| 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 | 59.9 | Low | 65.5 | Low | 233 Ų | 233 | 123.2 Ų | 123.2 | 100% | 1.148 | 63% | 0.627 | S | S | * | * | 0 | 107.4 | 0 | -172.8 | 165 | 163 | 0 | 0 | 106.6 | C3 | M1-C3 PolarHBondContact O-N 2.74Š| |||
| 2 | V | 59.7 | Low | 66.1 | Low | 108 Ų | 108 | 126.2 Ų | 126.2 | 66% | 0.655 | 63% | 0.632 | S | S | * | * | trans | -76.8 | 119.8 | 178.7 | -170.1 | 0 | 0 | 0 | 0 | 106.7 | D6 | V2-D6 HydrophobicContact CG1-CB 4.21Š| ||
| 3 | C | 69.4 | Low | 66.4 | Low | 69 Ų | 69 | 120.5 Ų | 120.5 | 47% | 0.466 | 62% | 0.617 | S | S | . | * | trans | -66.8 | 140.6 | -178.4 | -67.1 | 0 | 0 | 0 | 0 | 109.7 | M1 S5 D6 | M1-C3 PolarHBondContact O-N 2.74Å; C3-S5 PolarHBondContact O-N 2.93Å; C3-D6 WeakPolarHBondContact CB-OD2 3.39Å; C3-D6 WeakPolarHBondContact O-CB 3.35Å; C3-D6 PolarHBondContact O-N 2.61Å | ||
| 4 | F | 62.1 | Low | 67 | Low | 192 Ų | 192 | 115.9 Ų | 115.9 | 84% | 0.842 | 61% | 0.606 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.1 | -21.4 | -177.6 | -140.2 | -99.2 | 0 | 0 | 0 | 112.8 | D6 | F4-D6 VanDerWaalsContact C-N 3.33Š|
| 5 | S | 66.2 | Low | 67.9 | Low | 74 Ų | 74 | 113.7 Ų | 113.7 | 52% | 0.517 | 60% | 0.595 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -72.1 | -16.1 | 173.1 | 51.8 | 0 | 0 | 0 | 0 | 115.3 | C3 | C3-S5 PolarHBondContact O-N 2.93Š|
| 6 | D | 63.2 | Low | 69.3 | Low | 53 Ų | 53 | 110.3 Ų | 110.3 | 28% | 0.283 | 58% | 0.584 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -94 | -19.3 | -175.9 | -61.7 | -35.7 | 0 | 0 | 0 | 112.8 | V2 C3 F4 K9 L10 | V2-D6 HydrophobicContact CG1-CB 4.21Å; C3-D6 WeakPolarHBondContact CB-OD2 3.39Å; C3-D6 WeakPolarHBondContact O-CB 3.35Å; C3-D6 PolarHBondContact O-N 2.61Å; F4-D6 VanDerWaalsContact C-N 3.33Å; D6-K9 PolarHBondContact O-N 2.94Å; D6-K9 VanDerWaalsContact O-N 3.15Å; D6-K9 IonicContact OD1-NZ 3.98Å; D6-L10 HydrophobicContact CB-CD1 4.31Å; D6-L10 WeakPolarHBondContact O-CD1 3.49Å; D6-L10 PolarHBondContact O-N 3.11Å |
| 7 | L | 63.5 | Low | 70.7 | Confident | 113 Ų | 113 | 112.8 Ų | 112.8 | 59% | 0.592 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -56.3 | -47 | 176.4 | -128.3 | 83.8 | 0 | 0 | 0 | 113.3 | K9 L10 R11 | L7-K9 VanDerWaalsContact C-N 3.3Å; L7-K9 PolarHBondContact O-N 3.04Å; L7-L10 PolarHBondContact O-N 2.75Å; L7-R11 PolarHBondContact O-N 3.07Å; L7-R11 VanDerWaalsContact O-N 3.15Å |
| 8 | P | 68.6 | Low | 71.9 | Confident | 76 Ų | 76 | 117.4 Ų | 117.4 | 49% | 0.494 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -66.7 | -31.5 | 177.4 | -18.2 | 31.3 | 0 | 0 | 0 | 112.7 | K12 | P8-K12 WeakPolarHBondContact O-CG 3.41Å; P8-K12 PolarHBondContact O-N 3.4Å; P8-K12 VanDerWaalsContact O-N 3.16Å |
| 9 | K | 68 | Low | 73.1 | Confident | 138 Ų | 138 | 115.5 Ų | 115.5 | 60% | 0.6 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -73.1 | -41.9 | 179.2 | -63.1 | -179.3 | -175.6 | 168.2 | 0 | 111.3 | D6 L7 K12 A13 | D6-K9 PolarHBondContact O-N 2.94Å; D6-K9 VanDerWaalsContact O-N 3.15Å; D6-K9 IonicContact OD1-NZ 3.98Å; L7-K9 VanDerWaalsContact C-N 3.3Å; L7-K9 PolarHBondContact O-N 3.04Å; K9-K12 PolarHBondContact O-N 3.45Å; K9-A13 WeakPolarHBondContact O-CB 3.41Å; K9-A13 PolarHBondContact O-N 3.4Å |
| 10 | L | 69.3 | Low | 74.2 | Confident | 117 Ų | 117 | 116 Ų | 116 | 61% | 0.613 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -62.2 | -43.3 | 174.4 | -97.6 | 96.4 | 0 | 0 | 0 | 112 | D6 L7 A13 A14 | D6-L10 HydrophobicContact CB-CD1 4.31Å; D6-L10 WeakPolarHBondContact O-CD1 3.49Å; D6-L10 PolarHBondContact O-N 3.11Å; L7-L10 PolarHBondContact O-N 2.75Å; L10-A13 PolarHBondContact O-N 2.99Å; L10-A14 WeakPolarHBondContact O-CB 3.26Å; L10-A14 PolarHBondContact O-N 2.99Å |
| 11 | R | 70.8 | Confident | 75.3 | Confident | 182 Ų | 182 | 116.5 Ų | 116.5 | 69% | 0.687 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -61.5 | -47.9 | 177.8 | -174.9 | 175.8 | 171.6 | 175.1 | -0.6 | 111.7 | L7 A13 A14 D15 | L7-R11 PolarHBondContact O-N 3.07Å; L7-R11 VanDerWaalsContact O-N 3.15Å; R11-A13 VanDerWaalsContact C-N 3.32Å; R11-A13 PolarHBondContact O-N 3.46Å; R11-A14 PolarHBondContact O-N 3.21Å; R11-D15 WeakPolarHBondContact O-CB 3.29Å; R11-D15 PolarHBondContact O-N 3.07Å |
| 12 | K | 72.1 | Confident | 77 | Confident | 159 Ų | 159 | 111.9 Ų | 111.9 | 69% | 0.691 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -59.6 | -40.2 | 175.2 | -75.3 | -178.4 | 178.5 | -175.5 | 0 | 112.8 | P8 K9 S16 | P8-K12 WeakPolarHBondContact O-CG 3.41Å; P8-K12 PolarHBondContact O-N 3.4Å; P8-K12 VanDerWaalsContact O-N 3.16Å; K9-K12 PolarHBondContact O-N 3.45Å; K12-S16 WeakPolarHBondContact O-CB 3.4Å; K12-S16 PolarHBondContact O-N 3.02Å |
| 13 | A | 70.8 | Confident | 78.7 | Confident | 53 Ų | 53 | 114.1 Ų | 114.1 | 44% | 0.438 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -68 | -38.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | K9 L10 R11 S16 K17 | K9-A13 WeakPolarHBondContact O-CB 3.41Å; K9-A13 PolarHBondContact O-N 3.4Å; L10-A13 PolarHBondContact O-N 2.99Å; R11-A13 VanDerWaalsContact C-N 3.32Å; R11-A13 PolarHBondContact O-N 3.46Å; A13-S16 PolarHBondContact O-N 3.34Å; A13-K17 PolarHBondContact O-N 2.86Å; A13-K17 VanDerWaalsContact O-N 3.1Å |
| 14 | A | 74.5 | Confident | 80 | Confident | 56 Ų | 56 | 118 Ų | 118 | 46% | 0.463 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -66.2 | -44.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | L10 R11 S16 K17 R18 | L10-A14 WeakPolarHBondContact O-CB 3.26Å; L10-A14 PolarHBondContact O-N 2.99Å; R11-A14 PolarHBondContact O-N 3.21Å; A14-S16 VanDerWaalsContact C-N 3.3Å; A14-S16 PolarHBondContact O-N 2.88Å; A14-K17 PolarHBondContact O-N 2.95Å; A14-R18 PolarHBondContact O-N 3.36Å |
| 15 | D | 80.4 | Confident | 81.7 | Confident | 82 Ų | 82 | 110.5 Ų | 110.5 | 44% | 0.439 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61.6 | -39.8 | 175.7 | -68.5 | -27.3 | 0 | 0 | 0 | 111 | R11 R18 E19 | R11-D15 WeakPolarHBondContact O-CB 3.29Å; R11-D15 PolarHBondContact O-N 3.07Å; D15-R18 PolarHBondContact O-N 3.12Å; D15-E19 WeakPolarHBondContact O-CB 3.36Å; D15-E19 PolarHBondContact O-N 3Å |
| 16 | S | 90.7 | Very high | 82.9 | Confident | 59 Ų | 59 | 111 Ų | 111 | 41% | 0.413 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.5 | -44.5 | 175.9 | -177.1 | 0 | 0 | 0 | 0 | 112.9 | K12 A13 A14 E19 Q20 | K12-S16 WeakPolarHBondContact O-CB 3.4Å; K12-S16 PolarHBondContact O-N 3.02Å; A13-S16 PolarHBondContact O-N 3.34Å; A14-S16 VanDerWaalsContact C-N 3.3Å; A14-S16 PolarHBondContact O-N 2.88Å; S16-E19 PolarHBondContact O-N 3.32Å; S16-Q20 WeakPolarHBondContact O-CG 3.37Å; S16-Q20 PolarHBondContact O-N 3.39Å |
| 17 | K | 91.8 | Very high | 84.3 | Confident | 154 Ų | 154 | 118 Ų | 118 | 67% | 0.67 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -64.1 | -40.8 | 176.5 | -73.9 | -179.8 | 179.3 | -177.4 | 0 | 112 | A13 A14 Q20 F21 | A13-K17 PolarHBondContact O-N 2.86Å; A13-K17 VanDerWaalsContact O-N 3.1Å; A14-K17 PolarHBondContact O-N 2.95Å; K17-Q20 PolarHBondContact O-N 2.88Å; K17-F21 PolarHBondContact O-N 2.84Å |
| 18 | R | 93.1 | Very high | 85.5 | Confident | 195 Ų | 195 | 115.4 Ų | 115.4 | 74% | 0.736 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -62.4 | -43.9 | 177 | -175.5 | -179.7 | 176.9 | -175.4 | -0.4 | 111.5 | A14 D15 F21 R22 | A14-R18 PolarHBondContact O-N 3.36Å; D15-R18 PolarHBondContact O-N 3.12Å; R18-F21 PolarHBondContact O-N 2.92Å; R18-R22 PolarHBondContact O-N 2.92Å |
| 19 | E | 94.9 | Very high | 86.5 | Confident | 81 Ų | 81 | 113 Ų | 113 | 38% | 0.379 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.8 | -43.3 | 177.5 | 179.3 | 58.9 | -161.9 | 0 | 0 | 111.9 | D15 S16 F21 R22 R23 | D15-E19 WeakPolarHBondContact O-CB 3.36Å; D15-E19 PolarHBondContact O-N 3Å; S16-E19 PolarHBondContact O-N 3.32Å; E19-F21 VanDerWaalsContact C-N 3.31Å; E19-F21 PolarHBondContact O-N 3.39Å; E19-R22 PolarHBondContact O-N 3.24Å; E19-R23 WeakPolarHBondContact O-CG 3.37Å; E19-R23 PolarHBondContact O-N 3.3Å; E19-R23 IonicContact OE1-CZ 3.64Å; E19-R23 IonicContact OE1-NE 2.87Å; E19-R23 PolarHBondContact OE1-NE 3.35Å; E19-R23 IonicContact OE1-NH2 3.49Å; E19-R23 PolarHBondContact OE1-NH2 2.92Å |
| 20 | Q | 95.4 | Very high | 87.7 | Confident | 126 Ų | 126 | 109.2 Ų | 109.2 | 59% | 0.589 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -58.9 | -43.5 | 174.7 | -74.2 | 173.6 | 6.6 | 0 | 0 | 111.9 | S16 K17 R23 Y24 | S16-Q20 WeakPolarHBondContact O-CG 3.37Å; S16-Q20 PolarHBondContact O-N 3.39Å; K17-Q20 PolarHBondContact O-N 2.88Å; Q20-R23 PolarHBondContact O-N 3.01Å; Q20-Y24 PolarHBondContact O-N 3.44Å |
| 21 | F | 96.1 | Very high | 88.8 | Confident | 127 Ų | 127 | 106.1 Ų | 106.1 | 56% | 0.557 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -65.7 | -42.2 | 177.4 | -173.4 | -115.8 | 0 | 0 | 0 | 112 | K17 R18 E19 R23 Y24 L25 | K17-F21 PolarHBondContact O-N 2.84Å; R18-F21 PolarHBondContact O-N 2.92Å; E19-F21 VanDerWaalsContact C-N 3.31Å; E19-F21 PolarHBondContact O-N 3.39Å; F21-R23 PolarHBondContact O-N 3.47Å; F21-Y24 HydrophobicContact CD2-CD1 4.34Å; F21-Y24 HydrophobicContact CE2-CD1 4.28Å; F21-Y24 WeakPolarHBondContact O-CB 3.46Å; F21-Y24 PolarHBondContact O-N 3.49Å; F21-L25 HydrophobicContact CD1-CD1 4.13Å; F21-L25 HydrophobicContact CE1-CD1 3.68Å; F21-L25 HydrophobicContact CE1-CG 4.24Å; F21-L25 HydrophobicContact CE2-CD2 4.4Å; F21-L25 HydrophobicContact CZ-CD1 4.03Å; F21-L25 HydrophobicContact CZ-CD2 4.13Å; F21-L25 HydrophobicContact CZ-CG 4.22Å; F21-L25 WeakPolarHBondContact O-CG 3.48Å; F21-L25 PolarHBondContact O-N 3.35Å |
| 22 | R | 96 | Very high | 89.7 | Confident | 135 Ų | 135 | 101.4 Ų | 101.4 | 51% | 0.509 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -57.2 | -50 | 174.4 | -177.9 | -172.3 | 165.4 | 108.4 | 11.3 | 111.3 | R18 E19 Y24 L25 E26 | R18-R22 PolarHBondContact O-N 2.92Å; E19-R22 PolarHBondContact O-N 3.24Å; R22-Y24 VanDerWaalsContact C-N 3.27Å; R22-Y24 PolarHBondContact O-N 3.3Å; R22-L25 PolarHBondContact O-N 2.9Å; R22-L25 VanDerWaalsContact O-N 3.14Å; R22-E26 IonicContact CZ-OE1 3.18Å; R22-E26 IonicContact NE-OE1 2.77Å; R22-E26 PolarHBondContact NE-OE1 3.3Å; R22-E26 IonicContact NH2-OE1 2.78Å; R22-E26 PolarHBondContact NH2-OE1 3.36Å; R22-E26 WeakPolarHBondContact O-CG 3.32Å; R22-E26 PolarHBondContact O-N 3.49Å |
| 23 | R | 96.7 | Very high | 90.6 | Very high | 156 Ų | 156 | 95.9 Ų | 95.9 | 59% | 0.589 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -61.5 | -35 | 178.2 | -71.8 | -176.3 | -177.6 | -149.5 | -2.2 | 112.8 | E19 Q20 F21 E26 K27 | E19-R23 WeakPolarHBondContact O-CG 3.37Å; E19-R23 PolarHBondContact O-N 3.3Å; E19-R23 IonicContact OE1-CZ 3.64Å; E19-R23 IonicContact OE1-NE 2.87Å; E19-R23 PolarHBondContact OE1-NE 3.35Å; E19-R23 IonicContact OE1-NH2 3.49Å; E19-R23 PolarHBondContact OE1-NH2 2.92Å; Q20-R23 PolarHBondContact O-N 3.01Å; F21-R23 PolarHBondContact O-N 3.47Å; R23-E26 PolarHBondContact O-N 2.92Å; R23-K27 VanDerWaalsContact O-CB 3.26Å; R23-K27 WeakPolarHBondContact O-CB 3.47Å; R23-K27 PolarHBondContact O-N 3.2Å |
| 24 | Y | 96.8 | Very high | 91.7 | Very high | 149 Ų | 149 | 96.5 Ų | 96.5 | 58% | 0.584 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -62.6 | -46.6 | 173.8 | 166.9 | -101.1 | 0 | 0 | 0 | 111.5 | Q20 F21 R22 E26 K27 S28 | Q20-Y24 PolarHBondContact O-N 3.44Å; F21-Y24 HydrophobicContact CD2-CD1 4.34Å; F21-Y24 HydrophobicContact CE2-CD1 4.28Å; F21-Y24 WeakPolarHBondContact O-CB 3.46Å; F21-Y24 PolarHBondContact O-N 3.49Å; R22-Y24 VanDerWaalsContact C-N 3.27Å; R22-Y24 PolarHBondContact O-N 3.3Å; Y24-E26 VanDerWaalsContact C-N 3.33Å; Y24-E26 PolarHBondContact O-N 2.98Å; Y24-K27 PolarHBondContact O-N 3.07Å; Y24-S28 WeakPolarHBondContact O-CB 3.47Å; Y24-S28 PolarHBondContact O-N 3Å; Y24-S28 PolarHBondContact O-OG 2.66Å |
| 25 | L | 96.3 | Very high | 92.7 | Very high | 36 Ų | 36 | 97.7 Ų | 97.7 | 19% | 0.188 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -65.1 | -36.1 | 176.9 | -63.3 | -179.9 | 0 | 0 | 0 | 112.6 | F21 R22 S28 G29 V30 L31 | F21-L25 HydrophobicContact CD1-CD1 4.13Å; F21-L25 HydrophobicContact CE1-CD1 3.68Å; F21-L25 HydrophobicContact CE1-CG 4.24Å; F21-L25 HydrophobicContact CE2-CD2 4.4Å; F21-L25 HydrophobicContact CZ-CD1 4.03Å; F21-L25 HydrophobicContact CZ-CD2 4.13Å; F21-L25 HydrophobicContact CZ-CG 4.22Å; F21-L25 WeakPolarHBondContact O-CG 3.48Å; F21-L25 PolarHBondContact O-N 3.35Å; R22-L25 PolarHBondContact O-N 2.9Å; R22-L25 VanDerWaalsContact O-N 3.14Å; L25-S28 WeakPolarHBondContact CA-OG 3.43Å; L25-S28 PolarHBondContact O-OG 2.85Å; L25-G29 PolarHBondContact O-N 3.43Å; L25-V30 HydrophobicContact CB-CB 4.35Å; L25-V30 HydrophobicContact CD2-CB 4.07Å; L25-V30 HydrophobicContact CD2-CG1 4.04Å; L25-V30 HydrophobicContact CD2-CG2 4.26Å; L25-V30 PolarHBondContact O-N 3.04Å; L25-L31 HydrophobicContact CB-CD1 4.5Å; L25-L31 HydrophobicContact CB-CD2 3.95Å; L25-L31 HydrophobicContact CB-CG 3.84Å; L25-L31 HydrophobicContact CD1-CD2 4.15Å; L25-L31 PolarHBondContact O-N 3.44Å |
| 26 | E | 92 | Very high | 93.2 | Very high | 85 Ų | 85 | 99.9 Ų | 99.9 | 40% | 0.397 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -65.3 | -52.2 | 173.3 | -73.7 | 173.2 | 177 | 0 | 0 | 111.1 | R22 R23 Y24 S28 G29 L31 | R22-E26 IonicContact CZ-OE1 3.18Å; R22-E26 IonicContact NE-OE1 2.77Å; R22-E26 PolarHBondContact NE-OE1 3.3Å; R22-E26 IonicContact NH2-OE1 2.78Å; R22-E26 PolarHBondContact NH2-OE1 3.36Å; R22-E26 WeakPolarHBondContact O-CG 3.32Å; R22-E26 PolarHBondContact O-N 3.49Å; R23-E26 PolarHBondContact O-N 2.92Å; Y24-E26 VanDerWaalsContact C-N 3.33Å; Y24-E26 PolarHBondContact O-N 2.98Å; E26-S28 VanDerWaalsContact C-N 3.31Å; E26-S28 PolarHBondContact O-N 3.47Å; E26-G29 PolarHBondContact O-N 3.29Å; E26-G29 VanDerWaalsContact O-N 3.08Å; E26-L31 HydrophobicContact CG-CD1 3.45Å; E26-L31 VanDerWaalsContact CG-CD1 3.45Å; E26-L31 HydrophobicContact CG-CG 4.24Å |
| 27 | K | 92.4 | Very high | 93.4 | Very high | 198 Ų | 198 | 97.5 Ų | 97.5 | 86% | 0.861 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -65.5 | -32.3 | -177.3 | -173.9 | 178.2 | 177.6 | -176.6 | 0 | 113.1 | R23 Y24 G29 | R23-K27 VanDerWaalsContact O-CB 3.26Å; R23-K27 WeakPolarHBondContact O-CB 3.47Å; R23-K27 PolarHBondContact O-N 3.2Å; Y24-K27 PolarHBondContact O-N 3.07Å; K27-G29 VanDerWaalsContact C-N 3.28Å |
| 28 | S | 89.7 | Confident | 93.5 | Very high | 60 Ų | 60 | 94.7 Ų | 94.7 | 42% | 0.42 | 45% | 0.445 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.5 | -4.7 | 176.2 | 55.8 | 0 | 0 | 0 | 0 | 113.6 | Y24 L25 E26 V30 | Y24-S28 WeakPolarHBondContact O-CB 3.47Å; Y24-S28 PolarHBondContact O-N 3Å; Y24-S28 PolarHBondContact O-OG 2.66Å; L25-S28 WeakPolarHBondContact CA-OG 3.43Å; L25-S28 PolarHBondContact O-OG 2.85Å; E26-S28 VanDerWaalsContact C-N 3.31Å; E26-S28 PolarHBondContact O-N 3.47Å; S28-V30 VanDerWaalsContact C-N 3.27Å; S28-V30 PolarHBondContact O-N 3.02Å; S28-V30 WeakPolarHBondContact OG-CG2 3.49Å |
| 29 | G | 89.2 | Confident | 93.6 | Very high | 24 Ų | 24 | 88.5 Ų | 88.5 | 25% | 0.247 | 43% | 0.429 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 79.2 | 1.5 | 179.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | L25 E26 K27 L31 D32 T33 | L25-G29 PolarHBondContact O-N 3.43Å; E26-G29 PolarHBondContact O-N 3.29Å; E26-G29 VanDerWaalsContact O-N 3.08Å; K27-G29 VanDerWaalsContact C-N 3.28Å; G29-L31 VanDerWaalsContact C-N 3.31Å; G29-L31 PolarHBondContact O-N 3.1Å; G29-D32 PolarHBondContact O-N 3.03Å; G29-D32 VanDerWaalsContact O-N 3.15Å; G29-T33 PolarHBondContact O-N 3.26Å; G29-T33 PolarHBondContact O-OG1 3.39Å |
| 30 | V | 92.2 | Very high | 93.5 | Very high | 59 Ų | 59 | 86 Ų | 86 | 36% | 0.358 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -58.6 | -42.7 | -179.7 | 173.9 | 0 | 0 | 0 | 0 | 111.5 | L25 S28 D32 L34 | L25-V30 HydrophobicContact CB-CB 4.35Å; L25-V30 HydrophobicContact CD2-CB 4.07Å; L25-V30 HydrophobicContact CD2-CG1 4.04Å; L25-V30 HydrophobicContact CD2-CG2 4.26Å; L25-V30 PolarHBondContact O-N 3.04Å; S28-V30 VanDerWaalsContact C-N 3.27Å; S28-V30 PolarHBondContact O-N 3.02Å; S28-V30 WeakPolarHBondContact OG-CG2 3.49Å; V30-D32 VanDerWaalsContact C-N 3.35Å; V30-L34 HydrophobicContact CG1-CD1 3.86Å; V30-L34 HydrophobicContact CG1-CG 4.37Å; V30-L34 WeakPolarHBondContact O-CB 3.49Å; V30-L34 VanDerWaalsContact O-CG 3.31Å; V30-L34 WeakPolarHBondContact O-CG 3.28Å; V30-L34 PolarHBondContact O-N 2.93Å |
| 31 | L | 93.1 | Very high | 93.5 | Very high | 53 Ų | 53 | 81.3 Ų | 81.3 | 28% | 0.277 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -67 | -36.5 | 179 | -63.7 | -165.2 | 0 | 0 | 0 | 112.5 | L25 E26 G29 T35 | L25-L31 HydrophobicContact CB-CD1 4.5Å; L25-L31 HydrophobicContact CB-CD2 3.95Å; L25-L31 HydrophobicContact CB-CG 3.84Å; L25-L31 HydrophobicContact CD1-CD2 4.15Å; L25-L31 PolarHBondContact O-N 3.44Å; E26-L31 HydrophobicContact CG-CD1 3.45Å; E26-L31 VanDerWaalsContact CG-CD1 3.45Å; E26-L31 HydrophobicContact CG-CG 4.24Å; G29-L31 VanDerWaalsContact C-N 3.31Å; G29-L31 PolarHBondContact O-N 3.1Å; L31-T35 VanDerWaalsContact O-CB 3.31Å; L31-T35 WeakPolarHBondContact O-CB 3.49Å; L31-T35 PolarHBondContact O-N 3.49Å; L31-T35 PolarHBondContact O-OG1 3.06Å |
| 32 | D | 89.5 | Confident | 93.5 | Very high | 83 Ų | 83 | 84.3 Ų | 84.3 | 44% | 0.444 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -65.8 | -47.6 | 177.6 | 178 | 67.1 | 0 | 0 | 0 | 110.8 | G29 V30 L34 T35 K36 | G29-D32 PolarHBondContact O-N 3.03Å; G29-D32 VanDerWaalsContact O-N 3.15Å; V30-D32 VanDerWaalsContact C-N 3.35Å; D32-L34 PolarHBondContact O-N 3.05Å; D32-T35 WeakPolarHBondContact O-CB 3.27Å; D32-T35 PolarHBondContact O-N 2.95Å; D32-K36 WeakPolarHBondContact O-CG 3.46Å; D32-K36 PolarHBondContact O-N 3.01Å; D32-K36 IonicContact OD1-NZ 2.85Å; D32-K36 WeakPolarHBondContact OD2-CE 3.3Å; D32-K36 IonicContact OD2-NZ 2.77Å; D32-K36 PolarHBondContact OD2-NZ 3.38Å |
| 33 | T | 91.8 | Very high | 93.5 | Very high | 42 Ų | 42 | 84.6 Ų | 84.6 | 26% | 0.258 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -60.2 | -47.4 | 175.7 | -59.2 | 0 | 0 | 0 | 0 | 112.1 | G29 T35 K36 V37 L59 A62 | G29-T33 PolarHBondContact O-N 3.26Å; G29-T33 PolarHBondContact O-OG1 3.39Å; T33-T35 VanDerWaalsContact C-N 3.29Å; T33-T35 PolarHBondContact O-N 2.81Å; T33-K36 PolarHBondContact O-N 3.42Å; T33-V37 WeakPolarHBondContact O-CG2 3.45Å; T33-V37 PolarHBondContact O-N 2.93Å; T33-L59 HydrophobicContact CG2-CD2 4.14Å; T33-A62 HydrophobicContact CG2-CB 3.76Å |
| 34 | L | 93.9 | Very high | 93.4 | Very high | 67 Ų | 67 | 80.5 Ų | 80.5 | 35% | 0.351 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -60.3 | -41 | 176.6 | -74.3 | 171.4 | 0 | 0 | 0 | 111.6 | V30 D32 V37 L38 L59 | V30-L34 HydrophobicContact CG1-CD1 3.86Å; V30-L34 HydrophobicContact CG1-CG 4.37Å; V30-L34 WeakPolarHBondContact O-CB 3.49Å; V30-L34 VanDerWaalsContact O-CG 3.31Å; V30-L34 WeakPolarHBondContact O-CG 3.28Å; V30-L34 PolarHBondContact O-N 2.93Å; D32-L34 PolarHBondContact O-N 3.05Å; L34-V37 PolarHBondContact O-N 2.96Å; L34-L38 WeakPolarHBondContact O-CB 3.46Å; L34-L38 VanDerWaalsContact O-CG 3.25Å; L34-L38 WeakPolarHBondContact O-CG 3.2Å; L34-L38 PolarHBondContact O-N 3.41Å; L34-L59 HydrophobicContact CD2-CD1 4.41Å; L34-L59 HydrophobicContact CD2-CD2 4Å |
| 35 | T | 93.9 | Very high | 93 | Very high | 81 Ų | 81 | 79.3 Ų | 79.3 | 50% | 0.497 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -62.1 | -46.9 | 177.2 | -58.3 | 0 | 0 | 0 | 0 | 110.7 | L31 D32 T33 V37 L38 V39 | L31-T35 VanDerWaalsContact O-CB 3.31Å; L31-T35 WeakPolarHBondContact O-CB 3.49Å; L31-T35 PolarHBondContact O-N 3.49Å; L31-T35 PolarHBondContact O-OG1 3.06Å; D32-T35 WeakPolarHBondContact O-CB 3.27Å; D32-T35 PolarHBondContact O-N 2.95Å; T33-T35 VanDerWaalsContact C-N 3.29Å; T33-T35 PolarHBondContact O-N 2.81Å; T35-V37 PolarHBondContact O-N 2.68Å; T35-L38 PolarHBondContact O-N 2.77Å; T35-V39 HydrophobicContact CG2-CG2 4.36Å; T35-V39 VanDerWaalsContact O-CG2 3.28Å; T35-V39 WeakPolarHBondContact O-CG2 3.26Å; T35-V39 PolarHBondContact O-N 2.85Å |
| 36 | K | 92 | Very high | 92.9 | Very high | 128 Ų | 128 | 85.5 Ų | 85.5 | 56% | 0.557 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -59.6 | -45.1 | 177.8 | -73.8 | 168.5 | 175.7 | 167.5 | 0 | 112.8 | D32 T33 L38 V39 A40 | D32-K36 WeakPolarHBondContact O-CG 3.46Å; D32-K36 PolarHBondContact O-N 3.01Å; D32-K36 IonicContact OD1-NZ 2.85Å; D32-K36 WeakPolarHBondContact OD2-CE 3.3Å; D32-K36 IonicContact OD2-NZ 2.77Å; D32-K36 PolarHBondContact OD2-NZ 3.38Å; T33-K36 PolarHBondContact O-N 3.42Å; K36-L38 VanDerWaalsContact C-N 3.34Å; K36-L38 PolarHBondContact O-N 3.48Å; K36-V39 PolarHBondContact O-N 3.37Å; K36-A40 PolarHBondContact O-N 2.7Å |
| 37 | V | 94.1 | Very high | 93 | Very high | 8 Ų | 8 | 87 Ų | 87 | 5% | 0.048 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -64.9 | -39.4 | 178.2 | 174.6 | 0 | 0 | 0 | 0 | 111.5 | T33 L34 T35 A40 L41 L55 H58 L59 A62 | T33-V37 WeakPolarHBondContact O-CG2 3.45Å; T33-V37 PolarHBondContact O-N 2.93Å; L34-V37 PolarHBondContact O-N 2.96Å; T35-V37 PolarHBondContact O-N 2.68Å; V37-A40 PolarHBondContact O-N 2.85Å; V37-L41 PolarHBondContact O-N 3.35Å; V37-L55 HydrophobicContact CG1-CD1 4.38Å; V37-L55 HydrophobicContact CG1-CG 4.01Å; V37-H58 HydrophobicContact CB-CB 4.5Å; V37-H58 HydrophobicContact CG1-CB 3.75Å; V37-H58 HydrophobicContact CG2-CB 4.02Å; V37-L59 HydrophobicContact CG2-CD2 3.96Å; V37-L59 HydrophobicContact CG2-CG 4.36Å; V37-A62 HydrophobicContact CG2-CB 4.45Å |
| 38 | L | 95 | Very high | 93 | Very high | 96 Ų | 96 | 79.7 Ų | 79.7 | 50% | 0.503 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -68.5 | -37.6 | 176.6 | -71 | 172.9 | 0 | 0 | 0 | 112.4 | L34 T35 K36 L41 Y42 L55 | L34-L38 WeakPolarHBondContact O-CB 3.46Å; L34-L38 VanDerWaalsContact O-CG 3.25Å; L34-L38 WeakPolarHBondContact O-CG 3.2Å; L34-L38 PolarHBondContact O-N 3.41Å; T35-L38 PolarHBondContact O-N 2.77Å; K36-L38 VanDerWaalsContact C-N 3.34Å; K36-L38 PolarHBondContact O-N 3.48Å; L38-L41 PolarHBondContact O-N 2.77Å; L38-Y42 WeakPolarHBondContact O-CB 3.37Å; L38-Y42 PolarHBondContact O-N 2.87Å; L38-L55 HydrophobicContact CD2-CD2 4.45Å |
| 39 | V | 94.1 | Very high | 93.1 | Very high | 64 Ų | 64 | 85.5 Ų | 85.5 | 39% | 0.388 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -62.7 | -47.4 | 172.8 | 170.2 | 0 | 0 | 0 | 0 | 110.2 | T35 K36 L41 Y42 E43 | T35-V39 HydrophobicContact CG2-CG2 4.36Å; T35-V39 VanDerWaalsContact O-CG2 3.28Å; T35-V39 WeakPolarHBondContact O-CG2 3.26Å; T35-V39 PolarHBondContact O-N 2.85Å; K36-V39 PolarHBondContact O-N 3.37Å; V39-L41 VanDerWaalsContact C-N 3.33Å; V39-L41 PolarHBondContact O-N 3Å; V39-Y42 CarbonylContact O-C 3.54Å; V39-Y42 WeakPolarHBondContact O-CA 3.29Å; V39-Y42 WeakPolarHBondContact O-CB 3.45Å; V39-Y42 PolarHBondContact O-N 3.42Å; V39-E43 HydrophobicContact CG1-CG 4.25Å; V39-E43 WeakPolarHBondContact O-CG 3.23Å; V39-E43 PolarHBondContact O-N 3.23Å |
| 40 | A | 93.8 | Very high | 93.4 | Very high | 30 Ų | 30 | 86.4 Ų | 86.4 | 25% | 0.248 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -56.3 | -47.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | K36 V37 Y42 E43 E44 F54 | K36-A40 PolarHBondContact O-N 2.7Å; V37-A40 PolarHBondContact O-N 2.85Å; A40-Y42 VanDerWaalsContact C-N 3.28Å; A40-Y42 PolarHBondContact O-N 3.02Å; A40-E43 PolarHBondContact O-N 3.17Å; A40-E44 PolarHBondContact O-N 3.46Å; A40-F54 HydrophobicContact CB-CE1 4.37Å; A40-F54 HydrophobicContact CB-CZ 4.24Å |
| 41 | L | 95.8 | Very high | 93.5 | Very high | 27 Ų | 27 | 85.9 Ų | 85.9 | 14% | 0.141 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -61.1 | -36.8 | 175.4 | 179.1 | 61.8 | 0 | 0 | 0 | 112.4 | V37 L38 V39 K47 P48 A51 F54 L55 | V37-L41 PolarHBondContact O-N 3.35Å; L38-L41 PolarHBondContact O-N 2.77Å; V39-L41 VanDerWaalsContact C-N 3.33Å; V39-L41 PolarHBondContact O-N 3Å; L41-K47 PolarHBondContact O-NZ 3.06Å; L41-P48 HydrophobicContact CD1-CG 3.51Å; L41-A51 HydrophobicContact CD2-CB 3.96Å; L41-F54 HydrophobicContact CB-CD1 3.9Å; L41-F54 HydrophobicContact CB-CE1 3.65Å; L41-F54 HydrophobicContact CB-CZ 4.33Å; L41-F54 HydrophobicContact CD1-CB 4.34Å; L41-F54 HydrophobicContact CD1-CD1 3.86Å; L41-F54 HydrophobicContact CD1-CD2 4.35Å; L41-F54 HydrophobicContact CD1-CE1 4.22Å; L41-F54 HydrophobicContact CD1-CG 3.93Å; L41-F54 HydrophobicContact CG-CD1 4.34Å; L41-F54 HydrophobicContact CG-CE1 4.5Å; L41-L55 HydrophobicContact CD2-CD1 3.6Å |
| 42 | Y | 95.3 | Very high | 93.6 | Very high | 190 Ų | 190 | 89.2 Ų | 89.2 | 75% | 0.745 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -69.5 | -34.9 | 177.4 | 175.6 | -99.6 | 0 | 0 | 0 | 112.3 | L38 V39 A40 K47 | L38-Y42 WeakPolarHBondContact O-CB 3.37Å; L38-Y42 PolarHBondContact O-N 2.87Å; V39-Y42 CarbonylContact O-C 3.54Å; V39-Y42 WeakPolarHBondContact O-CA 3.29Å; V39-Y42 WeakPolarHBondContact O-CB 3.45Å; V39-Y42 PolarHBondContact O-N 3.42Å; A40-Y42 VanDerWaalsContact C-N 3.28Å; A40-Y42 PolarHBondContact O-N 3.02Å; Y42-K47 PolarHBondContact O-NZ 2.91Å |
| 43 | E | 95.2 | Very high | 93.8 | Very high | 140 Ų | 140 | 89.3 Ų | 89.3 | 65% | 0.654 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -81.2 | -16.7 | -179.6 | -69.3 | 177.4 | 164.6 | 0 | 0 | 113.5 | V39 A40 P45 | V39-E43 HydrophobicContact CG1-CG 4.25Å; V39-E43 WeakPolarHBondContact O-CG 3.23Å; V39-E43 PolarHBondContact O-N 3.23Å; A40-E43 PolarHBondContact O-N 3.17Å; E43-P45 WeakPolarHBondContact O-CD 3.49Å; E43-P45 VanDerWaalsContact O-N 3.16Å |
| 44 | E | 94.5 | Very high | 93.9 | Very high | 70 Ų | 70 | 88.4 Ų | 88.4 | 33% | 0.327 | 46% | 0.462 | S | S | . | . | trans | -52.9 | 119 | 176.4 | -80.9 | -59.5 | 159 | 0 | 0 | 111.9 | A40 E46 K47 F54 | A40-E44 PolarHBondContact O-N 3.46Å; E44-E46 VanDerWaalsContact C-N 3.32Å; E44-E46 PolarHBondContact O-N 3.01Å; E44-K47 PolarHBondContact O-NZ 3.28Å; E44-F54 HydrophobicContact CG-CE2 3.66Å; E44-F54 HydrophobicContact CG-CZ 3.95Å | ||
| 45 | P | 90.1 | Very high | 93.8 | Very high | 124 Ų | 124 | 87.1 Ų | 87.1 | 81% | 0.805 | 46% | 0.456 | S | S | * | . | S | Bend | trans | -67 | -34.7 | -178 | 26.1 | -33.8 | 0 | 0 | 0 | 111.8 | E43 | E43-P45 WeakPolarHBondContact O-CD 3.49Å; E43-P45 VanDerWaalsContact O-N 3.16Å |
| 46 | E | 93.9 | Very high | 93.7 | Very high | 167 Ų | 167 | 89.8 Ų | 89.8 | 78% | 0.78 | 46% | 0.46 | S | S | * | . | S | Bend | trans | -111.8 | 113.8 | 170.6 | -67.3 | -171.4 | 173.3 | 0 | 0 | 108.9 | E44 | E44-E46 VanDerWaalsContact C-N 3.32Å; E44-E46 PolarHBondContact O-N 3.01Å |
| 47 | K | 92.6 | Very high | 93.6 | Very high | 116 Ų | 116 | 90.2 Ų | 90.2 | 50% | 0.504 | 46% | 0.464 | S | S | . | . | trans | -65.7 | 132.4 | -178.5 | -64.8 | -58.5 | 176.5 | -143.1 | 0 | 110.5 | L41 Y42 E44 | L41-K47 PolarHBondContact O-NZ 3.06Å; Y42-K47 PolarHBondContact O-NZ 2.91Å; E44-K47 PolarHBondContact O-NZ 3.28Å | ||
| 48 | P | 92.9 | Very high | 93.3 | Very high | 44 Ų | 44 | 92.7 Ų | 92.7 | 29% | 0.286 | 48% | 0.475 | S | S | . | . | trans | -63.1 | 142.7 | 178.2 | 26.9 | -34.5 | 0 | 0 | 0 | 109.9 | L41 S50 F54 | L41-P48 HydrophobicContact CD1-CG 3.51Å; P48-S50 PolarHBondContact O-N 3.36Å; P48-S50 VanDerWaalsContact O-N 3.07Å; P48-F54 HydrophobicContact CB-CB 4.36Å; P48-F54 HydrophobicContact CB-CD2 4.44Å; P48-F54 HydrophobicContact CG-CB 3.87Å; P48-F54 HydrophobicContact CG-CD2 3.97Å; P48-F54 HydrophobicContact CG-CG 4.12Å | ||
| 49 | N | 92.9 | Very high | 93 | Very high | 183 Ų | 183 | 91 Ų | 91 | 98% | 0.979 | 47% | 0.466 | S | S | * | . | S | Bend | trans | -56.1 | -27.8 | 176.1 | -67 | -34 | 0 | 0 | 0 | 112.5 | ||
| 50 | S | 95.6 | Very high | 92.3 | Very high | 43 Ų | 43 | 90.5 Ų | 90.5 | 30% | 0.301 | 47% | 0.474 | S | S | . | . | trans | -130 | 101.7 | 175.2 | 177.7 | 0 | 0 | 0 | 0 | 110.5 | P48 L52 D53 F54 | P48-S50 PolarHBondContact O-N 3.36Å; P48-S50 VanDerWaalsContact O-N 3.07Å; S50-L52 PolarHBondContact O-N 2.95Å; S50-D53 WeakPolarHBondContact CB-OD2 3.2Å; S50-D53 PolarHBondContact O-N 3.37Å; S50-D53 PolarHBondContact OG-N 3.46Å; S50-D53 PolarHBondContact OG-OD2 2.87Å; S50-F54 PolarHBondContact O-N 3.36Å | ||
| 51 | A | 94.3 | Very high | 91.3 | Very high | 48 Ų | 48 | 92.5 Ų | 92.5 | 40% | 0.397 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -61 | -33.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | L41 F54 L55 | L41-A51 HydrophobicContact CD2-CB 3.96Å; A51-F54 WeakPolarHBondContact O-CB 3.18Å; A51-F54 PolarHBondContact O-N 2.9Å; A51-L55 WeakPolarHBondContact O-CD1 3.5Å; A51-L55 PolarHBondContact O-N 3.14Å |
| 52 | L | 93.9 | Very high | 89.8 | Confident | 123 Ų | 123 | 93.2 Ų | 93.2 | 64% | 0.644 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -65.9 | -39.7 | 178.3 | -73.9 | 177.7 | 0 | 0 | 0 | 112.1 | S50 L55 K56 | S50-L52 PolarHBondContact O-N 2.95Å; L52-L55 PolarHBondContact O-N 3.44Å; L52-K56 WeakPolarHBondContact O-CG 3.27Å; L52-K56 PolarHBondContact O-N 2.92Å |
| 53 | D | 93.9 | Very high | 88.1 | Confident | 85 Ų | 85 | 88.4 Ų | 88.4 | 46% | 0.455 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -72.4 | -34.9 | 178.8 | -62.5 | -37 | 0 | 0 | 0 | 111.5 | S50 L55 K56 H57 | S50-D53 WeakPolarHBondContact CB-OD2 3.2Å; S50-D53 PolarHBondContact O-N 3.37Å; S50-D53 PolarHBondContact OG-N 3.46Å; S50-D53 PolarHBondContact OG-OD2 2.87Å; D53-L55 PolarHBondContact O-N 3.37Å; D53-K56 PolarHBondContact O-N 3.33Å; D53-K56 IonicContact OD1-NZ 2.7Å; D53-K56 PolarHBondContact OD1-NZ 3.19Å; D53-H57 WeakPolarHBondContact O-CB 3.33Å; D53-H57 PolarHBondContact O-N 3.02Å |
| 54 | F | 93.9 | Very high | 86.3 | Confident | 23 Ų | 23 | 87 Ų | 87 | 10% | 0.101 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -56 | -49.6 | 168.9 | -176.1 | -81.3 | 0 | 0 | 0 | 111.5 | A40 L41 E44 P48 S50 A51 H57 H58 | A40-F54 HydrophobicContact CB-CE1 4.37Å; A40-F54 HydrophobicContact CB-CZ 4.24Å; L41-F54 HydrophobicContact CB-CD1 3.9Å; L41-F54 HydrophobicContact CB-CE1 3.65Å; L41-F54 HydrophobicContact CB-CZ 4.33Å; L41-F54 HydrophobicContact CD1-CB 4.34Å; L41-F54 HydrophobicContact CD1-CD1 3.86Å; L41-F54 HydrophobicContact CD1-CD2 4.35Å; L41-F54 HydrophobicContact CD1-CE1 4.22Å; L41-F54 HydrophobicContact CD1-CG 3.93Å; L41-F54 HydrophobicContact CG-CD1 4.34Å; L41-F54 HydrophobicContact CG-CE1 4.5Å; E44-F54 HydrophobicContact CG-CE2 3.66Å; E44-F54 HydrophobicContact CG-CZ 3.95Å; P48-F54 HydrophobicContact CB-CB 4.36Å; P48-F54 HydrophobicContact CB-CD2 4.44Å; P48-F54 HydrophobicContact CG-CB 3.87Å; P48-F54 HydrophobicContact CG-CD2 3.97Å; P48-F54 HydrophobicContact CG-CG 4.12Å; S50-F54 PolarHBondContact O-N 3.36Å; A51-F54 WeakPolarHBondContact O-CB 3.18Å; A51-F54 PolarHBondContact O-N 2.9Å; F54-H57 PolarHBondContact O-N 2.93Å; F54-H58 AromaticContact CD1-ND1 3.59Å; F54-H58 AromaticContact CD2-CE1 3.59Å; F54-H58 AromaticContact CD2-ND1 3.8Å; F54-H58 HydrophobicContact CE1-CB 4.44Å; F54-H58 AromaticContact CE1-CE1 3.69Å; F54-H58 AromaticContact CE1-CG 3.75Å; F54-H58 AromaticContact CE1-ND1 3.5Å; F54-H58 WeakPolarHBondContact CE1-ND1 3.41Å; F54-H58 AromaticContact CE2-CE1 3.18Å; F54-H58 WeakPolarHBondContact CE2-CE1 3.47Å; F54-H58 AromaticContact CE2-ND1 3.73Å; F54-H58 AromaticContact CE2-NE2 3.79Å; F54-H58 AromaticContact CG-ND1 3.74Å; F54-H58 AromaticContact CZ-CD2 3.95Å; F54-H58 AromaticContact CZ-CE1 3.23Å; F54-H58 WeakPolarHBondContact CZ-CE1 3.38Å; F54-H58 AromaticContact CZ-ND1 3.58Å; F54-H58 AromaticContact CZ-NE2 3.49Å; F54-H58 WeakPolarHBondContact CZ-NE2 3.47Å; F54-H58 WeakPolarHBondContact O-CB 3.47Å; F54-H58 PolarHBondContact O-N 3.34Å; F54-H58 PolarHBondContact O-ND1 3Å |
| 55 | L | 92.6 | Very high | 84.7 | Confident | 40 Ų | 40 | 88.8 Ų | 88.8 | 21% | 0.209 | 50% | 0.502 | C | S | . | . | H | α-helix | trans | -60.2 | -46.8 | 177.9 | -97.2 | 71.7 | 0 | 0 | 0 | 111.9 | V37 L38 L41 A51 L52 D53 H57 H58 L59 | V37-L55 HydrophobicContact CG1-CD1 4.38Å; V37-L55 HydrophobicContact CG1-CG 4.01Å; L38-L55 HydrophobicContact CD2-CD2 4.45Å; L41-L55 HydrophobicContact CD2-CD1 3.6Å; A51-L55 WeakPolarHBondContact O-CD1 3.5Å; A51-L55 PolarHBondContact O-N 3.14Å; L52-L55 PolarHBondContact O-N 3.44Å; D53-L55 PolarHBondContact O-N 3.37Å; L55-H57 VanDerWaalsContact C-N 3.32Å; L55-H57 PolarHBondContact O-N 3Å; L55-H58 PolarHBondContact O-N 3.39Å; L55-L59 VanDerWaalsContact O-CB 3.27Å; L55-L59 WeakPolarHBondContact O-CB 3.35Å; L55-L59 WeakPolarHBondContact O-CD1 3.18Å; L55-L59 WeakPolarHBondContact O-CG 3.49Å; L55-L59 PolarHBondContact O-N 3.44Å |
| 56 | K | 90.8 | Very high | 83.5 | Confident | 137 Ų | 137 | 86.1 Ų | 86.1 | 60% | 0.596 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -58.3 | -45.8 | 179.1 | -71 | 171.2 | -163.1 | 158.5 | 0 | 111.6 | L52 D53 G60 | L52-K56 WeakPolarHBondContact O-CG 3.27Å; L52-K56 PolarHBondContact O-N 2.92Å; D53-K56 PolarHBondContact O-N 3.33Å; D53-K56 IonicContact OD1-NZ 2.7Å; D53-K56 PolarHBondContact OD1-NZ 3.19Å; K56-G60 PolarHBondContact O-N 3.46Å; K56-G60 VanDerWaalsContact O-N 3.17Å |
| 57 | H | 89.6 | Confident | 82.6 | Confident | 137 Ų | 137 | 82.6 Ų | 82.6 | 63% | 0.634 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -64.5 | -49.5 | -179.8 | -174.5 | 72.7 | 0 | 0 | 0 | 111.3 | D53 F54 L55 L59 G60 A61 | D53-H57 WeakPolarHBondContact O-CB 3.33Å; D53-H57 PolarHBondContact O-N 3.02Å; F54-H57 PolarHBondContact O-N 2.93Å; L55-H57 VanDerWaalsContact C-N 3.32Å; L55-H57 PolarHBondContact O-N 3Å; H57-L59 PolarHBondContact O-N 3.48Å; H57-G60 PolarHBondContact O-N 3.49Å; H57-A61 PolarHBondContact O-N 3.02Å |
| 58 | H | 88.8 | Confident | 81.8 | Confident | 59 Ų | 59 | 82.9 Ų | 82.9 | 27% | 0.273 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -70.1 | -31.8 | -176.9 | -76.7 | 76.6 | 0 | 0 | 0 | 113 | V37 F54 L55 A61 A62 | V37-H58 HydrophobicContact CB-CB 4.5Å; V37-H58 HydrophobicContact CG1-CB 3.75Å; V37-H58 HydrophobicContact CG2-CB 4.02Å; F54-H58 AromaticContact CD1-ND1 3.59Å; F54-H58 AromaticContact CD2-CE1 3.59Å; F54-H58 AromaticContact CD2-ND1 3.8Å; F54-H58 HydrophobicContact CE1-CB 4.44Å; F54-H58 AromaticContact CE1-CE1 3.69Å; F54-H58 AromaticContact CE1-CG 3.75Å; F54-H58 AromaticContact CE1-ND1 3.5Å; F54-H58 WeakPolarHBondContact CE1-ND1 3.41Å; F54-H58 AromaticContact CE2-CE1 3.18Å; F54-H58 WeakPolarHBondContact CE2-CE1 3.47Å; F54-H58 AromaticContact CE2-ND1 3.73Å; F54-H58 AromaticContact CE2-NE2 3.79Å; F54-H58 AromaticContact CG-ND1 3.74Å; F54-H58 AromaticContact CZ-CD2 3.95Å; F54-H58 AromaticContact CZ-CE1 3.23Å; F54-H58 WeakPolarHBondContact CZ-CE1 3.38Å; F54-H58 AromaticContact CZ-ND1 3.58Å; F54-H58 AromaticContact CZ-NE2 3.49Å; F54-H58 WeakPolarHBondContact CZ-NE2 3.47Å; F54-H58 WeakPolarHBondContact O-CB 3.47Å; F54-H58 PolarHBondContact O-N 3.34Å; F54-H58 PolarHBondContact O-ND1 3Å; L55-H58 PolarHBondContact O-N 3.39Å; H58-A61 PolarHBondContact O-N 2.81Å; H58-A62 WeakPolarHBondContact O-CB 3.3Å; H58-A62 PolarHBondContact O-N 3.02Å |
| 59 | L | 88.3 | Confident | 81.2 | Confident | 61 Ų | 61 | 84.4 Ų | 84.4 | 32% | 0.319 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -69.5 | -35.2 | 173 | -71.4 | 169.1 | 0 | 0 | 0 | 112.3 | T33 L34 V37 L55 H57 A61 | T33-L59 HydrophobicContact CG2-CD2 4.14Å; L34-L59 HydrophobicContact CD2-CD1 4.41Å; L34-L59 HydrophobicContact CD2-CD2 4Å; V37-L59 HydrophobicContact CG2-CD2 3.96Å; V37-L59 HydrophobicContact CG2-CG 4.36Å; L55-L59 VanDerWaalsContact O-CB 3.27Å; L55-L59 WeakPolarHBondContact O-CB 3.35Å; L55-L59 WeakPolarHBondContact O-CD1 3.18Å; L55-L59 WeakPolarHBondContact O-CG 3.49Å; L55-L59 PolarHBondContact O-N 3.44Å; H57-L59 PolarHBondContact O-N 3.48Å; L59-A61 VanDerWaalsContact C-N 3.33Å |
| 60 | G | 79.8 | Confident | 80.8 | Confident | 54 Ų | 54 | 79.6 Ų | 79.6 | 56% | 0.557 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -70.2 | -28.7 | 173.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | K56 H57 T63 | K56-G60 PolarHBondContact O-N 3.46Å; K56-G60 VanDerWaalsContact O-N 3.17Å; H57-G60 PolarHBondContact O-N 3.49Å; G60-T63 PolarHBondContact O-OG1 3.13Å; G60-T63 VanDerWaalsContact O-OG1 3.06Å |
| 61 | A | 72.3 | Confident | 80.4 | Confident | 72 Ų | 72 | 82.4 Ų | 82.4 | 60% | 0.595 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -85.7 | -26.7 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | H57 H58 L59 T63 | H57-A61 PolarHBondContact O-N 3.02Å; H58-A61 PolarHBondContact O-N 2.81Å; L59-A61 VanDerWaalsContact C-N 3.33Å; A61-T63 VanDerWaalsContact C-N 3.31Å; A61-T63 PolarHBondContact O-N 2.9Å |
| 62 | A | 64.3 | Low | 80.2 | Confident | 41 Ų | 41 | 84.8 Ų | 84.8 | 34% | 0.339 | 47% | 0.469 | S | S | . | . | S | Bend | trans | -81.5 | -5.6 | -177.8 | 0 | 0 | 0 | 0 | 0 | 114 | T33 V37 H58 P64 | T33-A62 HydrophobicContact CG2-CB 3.76Å; V37-A62 HydrophobicContact CG2-CB 4.45Å; H58-A62 WeakPolarHBondContact O-CB 3.3Å; H58-A62 PolarHBondContact O-N 3.02Å; A62-P64 VanDerWaalsContact O-CD 3.3Å; A62-P64 WeakPolarHBondContact O-CD 3.39Å |
| 63 | T | 59.5 | Low | 80.1 | Confident | 89 Ų | 89 | 84.7 Ų | 84.7 | 55% | 0.546 | 46% | 0.46 | S | S | . | . | S | Bend | trans | -65.4 | 118.2 | 161.6 | 45.8 | 0 | 0 | 0 | 0 | 107.3 | G60 A61 E65 | G60-T63 PolarHBondContact O-OG1 3.13Å; G60-T63 VanDerWaalsContact O-OG1 3.06Å; A61-T63 VanDerWaalsContact C-N 3.31Å; A61-T63 PolarHBondContact O-N 2.9Å; T63-E65 PolarHBondContact O-N 2.93Å; T63-E65 VanDerWaalsContact O-N 3.13Å |
| 64 | P | 58.3 | Low | 80.2 | Confident | 112 Ų | 112 | 85.5 Ų | 85.5 | 73% | 0.727 | 46% | 0.464 | S | S | * | . | P | Polyproline II helix | trans | -49.6 | 128.2 | 168.5 | -19.1 | 29.6 | 0 | 0 | 0 | 106.7 | A62 N66 | A62-P64 VanDerWaalsContact O-CD 3.3Å; A62-P64 WeakPolarHBondContact O-CD 3.39Å; P64-N66 PolarHBondContact O-N 2.68Å |
| 65 | E | 59.6 | Low | 80.3 | Confident | 106 Ų | 106 | 89.8 Ų | 89.8 | 50% | 0.495 | 48% | 0.484 | S | S | . | . | P | Polyproline II helix | trans | -49.3 | 117.1 | 169.8 | -69.8 | -172.4 | 132.5 | 0 | 0 | 105.7 | T63 P67 E70 R73 | T63-E65 PolarHBondContact O-N 2.93Å; T63-E65 VanDerWaalsContact O-N 3.13Å; E65-P67 VanDerWaalsContact O-N 3.1Å; E65-E70 HydrophobicContact CB-CG 4.3Å; E65-E70 VanDerWaalsContact OE2-OE1 3.11Å; E65-R73 IonicContact OE1-CZ 2.85Å; E65-R73 VanDerWaalsContact OE1-CZ 3.25Å; E65-R73 IonicContact OE1-NH1 3.8Å; E65-R73 PolarHBondContact OE1-NH1 3.08Å; E65-R73 IonicContact OE1-NH2 3.52Å; E65-R73 PolarHBondContact OE1-NH2 3.21Å; E65-R73 IonicContact OE2-CZ 2.66Å; E65-R73 IonicContact OE2-NH1 3.25Å; E65-R73 PolarHBondContact OE2-NH1 3.49Å |
| 66 | N | 66.8 | Low | 80.4 | Confident | 68 Ų | 68 | 92.7 Ų | 92.7 | 36% | 0.364 | 50% | 0.499 | S | S | . | . | P | Polyproline II helix | trans | -47.7 | 126.8 | -172.9 | 171.6 | 1.2 | 0 | 0 | 0 | 106.3 | P64 E68 I69 E70 | P64-N66 PolarHBondContact O-N 2.68Å; N66-E68 PolarHBondContact ND2-OE2 3.46Å; N66-E68 VanDerWaalsContact ND2-OE2 3.14Å; N66-E68 CarbonylContact O-C 3.6Å; N66-E68 PolarHBondContact O-N 2.98Å; N66-E68 VanDerWaalsContact OD1-CB 3.25Å; N66-E68 WeakPolarHBondContact OD1-CB 3.41Å; N66-E68 PolarHBondContact OD1-N 3.47Å; N66-E68 VanDerWaalsContact OD1-N 3.08Å; N66-I69 HydrophobicContact CB-CB 4.33Å; N66-I69 HydrophobicContact CB-CD1 3.77Å; N66-I69 HydrophobicContact CB-CG1 3.88Å; N66-I69 WeakPolarHBondContact O-CA 3.06Å; N66-I69 VanDerWaalsContact O-CB 3.28Å; N66-I69 WeakPolarHBondContact O-CB 3.43Å; N66-I69 PolarHBondContact O-N 3.14Å; N66-E70 PolarHBondContact O-N 2.86Å |
| 67 | P | 73.6 | Confident | 80.8 | Confident | 94 Ų | 94 | 88.8 Ų | 88.8 | 61% | 0.61 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -52.3 | -25.5 | -179.3 | 16.1 | -29.8 | 0 | 0 | 0 | 112.6 | E65 E70 L71 | E65-P67 VanDerWaalsContact O-N 3.1Å; P67-E70 PolarHBondContact O-N 3.26Å; P67-L71 WeakPolarHBondContact O-CB 3.28Å; P67-L71 PolarHBondContact O-N 3.46Å |
| 68 | E | 75.5 | Confident | 81.2 | Confident | 122 Ų | 122 | 86.6 Ų | 86.6 | 57% | 0.57 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -65.3 | -38.9 | 169.1 | -166.6 | 175.7 | -163.7 | 0 | 0 | 113.8 | N66 L71 L72 | N66-E68 PolarHBondContact ND2-OE2 3.46Å; N66-E68 VanDerWaalsContact ND2-OE2 3.14Å; N66-E68 CarbonylContact O-C 3.6Å; N66-E68 PolarHBondContact O-N 2.98Å; N66-E68 VanDerWaalsContact OD1-CB 3.25Å; N66-E68 WeakPolarHBondContact OD1-CB 3.41Å; N66-E68 PolarHBondContact OD1-N 3.47Å; N66-E68 VanDerWaalsContact OD1-N 3.08Å; E68-L71 PolarHBondContact O-N 3.26Å; E68-L72 HydrophobicContact CG-CD1 4.39Å; E68-L72 WeakPolarHBondContact O-CB 3.4Å; E68-L72 WeakPolarHBondContact O-CG 3.45Å; E68-L72 PolarHBondContact O-N 2.91Å |
| 69 | I | 80.9 | Confident | 81.6 | Confident | 75 Ų | 75 | 89.8 Ų | 89.8 | 39% | 0.385 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.1 | -42 | 173.2 | -67.6 | 170.4 | 0 | 0 | 0 | 110.6 | N66 L72 R73 | N66-I69 HydrophobicContact CB-CB 4.33Å; N66-I69 HydrophobicContact CB-CD1 3.77Å; N66-I69 HydrophobicContact CB-CG1 3.88Å; N66-I69 WeakPolarHBondContact O-CA 3.06Å; N66-I69 VanDerWaalsContact O-CB 3.28Å; N66-I69 WeakPolarHBondContact O-CB 3.43Å; N66-I69 PolarHBondContact O-N 3.14Å; I69-L72 PolarHBondContact O-N 2.88Å; I69-R73 WeakPolarHBondContact O-CG 3.34Å; I69-R73 PolarHBondContact O-N 2.93Å |
| 70 | E | 83.9 | Confident | 82 | Confident | 83 Ų | 83 | 92.7 Ų | 92.7 | 39% | 0.388 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.5 | -43.2 | 176.5 | -73.9 | -57.2 | 105.7 | 0 | 0 | 111.9 | E65 N66 P67 R73 L74 | E65-E70 HydrophobicContact CB-CG 4.3Å; E65-E70 VanDerWaalsContact OE2-OE1 3.11Å; N66-E70 PolarHBondContact O-N 2.86Å; P67-E70 PolarHBondContact O-N 3.26Å; E70-R73 PolarHBondContact O-N 3.39Å; E70-R73 WeakPolarHBondContact OE1-CD 3.3Å; E70-R73 IonicContact OE1-CZ 3.89Å; E70-R73 IonicContact OE1-NE 3.81Å; E70-R73 IonicContact OE1-NH1 2.85Å; E70-R73 PolarHBondContact OE1-NH1 2.98Å; E70-L74 PolarHBondContact O-N 3.31Å |
| 71 | L | 88.8 | Confident | 82.9 | Confident | 102 Ų | 102 | 96.8 Ų | 96.8 | 53% | 0.534 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -57.9 | -48.3 | 171.5 | -88 | 159.7 | 0 | 0 | 0 | 111.7 | P67 E68 R73 L74 E75 | P67-L71 WeakPolarHBondContact O-CB 3.28Å; P67-L71 PolarHBondContact O-N 3.46Å; E68-L71 PolarHBondContact O-N 3.26Å; L71-R73 VanDerWaalsContact C-N 3.29Å; L71-R73 PolarHBondContact O-N 3.21Å; L71-L74 WeakPolarHBondContact O-CB 3.45Å; L71-L74 PolarHBondContact O-N 3.01Å; L71-L74 VanDerWaalsContact O-N 3.14Å; L71-E75 WeakPolarHBondContact O-CG 3.34Å; L71-E75 PolarHBondContact O-N 2.67Å |
| 72 | L | 90.1 | Very high | 84.2 | Confident | 97 Ų | 97 | 98.8 Ų | 98.8 | 51% | 0.508 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.8 | -36.5 | 178.3 | -75.1 | 168.7 | 0 | 0 | 0 | 112.2 | E68 I69 L76 | E68-L72 HydrophobicContact CG-CD1 4.39Å; E68-L72 WeakPolarHBondContact O-CB 3.4Å; E68-L72 WeakPolarHBondContact O-CG 3.45Å; E68-L72 PolarHBondContact O-N 2.91Å; I69-L72 PolarHBondContact O-N 2.88Å; L72-L76 VanDerWaalsContact O-CB 3.26Å; L72-L76 WeakPolarHBondContact O-CB 3.43Å; L72-L76 PolarHBondContact O-N 2.66Å |
| 73 | R | 91.6 | Very high | 85.7 | Confident | 121 Ų | 121 | 104.5 Ų | 104.5 | 46% | 0.457 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -65.5 | -41.4 | 174.6 | -76.9 | 172.5 | 177.5 | 175.1 | 1.6 | 111.6 | E65 I69 E70 L71 L76 A77 | E65-R73 IonicContact OE1-CZ 2.85Å; E65-R73 VanDerWaalsContact OE1-CZ 3.25Å; E65-R73 IonicContact OE1-NH1 3.8Å; E65-R73 PolarHBondContact OE1-NH1 3.08Å; E65-R73 IonicContact OE1-NH2 3.52Å; E65-R73 PolarHBondContact OE1-NH2 3.21Å; E65-R73 IonicContact OE2-CZ 2.66Å; E65-R73 IonicContact OE2-NH1 3.25Å; E65-R73 PolarHBondContact OE2-NH1 3.49Å; I69-R73 WeakPolarHBondContact O-CG 3.34Å; I69-R73 PolarHBondContact O-N 2.93Å; E70-R73 PolarHBondContact O-N 3.39Å; E70-R73 WeakPolarHBondContact OE1-CD 3.3Å; E70-R73 IonicContact OE1-CZ 3.89Å; E70-R73 IonicContact OE1-NE 3.81Å; E70-R73 IonicContact OE1-NH1 2.85Å; E70-R73 PolarHBondContact OE1-NH1 2.98Å; L71-R73 VanDerWaalsContact C-N 3.29Å; L71-R73 PolarHBondContact O-N 3.21Å; R73-L76 PolarHBondContact O-N 3.15Å; R73-A77 PolarHBondContact O-N 3.02Å |
| 74 | L | 95.3 | Very high | 87.6 | Confident | 102 Ų | 102 | 106.6 Ų | 106.6 | 53% | 0.534 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.7 | -48.3 | 176.3 | -174.2 | 68 | 0 | 0 | 0 | 111.3 | E70 L71 L76 A77 E78 | E70-L74 PolarHBondContact O-N 3.31Å; L71-L74 WeakPolarHBondContact O-CB 3.45Å; L71-L74 PolarHBondContact O-N 3.01Å; L71-L74 VanDerWaalsContact O-N 3.14Å; L74-L76 VanDerWaalsContact C-N 3.29Å; L74-L76 PolarHBondContact O-N 3.33Å; L74-A77 WeakPolarHBondContact O-CB 3.25Å; L74-A77 PolarHBondContact O-N 3.4Å; L74-A77 VanDerWaalsContact O-N 3.1Å; L74-E78 PolarHBondContact O-N 3.32Å |
| 75 | E | 95.5 | Very high | 89.5 | Confident | 114 Ų | 114 | 104.1 Ų | 104.1 | 53% | 0.533 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -59.3 | -40.4 | 176.6 | -71.8 | 178.6 | 176.2 | 0 | 0 | 111.9 | L71 A77 E78 M79 | L71-E75 WeakPolarHBondContact O-CG 3.34Å; L71-E75 PolarHBondContact O-N 2.67Å; E75-A77 VanDerWaalsContact C-N 3.35Å; E75-E78 PolarHBondContact O-N 2.68Å; E75-M79 VanDerWaalsContact O-CB 3.3Å; E75-M79 WeakPolarHBondContact O-CB 3.17Å; E75-M79 PolarHBondContact O-N 3.08Å |
| 76 | L | 96.6 | Very high | 91.3 | Very high | 100 Ų | 100 | 103.5 Ų | 103.5 | 52% | 0.524 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.3 | -42.3 | 175.2 | -171.8 | 82.1 | 0 | 0 | 0 | 111.6 | L72 R73 L74 K80 | L72-L76 VanDerWaalsContact O-CB 3.26Å; L72-L76 WeakPolarHBondContact O-CB 3.43Å; L72-L76 PolarHBondContact O-N 2.66Å; R73-L76 PolarHBondContact O-N 3.15Å; L74-L76 VanDerWaalsContact C-N 3.29Å; L74-L76 PolarHBondContact O-N 3.33Å; L76-K80 HydrophobicContact CG-CD 4.49Å; L76-K80 WeakPolarHBondContact O-CB 3.17Å; L76-K80 VanDerWaalsContact O-CG 3.32Å; L76-K80 WeakPolarHBondContact O-CG 3.45Å; L76-K80 PolarHBondContact O-N 3.36Å |
| 77 | A | 97.3 | Very high | 92.8 | Very high | 55 Ų | 55 | 103.4 Ų | 103.4 | 46% | 0.455 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64.9 | -48.1 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | R73 L74 E75 M79 K80 E81 | R73-A77 PolarHBondContact O-N 3.02Å; L74-A77 WeakPolarHBondContact O-CB 3.25Å; L74-A77 PolarHBondContact O-N 3.4Å; L74-A77 VanDerWaalsContact O-N 3.1Å; E75-A77 VanDerWaalsContact C-N 3.35Å; A77-M79 VanDerWaalsContact C-N 3.31Å; A77-M79 PolarHBondContact O-N 2.78Å; A77-K80 PolarHBondContact O-N 2.77Å; A77-E81 PolarHBondContact O-N 3.4Å |
| 78 | E | 98 | Very high | 94 | Very high | 91 Ų | 91 | 102.9 Ų | 102.9 | 43% | 0.425 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.4 | -41.1 | 176.5 | -72 | -172.2 | -173.2 | 0 | 0 | 112.3 | L74 E75 E81 K82 | L74-E78 PolarHBondContact O-N 3.32Å; E75-E78 PolarHBondContact O-N 2.68Å; E78-E81 PolarHBondContact O-N 2.85Å; E78-K82 WeakPolarHBondContact O-CG 3.28Å; E78-K82 PolarHBondContact O-N 3.35Å; E78-K82 IonicContact OE2-NZ 3.8Å |
| 79 | M | 97.4 | Very high | 95 | Very high | 127 Ų | 127 | 102.7 Ų | 102.7 | 63% | 0.626 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -67.8 | -38.1 | 179.9 | -164.5 | 64.4 | 71.6 | 0 | 0 | 111.6 | E75 A77 Y83 | E75-M79 VanDerWaalsContact O-CB 3.3Å; E75-M79 WeakPolarHBondContact O-CB 3.17Å; E75-M79 PolarHBondContact O-N 3.08Å; A77-M79 VanDerWaalsContact C-N 3.31Å; A77-M79 PolarHBondContact O-N 2.78Å; M79-Y83 VanDerWaalsContact O-CB 3.29Å; M79-Y83 WeakPolarHBondContact O-CB 3.41Å; M79-Y83 PolarHBondContact O-N 3.37Å |
| 80 | K | 98.1 | Very high | 95.8 | Very high | 121 Ų | 121 | 102.7 Ų | 102.7 | 53% | 0.526 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.3 | -44.7 | 174.5 | -79.1 | 176.7 | 177.8 | -179.3 | 0 | 111.8 | L76 A77 K82 Y83 E84 | L76-K80 HydrophobicContact CG-CD 4.49Å; L76-K80 WeakPolarHBondContact O-CB 3.17Å; L76-K80 VanDerWaalsContact O-CG 3.32Å; L76-K80 WeakPolarHBondContact O-CG 3.45Å; L76-K80 PolarHBondContact O-N 3.36Å; A77-K80 PolarHBondContact O-N 2.77Å; K80-K82 PolarHBondContact O-N 3.34Å; K80-Y83 WeakPolarHBondContact O-CB 3.25Å; K80-Y83 PolarHBondContact O-N 2.94Å; K80-E84 WeakPolarHBondContact O-CG 3.49Å; K80-E84 PolarHBondContact O-N 3.14Å |
| 81 | E | 98.3 | Very high | 96.4 | Very high | 141 Ų | 141 | 105.2 Ų | 105.2 | 66% | 0.659 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -60.7 | -46.9 | 177.6 | -173.9 | -179.8 | -176.8 | 0 | 0 | 111.5 | A77 E78 Y83 E84 A85 | A77-E81 PolarHBondContact O-N 3.4Å; E78-E81 PolarHBondContact O-N 2.85Å; E81-Y83 VanDerWaalsContact C-N 3.33Å; E81-Y83 PolarHBondContact O-N 3.48Å; E81-E84 PolarHBondContact O-N 3.46Å; E81-A85 WeakPolarHBondContact O-CB 3.48Å; E81-A85 PolarHBondContact O-N 3.05Å |
| 82 | K | 98.1 | Very high | 96.8 | Very high | 113 Ų | 113 | 106.1 Ų | 106.1 | 49% | 0.491 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -60.8 | -42.4 | 175.6 | -72 | 170.4 | -173.3 | 161.1 | 0 | 111.8 | E78 K80 A85 I86 | E78-K82 WeakPolarHBondContact O-CG 3.28Å; E78-K82 PolarHBondContact O-N 3.35Å; E78-K82 IonicContact OE2-NZ 3.8Å; K80-K82 PolarHBondContact O-N 3.34Å; K82-A85 PolarHBondContact O-N 2.93Å; K82-I86 WeakPolarHBondContact O-CB 3.43Å; K82-I86 VanDerWaalsContact O-CG1 3.27Å; K82-I86 WeakPolarHBondContact O-CG1 3.31Å; K82-I86 PolarHBondContact O-N 2.94Å |
| 83 | Y | 97.8 | Very high | 97 | Very high | 161 Ų | 161 | 105.4 Ų | 105.4 | 63% | 0.631 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -61.6 | -47.7 | 178.2 | 178.1 | -97.3 | 0 | 0 | 0 | 111.7 | M79 K80 E81 A85 I86 V87 | M79-Y83 VanDerWaalsContact O-CB 3.29Å; M79-Y83 WeakPolarHBondContact O-CB 3.41Å; M79-Y83 PolarHBondContact O-N 3.37Å; K80-Y83 WeakPolarHBondContact O-CB 3.25Å; K80-Y83 PolarHBondContact O-N 2.94Å; E81-Y83 VanDerWaalsContact C-N 3.33Å; E81-Y83 PolarHBondContact O-N 3.48Å; Y83-A85 PolarHBondContact O-N 3.27Å; Y83-I86 PolarHBondContact O-N 3.22Å; Y83-V87 HydrophobicContact CD1-CG2 4.13Å; Y83-V87 HydrophobicContact CD2-CG2 4.48Å; Y83-V87 HydrophobicContact CE1-CG2 3.72Å; Y83-V87 HydrophobicContact CE2-CG2 4.1Å; Y83-V87 HydrophobicContact CG-CG2 4.49Å; Y83-V87 WeakPolarHBondContact O-CB 3.32Å; Y83-V87 VanDerWaalsContact O-CG2 3.28Å; Y83-V87 WeakPolarHBondContact O-CG2 3.31Å; Y83-V87 PolarHBondContact O-N 3.47Å |
| 84 | E | 98.3 | Very high | 97.1 | Very high | 133 Ų | 133 | 106.6 Ų | 106.6 | 62% | 0.621 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -62.1 | -42.1 | 178.2 | -73.1 | -179.8 | -175.7 | 0 | 0 | 112 | K80 E81 I86 V87 E88 | K80-E84 WeakPolarHBondContact O-CG 3.49Å; K80-E84 PolarHBondContact O-N 3.14Å; E81-E84 PolarHBondContact O-N 3.46Å; E84-I86 PolarHBondContact O-N 3Å; E84-V87 PolarHBondContact O-N 3.43Å; E84-E88 WeakPolarHBondContact O-CB 3.46Å; E84-E88 PolarHBondContact O-N 3.49Å |
| 85 | A | 98.1 | Very high | 97 | Very high | 61 Ų | 61 | 104.5 Ų | 104.5 | 50% | 0.504 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.4 | -45.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | E81 K82 Y83 E88 E89 | E81-A85 WeakPolarHBondContact O-CB 3.48Å; E81-A85 PolarHBondContact O-N 3.05Å; K82-A85 PolarHBondContact O-N 2.93Å; Y83-A85 PolarHBondContact O-N 3.27Å; A85-E88 PolarHBondContact O-N 2.87Å; A85-E89 WeakPolarHBondContact O-CB 3.49Å; A85-E89 PolarHBondContact O-N 2.96Å |
| 86 | I | 98.2 | Very high | 96.9 | Very high | 93 Ų | 93 | 105.1 Ų | 105.1 | 48% | 0.477 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.6 | -38.5 | 177.9 | -70.4 | 167.6 | 0 | 0 | 0 | 111.3 | K82 Y83 E84 N90 | K82-I86 WeakPolarHBondContact O-CB 3.43Å; K82-I86 VanDerWaalsContact O-CG1 3.27Å; K82-I86 WeakPolarHBondContact O-CG1 3.31Å; K82-I86 PolarHBondContact O-N 2.94Å; Y83-I86 PolarHBondContact O-N 3.22Å; E84-I86 PolarHBondContact O-N 3Å; I86-N90 WeakPolarHBondContact CG2-ND2 3.41Å; I86-N90 VanDerWaalsContact O-CB 3.3Å; I86-N90 WeakPolarHBondContact O-CB 3.45Å; I86-N90 PolarHBondContact O-N 3.39Å; I86-N90 PolarHBondContact O-ND2 2.93Å |
| 87 | V | 98.1 | Very high | 96.7 | Very high | 66 Ų | 66 | 106 Ų | 106 | 40% | 0.4 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -64.5 | -43.9 | 176.9 | 166.1 | 0 | 0 | 0 | 0 | 110.6 | Y83 E84 N90 K91 | Y83-V87 HydrophobicContact CD1-CG2 4.13Å; Y83-V87 HydrophobicContact CD2-CG2 4.48Å; Y83-V87 HydrophobicContact CE1-CG2 3.72Å; Y83-V87 HydrophobicContact CE2-CG2 4.1Å; Y83-V87 HydrophobicContact CG-CG2 4.49Å; Y83-V87 WeakPolarHBondContact O-CB 3.32Å; Y83-V87 VanDerWaalsContact O-CG2 3.28Å; Y83-V87 WeakPolarHBondContact O-CG2 3.31Å; Y83-V87 PolarHBondContact O-N 3.47Å; E84-V87 PolarHBondContact O-N 3.43Å; V87-N90 PolarHBondContact O-N 3.01Å; V87-K91 WeakPolarHBondContact O-CB 3.4Å; V87-K91 PolarHBondContact O-N 3.41Å |
| 88 | E | 98.1 | Very high | 96.3 | Very high | 82 Ų | 82 | 106.1 Ų | 106.1 | 38% | 0.383 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -68.2 | -39.6 | 178.8 | -173.4 | 56.8 | -152.7 | 0 | 0 | 111.8 | E84 A85 K91 K92 | E84-E88 WeakPolarHBondContact O-CB 3.46Å; E84-E88 PolarHBondContact O-N 3.49Å; A85-E88 PolarHBondContact O-N 2.87Å; E88-K91 WeakPolarHBondContact O-CB 3.33Å; E88-K91 PolarHBondContact O-N 3.36Å; E88-K92 WeakPolarHBondContact O-CG 3.44Å; E88-K92 PolarHBondContact O-N 2.98Å; E88-K92 WeakPolarHBondContact OE1-CE 3.41Å |
| 89 | E | 97.5 | Very high | 95.7 | Very high | 118 Ų | 118 | 108.9 Ų | 108.9 | 55% | 0.551 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -62.3 | -47.2 | 172.3 | -174.6 | 176.3 | -169.1 | 0 | 0 | 111.5 | A85 K91 K92 L93 | A85-E89 WeakPolarHBondContact O-CB 3.49Å; A85-E89 PolarHBondContact O-N 2.96Å; E89-K91 VanDerWaalsContact C-N 3.27Å; E89-K91 PolarHBondContact O-N 3.03Å; E89-K92 WeakPolarHBondContact O-CB 3.26Å; E89-K92 PolarHBondContact O-N 3.31Å; E89-K92 VanDerWaalsContact O-N 3.12Å; E89-L93 HydrophobicContact CG-CD1 4Å; E89-L93 HydrophobicContact CG-CG 4.31Å; E89-L93 WeakPolarHBondContact O-CG 3.41Å; E89-L93 PolarHBondContact O-N 3.39Å |
| 90 | N | 97.2 | Very high | 95 | Very high | 76 Ų | 76 | 112 Ų | 112 | 41% | 0.406 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -57.3 | -41.7 | 175.6 | -95.1 | -71.1 | 0 | 0 | 0 | 111.9 | I86 V87 L93 K94 | I86-N90 WeakPolarHBondContact CG2-ND2 3.41Å; I86-N90 VanDerWaalsContact O-CB 3.3Å; I86-N90 WeakPolarHBondContact O-CB 3.45Å; I86-N90 PolarHBondContact O-N 3.39Å; I86-N90 PolarHBondContact O-ND2 2.93Å; V87-N90 PolarHBondContact O-N 3.01Å; N90-L93 PolarHBondContact O-N 3.1Å; N90-K94 WeakPolarHBondContact O-CB 3.33Å; N90-K94 VanDerWaalsContact O-CG 3.29Å; N90-K94 WeakPolarHBondContact O-CG 3.39Å; N90-K94 PolarHBondContact O-N 3.46Å |
| 91 | K | 97.1 | Very high | 93.9 | Very high | 136 Ų | 136 | 113 Ų | 113 | 59% | 0.591 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -61.6 | -45.3 | 176.6 | -174.3 | -177.5 | 177.3 | -172.6 | 0 | 111.1 | V87 E88 E89 A95 | V87-K91 WeakPolarHBondContact O-CB 3.4Å; V87-K91 PolarHBondContact O-N 3.41Å; E88-K91 WeakPolarHBondContact O-CB 3.33Å; E88-K91 PolarHBondContact O-N 3.36Å; E89-K91 VanDerWaalsContact C-N 3.27Å; E89-K91 PolarHBondContact O-N 3.03Å; K91-A95 WeakPolarHBondContact O-CB 3.41Å; K91-A95 PolarHBondContact O-N 3.42Å |
| 92 | K | 96.3 | Very high | 92.4 | Very high | 121 Ų | 121 | 111.1 Ų | 111.1 | 53% | 0.526 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -63.2 | -43.3 | 176.2 | -72.2 | 170.2 | -177 | 169 | 0 | 112.2 | E88 E89 A95 K96 | E88-K92 WeakPolarHBondContact O-CG 3.44Å; E88-K92 PolarHBondContact O-N 2.98Å; E88-K92 WeakPolarHBondContact OE1-CE 3.41Å; E89-K92 WeakPolarHBondContact O-CB 3.26Å; E89-K92 PolarHBondContact O-N 3.31Å; E89-K92 VanDerWaalsContact O-N 3.12Å; K92-A95 PolarHBondContact O-N 3.42Å; K92-K96 WeakPolarHBondContact O-CG 3.36Å; K92-K96 PolarHBondContact O-N 3.49Å |
| 93 | L | 94.8 | Very high | 90.5 | Very high | 82 Ų | 82 | 111.4 Ų | 111.4 | 43% | 0.429 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -66 | -44.7 | 178.8 | -70.7 | 174.2 | 0 | 0 | 0 | 111.8 | E89 N90 A95 K96 L97 | E89-L93 HydrophobicContact CG-CD1 4Å; E89-L93 HydrophobicContact CG-CG 4.31Å; E89-L93 WeakPolarHBondContact O-CG 3.41Å; E89-L93 PolarHBondContact O-N 3.39Å; N90-L93 PolarHBondContact O-N 3.1Å; L93-A95 VanDerWaalsContact C-N 3.33Å; L93-A95 PolarHBondContact O-N 3.15Å; L93-K96 PolarHBondContact O-N 3.47Å; L93-L97 PolarHBondContact O-N 2.94Å |
| 94 | K | 94.1 | Very high | 88.6 | Confident | 146 Ų | 146 | 112.4 Ų | 112.4 | 64% | 0.635 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -59.7 | -42.8 | 174 | -75 | 177.8 | 178.6 | -177.2 | 0 | 111.8 | N90 K96 L97 A98 | N90-K94 WeakPolarHBondContact O-CB 3.33Å; N90-K94 VanDerWaalsContact O-CG 3.29Å; N90-K94 WeakPolarHBondContact O-CG 3.39Å; N90-K94 PolarHBondContact O-N 3.46Å; K94-K96 VanDerWaalsContact C-N 3.33Å; K94-K96 PolarHBondContact O-N 3.16Å; K94-L97 PolarHBondContact O-N 3.43Å; K94-A98 PolarHBondContact O-N 2.87Å |
| 95 | A | 93.3 | Very high | 86.2 | Confident | 57 Ų | 57 | 115 Ų | 115 | 47% | 0.471 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -64 | -37 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | K91 K92 L93 | K91-A95 WeakPolarHBondContact O-CB 3.41Å; K91-A95 PolarHBondContact O-N 3.42Å; K92-A95 PolarHBondContact O-N 3.42Å; L93-A95 VanDerWaalsContact C-N 3.33Å; L93-A95 PolarHBondContact O-N 3.15Å |
| 96 | K | 92.9 | Very high | 83.9 | Confident | 127 Ų | 127 | 119.8 Ų | 119.8 | 55% | 0.552 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -68.4 | -45.5 | 173.3 | -73.9 | 178.8 | -179.6 | -178.1 | 0 | 111.9 | K92 L93 K94 A98 Q99 Y100 | K92-K96 WeakPolarHBondContact O-CG 3.36Å; K92-K96 PolarHBondContact O-N 3.49Å; L93-K96 PolarHBondContact O-N 3.47Å; K94-K96 VanDerWaalsContact C-N 3.33Å; K94-K96 PolarHBondContact O-N 3.16Å; K96-A98 VanDerWaalsContact C-N 3.31Å; K96-A98 PolarHBondContact O-N 3.22Å; K96-Q99 WeakPolarHBondContact O-CB 3.45Å; K96-Q99 PolarHBondContact O-N 3.38Å; K96-Q99 VanDerWaalsContact O-N 3.07Å; K96-Y100 VanDerWaalsContact O-CD2 3.26Å; K96-Y100 WeakPolarHBondContact O-CD2 3.45Å |
| 97 | L | 91.4 | Very high | 81.6 | Confident | 118 Ų | 118 | 125.7 Ų | 125.7 | 62% | 0.618 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -59.3 | -41.4 | 179.1 | -81.1 | 169.5 | 0 | 0 | 0 | 112.1 | L93 K94 Q99 Y100 E101 | L93-L97 PolarHBondContact O-N 2.94Å; K94-L97 PolarHBondContact O-N 3.43Å; L97-Q99 PolarHBondContact O-N 2.89Å; L97-Q99 VanDerWaalsContact O-N 3.11Å; L97-Y100 CarbonylContact O-C 3.57Å; L97-Y100 PolarHBondContact O-N 3.3Å; L97-E101 PolarHBondContact O-N 2.93Å |
| 98 | A | 88.9 | Confident | 79.3 | Confident | 59 Ų | 59 | 133 Ų | 133 | 49% | 0.488 | 64% | 0.64 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -59.8 | -21.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | K94 K96 Y100 | K94-A98 PolarHBondContact O-N 2.87Å; K96-A98 VanDerWaalsContact C-N 3.31Å; K96-A98 PolarHBondContact O-N 3.22Å; A98-Y100 VanDerWaalsContact C-N 3.31Å |
| 99 | Q | 87 | Confident | 76.9 | Confident | 148 Ų | 148 | 133.5 Ų | 133.5 | 69% | 0.692 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.4 | -19.5 | 175.4 | -61.5 | 174.7 | 19.4 | 0 | 0 | 113 | K96 L97 | K96-Q99 WeakPolarHBondContact O-CB 3.45Å; K96-Q99 PolarHBondContact O-N 3.38Å; K96-Q99 VanDerWaalsContact O-N 3.07Å; L97-Q99 PolarHBondContact O-N 2.89Å; L97-Q99 VanDerWaalsContact O-N 3.11Å |
| 100 | Y | 82.1 | Confident | 74.2 | Confident | 194 Ų | 194 | 140.9 Ų | 140.9 | 76% | 0.761 | 69% | 0.693 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.7 | -4.4 | 179.9 | -62.7 | -76.9 | 0 | 0 | 0 | 112.5 | K96 L97 A98 | K96-Y100 VanDerWaalsContact O-CD2 3.26Å; K96-Y100 WeakPolarHBondContact O-CD2 3.45Å; L97-Y100 CarbonylContact O-C 3.57Å; L97-Y100 PolarHBondContact O-N 3.3Å; A98-Y100 VanDerWaalsContact C-N 3.31Å |
| 101 | E | 74.1 | Confident | 73.1 | Confident | 141 Ų | 141 | 144.2 Ų | 144.2 | 66% | 0.659 | 71% | 0.707 | S | S | * | * | S | Bend | trans | -66.8 | 124.6 | 167.9 | -91.5 | -178.2 | 156.9 | 0 | 0 | 108.6 | L97 | L97-E101 PolarHBondContact O-N 2.93Š|
| 102 | P | 66.7 | Low | 71.8 | Confident | 102 Ų | 102 | 144.6 Ų | 144.6 | 66% | 0.662 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 154.1 | 170.4 | 24.9 | -30.8 | 0 | 0 | 0 | 108.9 | Q104 | P102-Q104 PolarHBondContact O-N 3.15Š|
| 103 | P | 58.6 | Low | 70.5 | Confident | 118 Ų | 118 | 145.9 Ų | 145.9 | 77% | 0.766 | 72% | 0.724 | S | S | * | * | P | Polyproline II helix | trans | -48.6 | 125.7 | 165.7 | -17.4 | 28.1 | 0 | 0 | 0 | 106.1 | E105 | P103-E105 VanDerWaalsContact C-N 3.27Å; P103-E105 PolarHBondContact O-N 2.99Å |
| 104 | Q | 57.9 | Low | 69.1 | Low | 183 Ų | 183 | 149.6 Ų | 149.6 | 86% | 0.855 | 74% | 0.741 | S | S | * | * | trans | -52 | 108.4 | 167 | -74.4 | -170.2 | -15.1 | 0 | 0 | 104.5 | P102 E106 | P102-Q104 PolarHBondContact O-N 3.15Å; Q104-E106 PolarHBondContact O-N 2.86Å | ||
| 105 | E | 48.7 | Very low | 67.5 | Low | 186 Ų | 186 | 149.9 Ų | 149.9 | 87% | 0.869 | 75% | 0.748 | S | S | * | * | trans | -55.1 | 101.4 | 162.4 | -80.7 | -176.2 | 160.2 | 0 | 0 | 102.7 | P103 K107 | P103-E105 VanDerWaalsContact C-N 3.27Å; P103-E105 PolarHBondContact O-N 2.99Å; E105-K107 PolarHBondContact O-N 3.46Å | ||
| 106 | E | 49.6 | Very low | 65.8 | Low | 163 Ų | 163 | 156.1 Ų | 156.1 | 76% | 0.762 | 77% | 0.766 | S | S | * | * | trans | -40.6 | 116.5 | 160 | -79.3 | 178.7 | 149.4 | 0 | 0 | 103.8 | Q104 R108 | Q104-E106 PolarHBondContact O-N 2.86Å; E106-R108 PolarHBondContact O-N 2.99Å | ||
| 107 | K | 49.3 | Very low | 63.8 | Low | 216 Ų | 216 | 158.1 Ų | 158.1 | 94% | 0.939 | 78% | 0.782 | S | S | * | * | trans | -57 | 85.6 | 165.3 | -77.2 | -176.9 | 175.4 | -176.8 | 0 | 105.8 | E105 | E105-K107 PolarHBondContact O-N 3.46Š| ||
| 108 | R | 50.1 | Low | 61.7 | Low | 220 Ų | 220 | 161.2 Ų | 161.2 | 83% | 0.83 | 79% | 0.794 | S | S | * | * | trans | -79.7 | 118.8 | 174.1 | -140.3 | -174.5 | -148.7 | -146.1 | 5.7 | 104.5 | E106 | E106-R108 PolarHBondContact O-N 2.99Š| ||
| 109 | A | 47.6 | Very low | 59.4 | Low | 93 Ų | 93 | 169.8 Ų | 169.8 | 77% | 0.769 | 82% | 0.82 | S | S | * | * | trans | 72.8 | 107.7 | 168 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 110 | E | 41.7 | Very low | 56.9 | Low | 273 Ų | 273 | 171.7 Ų | 171.7 | 100% | 1.276 | 83% | 0.832 | S | S | * | * | -124.8 | 0 | 103.9 | -92.4 | -176.5 | 141.7 | 0 | 0 | 109.3 |
Retrieved 110 of 110 residues in 87 ms
(Link to these results)