContact O-C 3.54Å; D44-K46 PolarHBondContact O-N 3.47Å; D44-K46 PolarHBondContact OD1-N 3.06Å; D44-K46 WeakPolarHBondContact OD2-CB 3.35Å; D44-K46 WeakPolarHBondContact OD2-CD 3.38Å; D44-K46 WeakPolarHBondContact OD2-CG 3.25Å; D44-S47 WeakPolarHBondContact O-CA 3.44Å; D44-S47 VanDerWaalsContact O-CB 3.31Å; D44-S47 WeakPolarHBondContact O-CB 3.06Å; D44-S47 PolarHBondContact O-N 3.01Å; D44-V48 PolarHBondContact O-N 3.2Å; D44-V48 VanDerWaalsContact O-N 3.16Å | ||
| 45 | L | 46.8 | Very low | 47.5 | Very low | 135 Ų | 135 | 95.1 Ų | 95.1 | 71% | 0.707 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -48.5 | -29.2 | 174 | -83.1 | 154.7 | 0 | 0 | 0 | 110.7 | L43 V48 I49 | L43-L45 PolarHBondContact O-N 3.05Å; L45-V48 PolarHBondContact O-N 3.37Å; L45-I49 WeakPolarHBondContact O-CB 3.5Å; L45-I49 WeakPolarHBondContact O-CD1 3.32Å; L45-I49 WeakPolarHBondContact O-CG1 3.36Å; L45-I49 PolarHBondContact O-N 3.36Å |
| 46 | K | 47.2 | Very low | 48.1 | Very low | 152 Ų | 152 | 94.8 Ų | 94.8 | 66% | 0.661 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -61.7 | -41.2 | 170.5 | -61.9 | -173.5 | -172.1 | 169.6 | 0 | 114.2 | D44 I49 L50 | D44-K46 HydrophobicContact CB-CB 4.34Å; D44-K46 CarbonylContact O-C 3.54Å; D44-K46 PolarHBondContact O-N 3.47Å; D44-K46 PolarHBondContact OD1-N 3.06Å; D44-K46 WeakPolarHBondContact OD2-CB 3.35Å; D44-K46 WeakPolarHBondContact OD2-CD 3.38Å; D44-K46 WeakPolarHBondContact OD2-CG 3.25Å; K46-I49 PolarHBondContact O-N 3.5Å; K46-L50 WeakPolarHBondContact O-CB 3.43Å; K46-L50 PolarHBondContact O-N 3.19Å |
| 47 | S | 50.8 | Low | 48.2 | Very low | 44 Ų | 44 | 87.4 Ų | 87.4 | 31% | 0.308 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -67.6 | -38.4 | 175.7 | -56.7 | 0 | 0 | 0 | 0 | 111 | D44 L50 I51 | D44-S47 WeakPolarHBondContact O-CA 3.44Å; D44-S47 VanDerWaalsContact O-CB 3.31Å; D44-S47 WeakPolarHBondContact O-CB 3.06Å; D44-S47 PolarHBondContact O-N 3.01Å; S47-L50 PolarHBondContact O-N 3.32Å; S47-I51 WeakPolarHBondContact O-CD1 3.4Å; S47-I51 WeakPolarHBondContact O-CG1 3.39Å; S47-I51 PolarHBondContact O-N 2.89Å |
| 48 | V | 50.3 | Low | 48.2 | Very low | 56 Ų | 56 | 94.7 Ų | 94.7 | 34% | 0.339 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -60.4 | -50.6 | 171.1 | -177.7 | 0 | 0 | 0 | 0 | 109.5 | L43 D44 L45 L50 I51 Y52 | L43-V48 HydrophobicContact CB-CG2 4.25Å; D44-V48 PolarHBondContact O-N 3.2Å; D44-V48 VanDerWaalsContact O-N 3.16Å; L45-V48 PolarHBondContact O-N 3.37Å; V48-L50 VanDerWaalsContact C-N 3.27Å; V48-L50 PolarHBondContact O-N 3.38Å; V48-I51 WeakPolarHBondContact O-CB 3.45Å; V48-I51 PolarHBondContact O-N 3.4Å; V48-I51 VanDerWaalsContact O-N 3.11Å; V48-Y52 HydrophobicContact CG1-CD2 3.95Å; V48-Y52 HydrophobicContact CG1-CE2 3.81Å; V48-Y52 VanDerWaalsContact O-CD2 3.25Å; V48-Y52 WeakPolarHBondContact O-CD2 3.41Å; V48-Y52 PolarHBondContact O-N 3.35Å; V48-Y52 VanDerWaalsContact O-N 3.1Å |
| 49 | I | 50.3 | Low | 48.4 | Very low | 104 Ų | 104 | 96 Ų | 96 | 53% | 0.533 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.2 | -33.3 | 177.2 | -66.7 | 160.2 | 0 | 0 | 0 | 112.4 | L45 K46 Y52 T53 | L45-I49 WeakPolarHBondContact O-CB 3.5Å; L45-I49 WeakPolarHBondContact O-CD1 3.32Å; L45-I49 WeakPolarHBondContact O-CG1 3.36Å; L45-I49 PolarHBondContact O-N 3.36Å; K46-I49 PolarHBondContact O-N 3.5Å; I49-Y52 PolarHBondContact O-N 2.6Å; I49-T53 PolarHBondContact O-N 3.35Å; I49-T53 PolarHBondContact O-OG1 3.19Å |
| 50 | L | 47.4 | Very low | 48.9 | Very low | 80 Ų | 80 | 96.7 Ų | 96.7 | 42% | 0.419 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -68.7 | -35.6 | 176.4 | -155.2 | 86 | 0 | 0 | 0 | 112.3 | K46 S47 V48 Y52 T53 G54 | K46-L50 WeakPolarHBondContact O-CB 3.43Å; K46-L50 PolarHBondContact O-N 3.19Å; S47-L50 PolarHBondContact O-N 3.32Å; V48-L50 VanDerWaalsContact C-N 3.27Å; V48-L50 PolarHBondContact O-N 3.38Å; L50-Y52 VanDerWaalsContact C-N 3.33Å; L50-T53 WeakPolarHBondContact CA-OG1 3.37Å; L50-T53 PolarHBondContact O-OG1 2.92Å; L50-G54 PolarHBondContact O-N 3.49Å |
| 51 | I | 53.6 | Low | 49.6 | Very low | 33 Ų | 33 | 100.5 Ų | 100.5 | 17% | 0.169 | 51% | 0.509 | C | S | . | . | H | α-helix | trans | -65.2 | -40.8 | 173.5 | -66.9 | 164.5 | 0 | 0 | 0 | 110.2 | L43 S47 V48 R55 W63 V66 | L43-I51 HydrophobicContact CD2-CD1 4.24Å; S47-I51 WeakPolarHBondContact O-CD1 3.4Å; S47-I51 WeakPolarHBondContact O-CG1 3.39Å; S47-I51 PolarHBondContact O-N 2.89Å; V48-I51 WeakPolarHBondContact O-CB 3.45Å; V48-I51 PolarHBondContact O-N 3.4Å; V48-I51 VanDerWaalsContact O-N 3.11Å; I51-R55 PolarHBondContact O-N 3.38Å; I51-W63 HydrophobicContact CG2-CE3 3.95Å; I51-W63 HydrophobicContact CG2-CH2 4.02Å; I51-W63 HydrophobicContact CG2-CZ3 3.29Å; I51-V66 HydrophobicContact CD1-CG1 3.41Å; I51-V66 VanDerWaalsContact CD1-CG1 3.41Å; I51-V66 HydrophobicContact CG1-CB 4.34Å; I51-V66 HydrophobicContact CG1-CG1 3.63Å; I51-V66 HydrophobicContact CG1-CG2 4.01Å |
| 52 | Y | 48.3 | Very low | 49.8 | Very low | 102 Ų | 102 | 103.4 Ų | 103.4 | 40% | 0.4 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -69.7 | -43.5 | 177.3 | -85.3 | -86.3 | 0 | 0 | 0 | 112.6 | F23 V48 I49 L50 R55 | F23-Y52 WeakPolarHBondContact CD1-OH 3.44Å; F23-Y52 WeakPolarHBondContact CE1-OH 3.5Å; V48-Y52 HydrophobicContact CG1-CD2 3.95Å; V48-Y52 HydrophobicContact CG1-CE2 3.81Å; V48-Y52 VanDerWaalsContact O-CD2 3.25Å; V48-Y52 WeakPolarHBondContact O-CD2 3.41Å; V48-Y52 PolarHBondContact O-N 3.35Å; V48-Y52 VanDerWaalsContact O-N 3.1Å; I49-Y52 PolarHBondContact O-N 2.6Å; L50-Y52 VanDerWaalsContact C-N 3.33Å; Y52-R55 PolarHBondContact O-N 3.4Å |
| 53 | T | 48.1 | Very low | 50.2 | Low | 85 Ų | 85 | 102.3 Ų | 102.3 | 52% | 0.521 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -72.9 | -27.8 | 179.1 | 42.4 | 0 | 0 | 0 | 0 | 113.4 | I49 L50 G57 | I49-T53 PolarHBondContact O-N 3.35Å; I49-T53 PolarHBondContact O-OG1 3.19Å; L50-T53 WeakPolarHBondContact CA-OG1 3.37Å; L50-T53 PolarHBondContact O-OG1 2.92Å; T53-G57 PolarHBondContact O-N 3.42Å |
| 54 | G | 47.3 | Very low | 50.5 | Low | 23 Ų | 23 | 104 Ų | 104 | 24% | 0.237 | 51% | 0.511 | C | S | . | . | H | α-helix | trans | -76.7 | -19.4 | 173.4 | 0 | 0 | 0 | 0 | 0 | 114.8 | L50 | L50-G54 PolarHBondContact O-N 3.49Å |
| 55 | R | 48.3 | Very low | 50.9 | Low | 173 Ų | 173 | 104.5 Ų | 104.5 | 65% | 0.653 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -81 | -29.2 | 177.8 | -164.2 | 174 | -174.2 | -178.7 | -0.1 | 112.7 | I51 Y52 | I51-R55 PolarHBondContact O-N 3.38Å; Y52-R55 PolarHBondContact O-N 3.4Å |
| 56 | D | 53.7 | Low | 51.4 | Low | 151 Ų | 151 | 99.6 Ų | 99.6 | 81% | 0.807 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -98 | -4.3 | 180 | -79.7 | -29.8 | 0 | 0 | 0 | 114.5 | ||
| 57 | G | 45.3 | Very low | 51.7 | Low | 32 Ų | 32 | 96.3 Ų | 96.3 | 33% | 0.33 | 48% | 0.476 | S | S | . | . | S | Bend | trans | -176 | 121.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | T53 | T53-G57 PolarHBondContact O-N 3.42Š|
| 58 | Y | 45.8 | Very low | 52 | Low | 222 Ų | 222 | 100.4 Ų | 100.4 | 87% | 0.871 | 49% | 0.49 | S | S | * | . | S | Bend | trans | 68.4 | 111.1 | 164.7 | -62.7 | -94.9 | 0 | 0 | 0 | 116.7 | ||
| 59 | N | 51.3 | Low | 52.2 | Low | 104 Ų | 104 | 102.7 Ų | 102.7 | 56% | 0.556 | 50% | 0.5 | S | S | * | . | trans | 88.9 | 84.7 | 168.5 | -76 | -34.6 | 0 | 0 | 0 | 118.9 | H61 R62 | N59-H61 PolarHBondContact O-N 2.89Å; N59-H61 VanDerWaalsContact O-N 3.11Å; N59-R62 PolarHBondContact O-N 3.42Å | ||
| 60 | N | 53.1 | Low | 52.3 | Low | 140 Ų | 140 | 100 Ų | 100 | 75% | 0.749 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -47.7 | -32.8 | 160.4 | -69.3 | -14 | 0 | 0 | 0 | 113.2 | R62 W63 D64 | N60-R62 PolarHBondContact O-N 3.48Å; N60-R62 VanDerWaalsContact O-N 3.13Å; N60-W63 WeakPolarHBondContact O-CB 3.34Å; N60-W63 PolarHBondContact O-N 3.35Å; N60-D64 PolarHBondContact O-N 3Å |
| 61 | H | 56.1 | Low | 52.5 | Low | 139 Ų | 139 | 100 Ų | 100 | 64% | 0.644 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -57.7 | -27.5 | 176.8 | -79.7 | -58.4 | 0 | 0 | 0 | 114.6 | N59 I65 | N59-H61 PolarHBondContact O-N 2.89Å; N59-H61 VanDerWaalsContact O-N 3.11Å; H61-I65 WeakPolarHBondContact O-CD1 3.39Å; H61-I65 WeakPolarHBondContact O-CG1 3.47Å |
| 62 | R | 53 | Low | 52.2 | Low | 143 Ų | 143 | 101.9 Ų | 101.9 | 54% | 0.54 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -76.9 | -30.8 | 177.4 | -82.2 | -176.5 | 153.5 | -174.9 | -6.2 | 112.3 | N59 N60 V66 | N59-R62 PolarHBondContact O-N 3.42Å; N60-R62 PolarHBondContact O-N 3.48Å; N60-R62 VanDerWaalsContact O-N 3.13Å; R62-V66 VanDerWaalsContact O-CG2 3.32Å; R62-V66 WeakPolarHBondContact O-CG2 3.12Å; R62-V66 PolarHBondContact O-N 3.27Å |
| 63 | W | 55.9 | Low | 51.9 | Low | 91 Ų | 91 | 99.4 Ų | 99.4 | 35% | 0.345 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -66.6 | -42.3 | 176.5 | -174.9 | -94.2 | 0 | 0 | 0 | 111.3 | I51 N60 I65 V66 M67 | I51-W63 HydrophobicContact CG2-CE3 3.95Å; I51-W63 HydrophobicContact CG2-CH2 4.02Å; I51-W63 HydrophobicContact CG2-CZ3 3.29Å; N60-W63 WeakPolarHBondContact O-CB 3.34Å; N60-W63 PolarHBondContact O-N 3.35Å; W63-I65 PolarHBondContact O-N 3.45Å; W63-V66 PolarHBondContact O-N 2.96Å; W63-M67 HydrophobicContact CH2-CE 4.43Å; W63-M67 HydrophobicContact CZ2-CE 3.5Å; W63-M67 WeakPolarHBondContact O-CB 3.43Å; W63-M67 PolarHBondContact O-N 3.17Å |
| 64 | D | 55.9 | Low | 51.6 | Low | 93 Ų | 93 | 101.7 Ų | 101.7 | 50% | 0.497 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -59.7 | -45.5 | 178 | -63.1 | -30.3 | 0 | 0 | 0 | 111.5 | N60 V66 M67 E68 | N60-D64 PolarHBondContact O-N 3Å; D64-V66 PolarHBondContact O-N 3.47Å; D64-M67 PolarHBondContact O-N 3.21Å; D64-E68 VanDerWaalsContact O-CB 3.27Å; D64-E68 WeakPolarHBondContact O-CB 3.45Å; D64-E68 PolarHBondContact O-N 2.95Å |
| 65 | I | 60.2 | Low | 51.3 | Low | 93 Ų | 93 | 107.5 Ų | 107.5 | 48% | 0.477 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -64.4 | -40.2 | 179 | -64.2 | 166.5 | 0 | 0 | 0 | 111.6 | H61 W63 N69 | H61-I65 WeakPolarHBondContact O-CD1 3.39Å; H61-I65 WeakPolarHBondContact O-CG1 3.47Å; W63-I65 PolarHBondContact O-N 3.45Å; I65-N69 WeakPolarHBondContact O-CB 3.4Å; I65-N69 PolarHBondContact O-N 3.43Å; I65-N69 PolarHBondContact O-ND2 2.86Å |
| 66 | V | 58 | Low | 50.7 | Low | 32 Ų | 32 | 108.6 Ų | 108.6 | 19% | 0.194 | 54% | 0.538 | C | S | . | . | H | α-helix | trans | -66.4 | -46.7 | 176.8 | 171 | 0 | 0 | 0 | 0 | 110.5 | I51 R62 W63 D64 E68 N69 L70 | I51-V66 HydrophobicContact CD1-CG1 3.41Å; I51-V66 VanDerWaalsContact CD1-CG1 3.41Å; I51-V66 HydrophobicContact CG1-CB 4.34Å; I51-V66 HydrophobicContact CG1-CG1 3.63Å; I51-V66 HydrophobicContact CG1-CG2 4.01Å; R62-V66 VanDerWaalsContact O-CG2 3.32Å; R62-V66 WeakPolarHBondContact O-CG2 3.12Å; R62-V66 PolarHBondContact O-N 3.27Å; W63-V66 PolarHBondContact O-N 2.96Å; D64-V66 PolarHBondContact O-N 3.47Å; V66-E68 VanDerWaalsContact C-N 3.32Å; V66-E68 PolarHBondContact O-N 2.95Å; V66-N69 PolarHBondContact O-N 3.26Å; V66-L70 HydrophobicContact CG1-CD1 3.92Å; V66-L70 HydrophobicContact CG1-CG 4.5Å; V66-L70 WeakPolarHBondContact O-CB 3.33Å; V66-L70 WeakPolarHBondContact O-CG 3.43Å; V66-L70 PolarHBondContact O-N 3.28Å |
| 67 | M | 53.2 | Low | 49.8 | Very low | 83 Ų | 83 | 109 Ų | 109 | 41% | 0.409 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -64.7 | -36.8 | 179.1 | -84.2 | -64.6 | -168.7 | 0 | 0 | 112.2 | W63 D64 L70 T71 | W63-M67 HydrophobicContact CH2-CE 4.43Å; W63-M67 HydrophobicContact CZ2-CE 3.5Å; W63-M67 WeakPolarHBondContact O-CB 3.43Å; W63-M67 PolarHBondContact O-N 3.17Å; D64-M67 PolarHBondContact O-N 3.21Å; M67-L70 PolarHBondContact O-N 3Å; M67-L70 HydrophobicContact SD-CD1 4.09Å; M67-T71 WeakPolarHBondContact O-CB 3.23Å; M67-T71 PolarHBondContact O-N 2.92Å; M67-T71 PolarHBondContact O-OG1 2.87Å |
| 68 | E | 58 | Low | 50.1 | Low | 130 Ų | 130 | 112.9 Ų | 112.9 | 61% | 0.607 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -65 | -44.5 | 174.9 | -173 | 175.5 | -170.5 | 0 | 0 | 111.5 | D64 V66 L70 T71 T72 | D64-E68 VanDerWaalsContact O-CB 3.27Å; D64-E68 WeakPolarHBondContact O-CB 3.45Å; D64-E68 PolarHBondContact O-N 2.95Å; V66-E68 VanDerWaalsContact C-N 3.32Å; V66-E68 PolarHBondContact O-N 2.95Å; E68-L70 PolarHBondContact O-N 3.47Å; E68-T71 PolarHBondContact O-N 2.96Å; E68-T72 PolarHBondContact O-N 3.41Å; E68-T72 PolarHBondContact O-OG1 3.16Å |
| 69 | N | 53 | Low | 50.3 | Low | 103 Ų | 103 | 107.2 Ų | 107.2 | 55% | 0.551 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -63.9 | -38.3 | 175.2 | -79.1 | -30 | 0 | 0 | 0 | 112.6 | I65 V66 T71 T72 C73 | I65-N69 WeakPolarHBondContact O-CB 3.4Å; I65-N69 PolarHBondContact O-N 3.43Å; I65-N69 PolarHBondContact O-ND2 2.86Å; V66-N69 PolarHBondContact O-N 3.26Å; N69-T71 VanDerWaalsContact C-N 3.31Å; N69-T72 WeakPolarHBondContact CA-OG1 3.27Å; N69-T72 PolarHBondContact O-OG1 2.96Å; N69-C73 WeakPolarHBondContact O-CB 2.95Å; N69-C73 PolarHBondContact O-N 3.06Å; N69-C73 VanDerWaalsContact O-N 3.07Å |
| 70 | L | 53.7 | Low | 50.2 | Low | 49 Ų | 49 | 107.3 Ų | 107.3 | 26% | 0.257 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -63.5 | -38 | 173.2 | -80.4 | 167 | 0 | 0 | 0 | 111.9 | F41 L43 V66 M67 E68 K74 | F41-L70 HydrophobicContact CD1-CD2 4.15Å; F41-L70 HydrophobicContact CE1-CD2 3.84Å; L43-L70 HydrophobicContact CD1-CD2 3.67Å; L43-L70 HydrophobicContact CD1-CG 4.48Å; V66-L70 HydrophobicContact CG1-CD1 3.92Å; V66-L70 HydrophobicContact CG1-CG 4.5Å; V66-L70 WeakPolarHBondContact O-CB 3.33Å; V66-L70 WeakPolarHBondContact O-CG 3.43Å; V66-L70 PolarHBondContact O-N 3.28Å; M67-L70 PolarHBondContact O-N 3Å; M67-L70 HydrophobicContact SD-CD1 4.09Å; E68-L70 PolarHBondContact O-N 3.47Å; L70-K74 PolarHBondContact O-N 3.13Å |
| 71 | T | 50.5 | Low | 50.1 | Low | 80 Ų | 80 | 105.4 Ų | 105.4 | 49% | 0.491 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -75.6 | -39.9 | -179 | -53.5 | 0 | 0 | 0 | 0 | 111.8 | M67 E68 N69 C73 K74 L75 | M67-T71 WeakPolarHBondContact O-CB 3.23Å; M67-T71 PolarHBondContact O-N 2.92Å; M67-T71 PolarHBondContact O-OG1 2.87Å; E68-T71 PolarHBondContact O-N 2.96Å; N69-T71 VanDerWaalsContact C-N 3.31Å; T71-C73 VanDerWaalsContact C-N 3.33Å; T71-C73 PolarHBondContact O-N 3.19Å; T71-K74 PolarHBondContact O-N 3.44Å; T71-L75 PolarHBondContact O-N 3.4Å |
| 72 | T | 47.9 | Very low | 49.7 | Very low | 72 Ų | 72 | 103.3 Ų | 103.3 | 44% | 0.442 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -69.3 | -30.2 | 175.5 | 28.6 | 0 | 0 | 0 | 0 | 112.8 | E68 N69 K74 L75 | E68-T72 PolarHBondContact O-N 3.41Å; E68-T72 PolarHBondContact O-OG1 3.16Å; N69-T72 WeakPolarHBondContact CA-OG1 3.27Å; N69-T72 PolarHBondContact O-OG1 2.96Å; T72-K74 VanDerWaalsContact C-N 3.3Å; T72-K74 PolarHBondContact O-N 3.42Å; T72-L75 PolarHBondContact O-N 2.67Å |
| 73 | C | 42.8 | Very low | 49.5 | Very low | 50 Ų | 50 | 100.7 Ų | 100.7 | 34% | 0.338 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.2 | -36.5 | 171.5 | -171.5 | 0 | 0 | 0 | 0 | 112 | N69 T71 L75 | N69-C73 WeakPolarHBondContact O-CB 2.95Å; N69-C73 PolarHBondContact O-N 3.06Å; N69-C73 VanDerWaalsContact O-N 3.07Å; T71-C73 VanDerWaalsContact C-N 3.33Å; T71-C73 PolarHBondContact O-N 3.19Å; C73-L75 VanDerWaalsContact C-N 3.34Å; C73-L75 PolarHBondContact O-N 3.05Å |
| 74 | K | 40.7 | Very low | 49 | Very low | 133 Ų | 133 | 101.4 Ų | 101.4 | 58% | 0.578 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -71.9 | -17.6 | 176 | -82.5 | -177.8 | 174.9 | 177.2 | 0 | 115.2 | L70 T71 T72 | L70-K74 PolarHBondContact O-N 3.13Å; T71-K74 PolarHBondContact O-N 3.44Å; T72-K74 VanDerWaalsContact C-N 3.3Å; T72-K74 PolarHBondContact O-N 3.42Å |
| 75 | L | 40.3 | Very low | 48.5 | Very low | 144 Ų | 144 | 102 Ų | 102 | 75% | 0.754 | 53% | 0.533 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.7 | -1.1 | 179.4 | -80.2 | 162.3 | 0 | 0 | 0 | 113.6 | T71 T72 C73 | T71-L75 PolarHBondContact O-N 3.4Å; T72-L75 PolarHBondContact O-N 2.67Å; C73-L75 VanDerWaalsContact C-N 3.34Å; C73-L75 PolarHBondContact O-N 3.05Å |
| 76 | K | 36.3 | Very low | 47.5 | Very low | 197 Ų | 197 | 102.8 Ų | 102.8 | 86% | 0.857 | 54% | 0.537 | S | S | * | . | trans | -106.8 | -0.7 | 176.6 | -82.5 | -175.4 | 175.1 | 178.1 | 0 | 114.3 | ||||
| 77 | V | 35.6 | Very low | 46.5 | Very low | 160 Ų | 160 | 109.2 Ų | 109.2 | 97% | 0.97 | 57% | 0.568 | S | S | * | * | trans | -115.4 | 0 | 176.3 | -176.5 | 0 | 0 | 0 | 0 | 109 |
Retrieved 77 of 77 residues in 14.6 ms
(Link to these results)