| 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 | 56.4 | Low | 78.5 | Confident | 191 Ų | 191 | 112.5 Ų | 112.5 | 94% | 0.941 | 58% | 0.576 | S | S | * | * | 0 | -74.5 | 0 | -54.1 | -47.5 | -118.5 | 0 | 0 | 113.4 | E4 S5 | M1-E4 WeakPolarHBondContact CA-OE2 3.49Å; M1-E4 PolarHBondContact N-OE2 3.48Å; M1-S5 PolarHBondContact O-N 3.23Å; M1-S5 PolarHBondContact O-OG 2.77Å | |||
| 2 | A | 62.8 | Low | 79.7 | Confident | 78 Ų | 78 | 109.8 Ų | 109.8 | 65% | 0.645 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -72.4 | -36 | -175.2 | 0 | 0 | 0 | 0 | 0 | 115 | S5 R6 | A2-S5 PolarHBondContact O-OG 3.01Å; A2-R6 PolarHBondContact O-N 3.34Å |
| 3 | E | 66.1 | Low | 80.8 | Confident | 125 Ų | 125 | 107 Ų | 107 | 58% | 0.584 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -71.9 | -34.8 | 178.7 | -73.5 | -63.9 | 135.4 | 0 | 0 | 112.9 | R6 L7 | E3-R6 PolarHBondContact O-N 3.29Å; E3-L7 PolarHBondContact O-N 3.05Å |
| 4 | E | 73.3 | Confident | 81.8 | Confident | 124 Ų | 124 | 105.2 Ų | 105.2 | 58% | 0.579 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -66.9 | -42 | 177.1 | -71.6 | 158.7 | 144 | 0 | 0 | 111.6 | M1 R6 L7 S8 | M1-E4 WeakPolarHBondContact CA-OE2 3.49Å; M1-E4 PolarHBondContact N-OE2 3.48Å; E4-R6 VanDerWaalsContact C-N 3.29Å; E4-R6 PolarHBondContact O-N 3.33Å; E4-L7 PolarHBondContact O-N 2.76Å; E4-S8 PolarHBondContact O-N 3.39Å; E4-S8 PolarHBondContact O-OG 2.96Å |
| 5 | S | 77.2 | Confident | 82.7 | Confident | 56 Ų | 56 | 105.7 Ų | 105.7 | 39% | 0.392 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -61.1 | -37.8 | 174 | 41.8 | 0 | 0 | 0 | 0 | 112.5 | M1 A2 H9 | M1-S5 PolarHBondContact O-N 3.23Å; M1-S5 PolarHBondContact O-OG 2.77Å; A2-S5 PolarHBondContact O-OG 3.01Å; S5-H9 PolarHBondContact O-CD2 3.17Å; S5-H9 PolarHBondContact O-N 3.04Å |
| 6 | R | 82.9 | Confident | 83.5 | Confident | 162 Ų | 162 | 108.9 Ų | 108.9 | 61% | 0.611 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -67.5 | -42.7 | 178.5 | -172 | 179.7 | 174.4 | -174.8 | -0.5 | 111.7 | A2 E3 E4 H9 Q10 | A2-R6 PolarHBondContact O-N 3.34Å; E3-R6 PolarHBondContact O-N 3.29Å; E4-R6 VanDerWaalsContact C-N 3.29Å; E4-R6 PolarHBondContact O-N 3.33Å; R6-H9 PolarHBondContact O-N 3.48Å; R6-Q10 WeakPolarHBondContact O-CB 3.48Å; R6-Q10 PolarHBondContact O-N 2.94Å |
| 7 | L | 85.8 | Confident | 84.2 | Confident | 104 Ų | 104 | 106.1 Ų | 106.1 | 55% | 0.545 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -63.8 | -44.2 | 176.3 | -122.2 | 117.1 | 0 | 0 | 0 | 111.9 | E3 E4 H9 Q10 I11 | E3-L7 PolarHBondContact O-N 3.05Å; E4-L7 PolarHBondContact O-N 2.76Å; L7-H9 PolarHBondContact O-N 3.4Å; L7-Q10 PolarHBondContact O-N 3.2Å; L7-I11 HydrophobicContact CD2-CD1 4.39Å; L7-I11 WeakPolarHBondContact O-CG1 3.47Å; L7-I11 PolarHBondContact O-N 3.02Å |
| 8 | S | 87.5 | Confident | 84.9 | Confident | 64 Ų | 64 | 103.6 Ų | 103.6 | 45% | 0.448 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -63 | -39.8 | 176.2 | -60.8 | 0 | 0 | 0 | 0 | 112.6 | E4 Q10 I11 Q12 | E4-S8 PolarHBondContact O-N 3.39Å; E4-S8 PolarHBondContact O-OG 2.96Å; S8-Q10 VanDerWaalsContact C-N 3.33Å; S8-Q10 PolarHBondContact O-N 3.48Å; S8-I11 PolarHBondContact O-N 3.49Å; S8-Q12 WeakPolarHBondContact O-CB 3.36Å; S8-Q12 WeakPolarHBondContact O-CG 3.36Å; S8-Q12 PolarHBondContact O-N 3.47Å |
| 9 | H | 88.9 | Confident | 85.5 | Confident | 123 Ų | 123 | 103.4 Ų | 103.4 | 57% | 0.569 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -64.7 | -36.9 | 174.1 | -75.8 | -53.1 | 0 | 0 | 0 | 112.5 | S5 R6 L7 S13 | S5-H9 PolarHBondContact O-CD2 3.17Å; S5-H9 PolarHBondContact O-N 3.04Å; R6-H9 PolarHBondContact O-N 3.48Å; L7-H9 PolarHBondContact O-N 3.4Å; H9-S13 WeakPolarHBondContact O-CB 3.5Å; H9-S13 PolarHBondContact O-N 2.98Å |
| 10 | Q | 90.9 | Very high | 86 | Confident | 124 Ų | 124 | 104.3 Ų | 104.3 | 58% | 0.579 | 54% | 0.538 | S | S | * | . | H | α-helix | trans | -69.7 | -41.1 | 178.1 | -160.8 | 167.7 | -4.1 | 0 | 0 | 111.8 | R6 L7 S8 S13 V14 | R6-Q10 WeakPolarHBondContact O-CB 3.48Å; R6-Q10 PolarHBondContact O-N 2.94Å; L7-Q10 PolarHBondContact O-N 3.2Å; S8-Q10 VanDerWaalsContact C-N 3.33Å; S8-Q10 PolarHBondContact O-N 3.48Å; Q10-S13 WeakPolarHBondContact O-CB 3.27Å; Q10-S13 PolarHBondContact O-N 3.29Å; Q10-V14 WeakPolarHBondContact O-CG2 3.38Å; Q10-V14 PolarHBondContact O-N 2.97Å |
| 11 | I | 91.3 | Very high | 86.6 | Confident | 86 Ų | 86 | 103.6 Ų | 103.6 | 44% | 0.441 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -61.8 | -49.1 | 173.2 | -67.8 | 166.6 | 0 | 0 | 0 | 110.5 | L7 S8 S13 V14 E15 | L7-I11 HydrophobicContact CD2-CD1 4.39Å; L7-I11 WeakPolarHBondContact O-CG1 3.47Å; L7-I11 PolarHBondContact O-N 3.02Å; S8-I11 PolarHBondContact O-N 3.49Å; I11-S13 VanDerWaalsContact C-N 3.26Å; I11-S13 PolarHBondContact O-N 3.07Å; I11-V14 PolarHBondContact O-N 2.93Å; I11-V14 VanDerWaalsContact O-N 3.13Å; I11-E15 HydrophobicContact CG2-CG 4.33Å; I11-E15 WeakPolarHBondContact O-CG 3.37Å; I11-E15 PolarHBondContact O-N 2.99Å |
| 12 | Q | 92.9 | Very high | 88.5 | Confident | 81 Ų | 81 | 103.1 Ų | 103.1 | 38% | 0.379 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -60.9 | -34.4 | 176.6 | -74.6 | -178.4 | 12.4 | 0 | 0 | 112.8 | S8 R16 | S8-Q12 WeakPolarHBondContact O-CB 3.36Å; S8-Q12 WeakPolarHBondContact O-CG 3.36Å; S8-Q12 PolarHBondContact O-N 3.47Å; Q12-R16 VanDerWaalsContact O-CG 3.27Å; Q12-R16 WeakPolarHBondContact O-CG 3.48Å; Q12-R16 PolarHBondContact O-N 3.13Å; Q12-R16 VanDerWaalsContact O-N 3.07Å; Q12-R16 VanDerWaalsContact OE1-NH2 3.09Å |
| 13 | S | 93.7 | Very high | 90.1 | Very high | 73 Ų | 73 | 104.8 Ų | 104.8 | 51% | 0.51 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -66.9 | -43.9 | 175.1 | -171.9 | 0 | 0 | 0 | 0 | 111.5 | H9 Q10 I11 R16 S17 | H9-S13 WeakPolarHBondContact O-CB 3.5Å; H9-S13 PolarHBondContact O-N 2.98Å; Q10-S13 WeakPolarHBondContact O-CB 3.27Å; Q10-S13 PolarHBondContact O-N 3.29Å; I11-S13 VanDerWaalsContact C-N 3.26Å; I11-S13 PolarHBondContact O-N 3.07Å; S13-R16 PolarHBondContact O-N 3.41Å; S13-S17 WeakPolarHBondContact O-CB 3.35Å; S13-S17 PolarHBondContact O-N 3.29Å |
| 14 | V | 95.6 | Very high | 91.6 | Very high | 82 Ų | 82 | 103 Ų | 103 | 50% | 0.497 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -65.4 | -44.6 | 177 | 173.8 | 0 | 0 | 0 | 0 | 110.5 | Q10 I11 R16 S17 V18 | Q10-V14 WeakPolarHBondContact O-CG2 3.38Å; Q10-V14 PolarHBondContact O-N 2.97Å; I11-V14 PolarHBondContact O-N 2.93Å; I11-V14 VanDerWaalsContact O-N 3.13Å; V14-R16 PolarHBondContact O-N 2.66Å; V14-S17 WeakPolarHBondContact CA-OG 2.97Å; V14-S17 CarbonylContact O-C 3.58Å; V14-S17 PolarHBondContact O-N 3.09Å; V14-S17 VanDerWaalsContact O-N 3.09Å; V14-S17 PolarHBondContact O-OG 2.92Å; V14-V18 HydrophobicContact CG1-CG2 4.27Å; V14-V18 WeakPolarHBondContact O-CG2 3.39Å; V14-V18 PolarHBondContact O-N 2.85Å |
| 15 | E | 94.8 | Very high | 92.7 | Very high | 113 Ų | 113 | 102.7 Ų | 102.7 | 53% | 0.528 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -57.2 | -45.9 | 176 | -72.8 | 172.9 | 166.6 | 0 | 0 | 112.3 | I11 S17 V18 V19 | I11-E15 HydrophobicContact CG2-CG 4.33Å; I11-E15 WeakPolarHBondContact O-CG 3.37Å; I11-E15 PolarHBondContact O-N 2.99Å; E15-S17 VanDerWaalsContact C-N 3.33Å; E15-S17 PolarHBondContact O-N 2.84Å; E15-V18 PolarHBondContact O-N 3.28Å; E15-V19 WeakPolarHBondContact O-CG2 3.36Å; E15-V19 PolarHBondContact O-N 3.4Å |
| 16 | R | 95.6 | Very high | 93.7 | Very high | 157 Ų | 157 | 105.4 Ų | 105.4 | 59% | 0.592 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -61.2 | -41.8 | 174.1 | -71.8 | 176.4 | -164.5 | 115.3 | 6 | 111.7 | Q12 S13 V14 V19 F20 | Q12-R16 VanDerWaalsContact O-CG 3.27Å; Q12-R16 WeakPolarHBondContact O-CG 3.48Å; Q12-R16 PolarHBondContact O-N 3.13Å; Q12-R16 VanDerWaalsContact O-N 3.07Å; Q12-R16 VanDerWaalsContact OE1-NH2 3.09Å; S13-R16 PolarHBondContact O-N 3.41Å; V14-R16 PolarHBondContact O-N 2.66Å; R16-V19 PolarHBondContact O-N 3.46Å; R16-F20 WeakPolarHBondContact O-CB 3.38Å; R16-F20 PolarHBondContact O-N 2.92Å |
| 17 | S | 95.5 | Very high | 94.4 | Very high | 61 Ų | 61 | 101.3 Ų | 101.3 | 43% | 0.427 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65.5 | -36.4 | 177.4 | 75.6 | 0 | 0 | 0 | 0 | 112.7 | S13 V14 E15 F20 L21 | S13-S17 WeakPolarHBondContact O-CB 3.35Å; S13-S17 PolarHBondContact O-N 3.29Å; V14-S17 WeakPolarHBondContact CA-OG 2.97Å; V14-S17 CarbonylContact O-C 3.58Å; V14-S17 PolarHBondContact O-N 3.09Å; V14-S17 VanDerWaalsContact O-N 3.09Å; V14-S17 PolarHBondContact O-OG 2.92Å; E15-S17 VanDerWaalsContact C-N 3.33Å; E15-S17 PolarHBondContact O-N 2.84Å; S17-F20 PolarHBondContact O-N 2.85Å; S17-L21 WeakPolarHBondContact O-CB 3.37Å; S17-L21 PolarHBondContact O-N 3.42Å |
| 18 | V | 96.2 | Very high | 95 | Very high | 61 Ų | 61 | 101.5 Ų | 101.5 | 37% | 0.37 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -69.1 | -42 | 176 | 170.1 | 0 | 0 | 0 | 0 | 111.1 | V14 E15 F20 L21 R22 | V14-V18 HydrophobicContact CG1-CG2 4.27Å; V14-V18 WeakPolarHBondContact O-CG2 3.39Å; V14-V18 PolarHBondContact O-N 2.85Å; E15-V18 PolarHBondContact O-N 3.28Å; V18-F20 VanDerWaalsContact C-N 3.32Å; V18-L21 PolarHBondContact O-N 3.39Å; V18-R22 WeakPolarHBondContact O-CB 3.09Å; V18-R22 VanDerWaalsContact O-CG 3.27Å; V18-R22 WeakPolarHBondContact O-CG 3.32Å; V18-R22 PolarHBondContact O-N 2.87Å |
| 19 | V | 96.4 | Very high | 95.5 | Very high | 99 Ų | 99 | 104.6 Ų | 104.6 | 60% | 0.6 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -62.8 | -42.6 | 174.6 | 173.1 | 0 | 0 | 0 | 0 | 110.6 | E15 R16 R22 Q23 | E15-V19 WeakPolarHBondContact O-CG2 3.36Å; E15-V19 PolarHBondContact O-N 3.4Å; R16-V19 PolarHBondContact O-N 3.46Å; V19-R22 PolarHBondContact O-N 2.99Å; V19-Q23 WeakPolarHBondContact O-CB 3.34Å; V19-Q23 PolarHBondContact O-N 3.41Å |
| 20 | F | 96.8 | Very high | 95.9 | Very high | 121 Ų | 121 | 104 Ų | 104 | 53% | 0.531 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -59.9 | -49.9 | 174.8 | 178.9 | -98.7 | 0 | 0 | 0 | 111.8 | R16 S17 V18 R22 Q23 E24 | R16-F20 WeakPolarHBondContact O-CB 3.38Å; R16-F20 PolarHBondContact O-N 2.92Å; S17-F20 PolarHBondContact O-N 2.85Å; V18-F20 VanDerWaalsContact C-N 3.32Å; F20-R22 VanDerWaalsContact C-N 3.3Å; F20-R22 PolarHBondContact O-N 3.07Å; F20-Q23 WeakPolarHBondContact O-CA 3.37Å; F20-Q23 WeakPolarHBondContact O-CB 3.42Å; F20-Q23 PolarHBondContact O-N 3.35Å; F20-Q23 VanDerWaalsContact O-N 3.07Å; F20-E24 HydrophobicContact CD1-CG 4.24Å; F20-E24 HydrophobicContact CE1-CG 3.84Å; F20-E24 WeakPolarHBondContact CE1-OE1 3.27Å; F20-E24 VanDerWaalsContact CE1-OE2 3.32Å; F20-E24 WeakPolarHBondContact CE1-OE2 3.38Å; F20-E24 HydrophobicContact CE2-CG 4.35Å; F20-E24 HydrophobicContact CZ-CG 3.9Å; F20-E24 WeakPolarHBondContact CZ-OE1 3.37Å; F20-E24 PolarHBondContact O-N 2.92Å |
| 21 | L | 97 | Very high | 96.3 | Very high | 91 Ų | 91 | 99.8 Ų | 99.8 | 48% | 0.476 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.5 | -37 | 179.8 | -152.3 | 75.2 | 0 | 0 | 0 | 112 | S17 V18 E24 H25 | S17-L21 WeakPolarHBondContact O-CB 3.37Å; S17-L21 PolarHBondContact O-N 3.42Å; V18-L21 PolarHBondContact O-N 3.39Å; L21-E24 PolarHBondContact O-N 3.18Å; L21-H25 WeakPolarHBondContact O-CB 3.44Å; L21-H25 PolarHBondContact O-CD2 2.7Å; L21-H25 VanDerWaalsContact O-CG 3.28Å; L21-H25 PolarHBondContact O-N 3.42Å |
| 22 | R | 96.4 | Very high | 96.6 | Very high | 181 Ų | 181 | 99.8 Ų | 99.8 | 68% | 0.683 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -65 | -40.1 | 173.3 | -76.4 | 179.2 | 178 | -173.2 | 1 | 111.9 | V18 V19 F20 L26 | V18-R22 WeakPolarHBondContact O-CB 3.09Å; V18-R22 VanDerWaalsContact O-CG 3.27Å; V18-R22 WeakPolarHBondContact O-CG 3.32Å; V18-R22 PolarHBondContact O-N 2.87Å; V19-R22 PolarHBondContact O-N 2.99Å; F20-R22 VanDerWaalsContact C-N 3.3Å; F20-R22 PolarHBondContact O-N 3.07Å; R22-L26 WeakPolarHBondContact O-CB 3.49Å; R22-L26 PolarHBondContact O-N 2.88Å |
| 23 | Q | 97.2 | Very high | 96.9 | Very high | 113 Ų | 113 | 100.8 Ų | 100.8 | 53% | 0.528 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -64 | -46.4 | 174.9 | -175.8 | 62.8 | 31.8 | 0 | 0 | 110.8 | V19 F20 L26 T27 | V19-Q23 WeakPolarHBondContact O-CB 3.34Å; V19-Q23 PolarHBondContact O-N 3.41Å; F20-Q23 WeakPolarHBondContact O-CA 3.37Å; F20-Q23 WeakPolarHBondContact O-CB 3.42Å; F20-Q23 PolarHBondContact O-N 3.35Å; F20-Q23 VanDerWaalsContact O-N 3.07Å; Q23-L26 PolarHBondContact O-N 3.34Å; Q23-T27 WeakPolarHBondContact O-CG2 3.35Å; Q23-T27 PolarHBondContact O-N 3.47Å; Q23-T27 PolarHBondContact O-OG1 3.44Å |
| 24 | E | 97.3 | Very high | 97.1 | Very high | 87 Ų | 87 | 101.7 Ų | 101.7 | 41% | 0.407 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.6 | -46.8 | 176.6 | -71.9 | -166.9 | 142.4 | 0 | 0 | 111.9 | F20 L21 L26 T27 L28 | F20-E24 HydrophobicContact CD1-CG 4.24Å; F20-E24 HydrophobicContact CE1-CG 3.84Å; F20-E24 WeakPolarHBondContact CE1-OE1 3.27Å; F20-E24 VanDerWaalsContact CE1-OE2 3.32Å; F20-E24 WeakPolarHBondContact CE1-OE2 3.38Å; F20-E24 HydrophobicContact CE2-CG 4.35Å; F20-E24 HydrophobicContact CZ-CG 3.9Å; F20-E24 WeakPolarHBondContact CZ-OE1 3.37Å; F20-E24 PolarHBondContact O-N 2.92Å; L21-E24 PolarHBondContact O-N 3.18Å; E24-L26 VanDerWaalsContact C-N 3.3Å; E24-L26 PolarHBondContact O-N 3.35Å; E24-T27 WeakPolarHBondContact CA-OG1 3.36Å; E24-T27 PolarHBondContact O-N 2.87Å; E24-T27 PolarHBondContact O-OG1 3.42Å; E24-L28 PolarHBondContact O-N 3.02Å |
| 25 | H | 97.5 | Very high | 97.2 | Very high | 118 Ų | 118 | 103.2 Ų | 103.2 | 55% | 0.546 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -57.6 | -42.1 | 175.5 | -78.3 | -169.2 | 0 | 0 | 0 | 112.2 | L21 L28 L29 | L21-H25 WeakPolarHBondContact O-CB 3.44Å; L21-H25 PolarHBondContact O-CD2 2.7Å; L21-H25 VanDerWaalsContact O-CG 3.28Å; L21-H25 PolarHBondContact O-N 3.42Å; H25-L28 PolarHBondContact O-N 2.96Å; H25-L29 WeakPolarHBondContact O-CB 3.38Å; H25-L29 PolarHBondContact O-N 3.47Å |
| 26 | L | 97.9 | Very high | 97.4 | Very high | 113 Ų | 113 | 102 Ų | 102 | 59% | 0.592 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -67.3 | -40.7 | 178 | -168.4 | 147.4 | 0 | 0 | 0 | 111.5 | R22 Q23 E24 L29 H30 | R22-L26 WeakPolarHBondContact O-CB 3.49Å; R22-L26 PolarHBondContact O-N 2.88Å; Q23-L26 PolarHBondContact O-N 3.34Å; E24-L26 VanDerWaalsContact C-N 3.3Å; E24-L26 PolarHBondContact O-N 3.35Å; L26-L29 PolarHBondContact O-N 2.95Å; L26-H30 WeakPolarHBondContact O-CB 3.39Å; L26-H30 PolarHBondContact O-N 2.93Å |
| 27 | T | 97.6 | Very high | 97.5 | Very high | 76 Ų | 76 | 98.3 Ų | 98.3 | 47% | 0.466 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -64.5 | -41.1 | 175.7 | 56.1 | 0 | 0 | 0 | 0 | 112.6 | Q23 E24 H30 G31 | Q23-T27 WeakPolarHBondContact O-CG2 3.35Å; Q23-T27 PolarHBondContact O-N 3.47Å; Q23-T27 PolarHBondContact O-OG1 3.44Å; E24-T27 WeakPolarHBondContact CA-OG1 3.36Å; E24-T27 PolarHBondContact O-N 2.87Å; E24-T27 PolarHBondContact O-OG1 3.42Å; T27-H30 PolarHBondContact O-N 2.94Å; T27-G31 PolarHBondContact O-N 3.25Å |
| 28 | L | 98 | Very high | 97.6 | Very high | 108 Ų | 108 | 99.2 Ų | 99.2 | 57% | 0.565 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -64.3 | -46.7 | 176 | 177.9 | 62.5 | 0 | 0 | 0 | 111 | E24 H25 H30 G31 L32 | E24-L28 PolarHBondContact O-N 3.02Å; H25-L28 PolarHBondContact O-N 2.96Å; L28-H30 VanDerWaalsContact C-N 3.32Å; L28-H30 PolarHBondContact O-N 2.89Å; L28-G31 PolarHBondContact O-N 3.19Å; L28-L32 HydrophobicContact CD1-CD1 4.29Å; L28-L32 HydrophobicContact CD1-CG 4.23Å; L28-L32 HydrophobicContact CG-CD1 4.13Å; L28-L32 HydrophobicContact CG-CG 4.48Å; L28-L32 WeakPolarHBondContact O-CG 3.33Å; L28-L32 PolarHBondContact O-N 3.42Å |
| 29 | L | 97.9 | Very high | 97.8 | Very high | 128 Ų | 128 | 100.6 Ų | 100.6 | 67% | 0.67 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -63 | -39.8 | 179.9 | -165.3 | 121.8 | 0 | 0 | 0 | 111.7 | H25 L26 H33 | H25-L29 WeakPolarHBondContact O-CB 3.38Å; H25-L29 PolarHBondContact O-N 3.47Å; L26-L29 PolarHBondContact O-N 2.95Å; L29-H33 WeakPolarHBondContact O-CB 3.49Å; L29-H33 PolarHBondContact O-N 3.22Å |
| 30 | H | 98 | Very high | 97.8 | Very high | 111 Ų | 111 | 101.3 Ų | 101.3 | 51% | 0.514 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -64.2 | -44.2 | 173.4 | -175 | 63.5 | 0 | 0 | 0 | 112.1 | L26 T27 L28 H33 L34 | L26-H30 WeakPolarHBondContact O-CB 3.39Å; L26-H30 PolarHBondContact O-N 2.93Å; T27-H30 PolarHBondContact O-N 2.94Å; L28-H30 VanDerWaalsContact C-N 3.32Å; L28-H30 PolarHBondContact O-N 2.89Å; H30-H33 WeakPolarHBondContact O-CB 3.45Å; H30-H33 PolarHBondContact O-N 3.4Å; H30-L34 PolarHBondContact O-N 3.02Å; H30-L34 VanDerWaalsContact O-N 3.11Å |
| 31 | G | 98.3 | Very high | 97.9 | Very high | 36 Ų | 36 | 101.8 Ų | 101.8 | 37% | 0.371 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.1 | -47.2 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | T27 L28 H33 L34 E35 | T27-G31 PolarHBondContact O-N 3.25Å; L28-G31 PolarHBondContact O-N 3.19Å; G31-H33 VanDerWaalsContact C-N 3.3Å; G31-H33 PolarHBondContact O-N 3.11Å; G31-L34 PolarHBondContact O-N 3.27Å; G31-E35 PolarHBondContact O-N 3.04Å |
| 32 | L | 98.4 | Very high | 97.9 | Very high | 86 Ų | 86 | 105 Ų | 105 | 45% | 0.45 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.5 | -38.8 | 176.1 | -69.9 | 174.4 | 0 | 0 | 0 | 112 | L28 L34 E35 I36 | L28-L32 HydrophobicContact CD1-CD1 4.29Å; L28-L32 HydrophobicContact CD1-CG 4.23Å; L28-L32 HydrophobicContact CG-CD1 4.13Å; L28-L32 HydrophobicContact CG-CG 4.48Å; L28-L32 WeakPolarHBondContact O-CG 3.33Å; L28-L32 PolarHBondContact O-N 3.42Å; L32-L34 VanDerWaalsContact C-N 3.35Å; L32-L34 PolarHBondContact O-N 3.48Å; L32-E35 PolarHBondContact O-N 2.92Å; L32-I36 VanDerWaalsContact O-CG1 3.27Å; L32-I36 WeakPolarHBondContact O-CG1 3.27Å; L32-I36 PolarHBondContact O-N 3.28Å |
| 33 | H | 98.2 | Very high | 98 | Very high | 102 Ų | 102 | 100 Ų | 100 | 47% | 0.472 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.7 | -43.3 | 176.6 | -173.4 | 67.6 | 0 | 0 | 0 | 111.9 | L29 H30 G31 E35 I36 L37 | L29-H33 WeakPolarHBondContact O-CB 3.49Å; L29-H33 PolarHBondContact O-N 3.22Å; H30-H33 WeakPolarHBondContact O-CB 3.45Å; H30-H33 PolarHBondContact O-N 3.4Å; G31-H33 VanDerWaalsContact C-N 3.3Å; G31-H33 PolarHBondContact O-N 3.11Å; H33-E35 VanDerWaalsContact C-N 3.35Å; H33-E35 PolarHBondContact O-N 3.22Å; H33-I36 PolarHBondContact O-N 2.86Å; H33-L37 VanDerWaalsContact O-CG 3.31Å; H33-L37 WeakPolarHBondContact O-CG 3.46Å; H33-L37 PolarHBondContact O-N 3.45Å |
| 34 | L | 98.4 | Very high | 98 | Very high | 92 Ų | 92 | 98 Ų | 98 | 48% | 0.482 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.4 | -38.4 | 175.7 | -67 | 176.2 | 0 | 0 | 0 | 112.3 | H30 G31 L32 L37 S38 | H30-L34 PolarHBondContact O-N 3.02Å; H30-L34 VanDerWaalsContact O-N 3.11Å; G31-L34 PolarHBondContact O-N 3.27Å; L32-L34 VanDerWaalsContact C-N 3.35Å; L32-L34 PolarHBondContact O-N 3.48Å; L34-L37 PolarHBondContact O-N 3.5Å; L34-S38 WeakPolarHBondContact O-CB 3.31Å; L34-S38 PolarHBondContact O-N 3.41Å |
| 35 | E | 98.3 | Very high | 97.9 | Very high | 113 Ų | 113 | 98 Ų | 98 | 53% | 0.528 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -65.7 | -43.2 | 176.8 | -171.1 | 174.4 | -170.7 | 0 | 0 | 111.8 | G31 L32 H33 L37 S38 L39 | G31-E35 PolarHBondContact O-N 3.04Å; L32-E35 PolarHBondContact O-N 2.92Å; H33-E35 VanDerWaalsContact C-N 3.35Å; H33-E35 PolarHBondContact O-N 3.22Å; E35-L37 VanDerWaalsContact C-N 3.33Å; E35-L37 PolarHBondContact O-N 3.46Å; E35-S38 WeakPolarHBondContact O-CB 3.22Å; E35-S38 PolarHBondContact O-N 2.86Å; E35-L39 HydrophobicContact CG-CD1 4.25Å; E35-L39 WeakPolarHBondContact O-CB 3.49Å; E35-L39 WeakPolarHBondContact O-CG 3.4Å; E35-L39 PolarHBondContact O-N 2.88Å |
| 36 | I | 98.3 | Very high | 97.9 | Very high | 89 Ų | 89 | 96.7 Ų | 96.7 | 46% | 0.456 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -59.2 | -46.5 | 174 | -69.5 | 165.2 | 0 | 0 | 0 | 110.3 | L32 H33 S38 L39 Q40 | L32-I36 VanDerWaalsContact O-CG1 3.27Å; L32-I36 WeakPolarHBondContact O-CG1 3.27Å; L32-I36 PolarHBondContact O-N 3.28Å; H33-I36 PolarHBondContact O-N 2.86Å; I36-S38 VanDerWaalsContact C-N 3.34Å; I36-S38 PolarHBondContact O-N 3.37Å; I36-L39 PolarHBondContact O-N 2.95Å; I36-Q40 HydrophobicContact CG2-CG 4.33Å; I36-Q40 WeakPolarHBondContact O-CB 3.5Å; I36-Q40 WeakPolarHBondContact O-CG 3.46Å; I36-Q40 PolarHBondContact O-N 2.92Å |
| 37 | L | 98.3 | Very high | 97.7 | Very high | 79 Ų | 79 | 94.7 Ų | 94.7 | 41% | 0.414 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.6 | -40.6 | 177.4 | -69.9 | 175.2 | 0 | 0 | 0 | 112 | H33 L34 E35 Q40 K41 | H33-L37 VanDerWaalsContact O-CG 3.31Å; H33-L37 WeakPolarHBondContact O-CG 3.46Å; H33-L37 PolarHBondContact O-N 3.45Å; L34-L37 PolarHBondContact O-N 3.5Å; E35-L37 VanDerWaalsContact C-N 3.33Å; E35-L37 PolarHBondContact O-N 3.46Å; L37-Q40 PolarHBondContact O-N 3.38Å; L37-K41 WeakPolarHBondContact O-CB 3.35Å; L37-K41 PolarHBondContact O-N 3.01Å |
| 38 | S | 98.3 | Very high | 97.4 | Very high | 79 Ų | 79 | 94.3 Ų | 94.3 | 55% | 0.552 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -63 | -45.8 | 176.3 | -176.1 | 0 | 0 | 0 | 0 | 112.1 | L34 E35 I36 K41 R42 | L34-S38 WeakPolarHBondContact O-CB 3.31Å; L34-S38 PolarHBondContact O-N 3.41Å; E35-S38 WeakPolarHBondContact O-CB 3.22Å; E35-S38 PolarHBondContact O-N 2.86Å; I36-S38 VanDerWaalsContact C-N 3.34Å; I36-S38 PolarHBondContact O-N 3.37Å; S38-K41 WeakPolarHBondContact O-CB 3.49Å; S38-K41 PolarHBondContact O-N 2.94Å; S38-R42 PolarHBondContact O-N 3.29Å |
| 39 | L | 98.4 | Very high | 97.1 | Very high | 90 Ų | 90 | 93.4 Ų | 93.4 | 47% | 0.471 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64 | -43.8 | 176.2 | -79.2 | 166.9 | 0 | 0 | 0 | 111.7 | E35 I36 K41 R42 C43 | E35-L39 HydrophobicContact CG-CD1 4.25Å; E35-L39 WeakPolarHBondContact O-CB 3.49Å; E35-L39 WeakPolarHBondContact O-CG 3.4Å; E35-L39 PolarHBondContact O-N 2.88Å; I36-L39 PolarHBondContact O-N 2.95Å; L39-K41 VanDerWaalsContact C-N 3.29Å; L39-K41 PolarHBondContact O-N 3.38Å; L39-R42 PolarHBondContact O-N 2.87Å; L39-C43 WeakPolarHBondContact O-CB 3.35Å; L39-C43 PolarHBondContact O-N 3.45Å; L39-C43 PolarHBondContact O-SG 3.45Å |
| 40 | Q | 98.1 | Very high | 96.5 | Very high | 114 Ų | 114 | 97.4 Ų | 97.4 | 53% | 0.533 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -58 | -44.4 | 175.1 | -76.8 | 174.4 | -15.1 | 0 | 0 | 111.2 | I36 L37 C43 S44 | I36-Q40 HydrophobicContact CG2-CG 4.33Å; I36-Q40 WeakPolarHBondContact O-CB 3.5Å; I36-Q40 WeakPolarHBondContact O-CG 3.46Å; I36-Q40 PolarHBondContact O-N 2.92Å; L37-Q40 PolarHBondContact O-N 3.38Å; Q40-C43 PolarHBondContact O-N 2.93Å; Q40-S44 WeakPolarHBondContact O-CB 3.46Å; Q40-S44 PolarHBondContact O-N 3.34Å; Q40-S44 PolarHBondContact O-OG 3.49Å |
| 41 | K | 97.9 | Very high | 95.9 | Very high | 132 Ų | 132 | 100.3 Ų | 100.3 | 57% | 0.574 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -59.6 | -51.3 | 174.7 | -169.7 | -172.1 | -177.8 | -157 | 0 | 111.2 | L37 S38 L39 C43 S44 E45 | L37-K41 WeakPolarHBondContact O-CB 3.35Å; L37-K41 PolarHBondContact O-N 3.01Å; S38-K41 WeakPolarHBondContact O-CB 3.49Å; S38-K41 PolarHBondContact O-N 2.94Å; L39-K41 VanDerWaalsContact C-N 3.29Å; L39-K41 PolarHBondContact O-N 3.38Å; K41-C43 VanDerWaalsContact C-N 3.34Å; K41-C43 PolarHBondContact O-N 3.29Å; K41-S44 WeakPolarHBondContact O-CB 3.41Å; K41-S44 PolarHBondContact O-N 3.43Å; K41-S44 VanDerWaalsContact O-N 3.09Å; K41-S44 PolarHBondContact O-OG 2.83Å; K41-E45 WeakPolarHBondContact CE-OE1 3.48Å; K41-E45 IonicContact NZ-OE1 3.89Å; K41-E45 WeakPolarHBondContact O-CG 3.5Å; K41-E45 PolarHBondContact O-N 3.25Å |
| 42 | R | 97.9 | Very high | 95 | Very high | 159 Ų | 159 | 102.9 Ų | 102.9 | 60% | 0.6 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -61.3 | -40.6 | 179.3 | -172.3 | 176.1 | -177.9 | -153.4 | 0.2 | 112.7 | S38 L39 S44 E45 L46 | S38-R42 PolarHBondContact O-N 3.29Å; L39-R42 PolarHBondContact O-N 2.87Å; R42-S44 VanDerWaalsContact C-N 3.32Å; R42-S44 PolarHBondContact O-N 2.63Å; R42-E45 PolarHBondContact O-N 3.09Å; R42-L46 HydrophobicContact CG-CD1 4.22Å; R42-L46 WeakPolarHBondContact O-CB 3.44Å; R42-L46 WeakPolarHBondContact O-CG 3.34Å; R42-L46 PolarHBondContact O-N 3.41Å |
| 43 | C | 97.6 | Very high | 94 | Very high | 74 Ų | 74 | 104.8 Ų | 104.8 | 50% | 0.5 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -63.2 | -40 | 174.8 | -73.8 | 0 | 0 | 0 | 0 | 111.4 | L39 Q40 K41 T47 | L39-C43 WeakPolarHBondContact O-CB 3.35Å; L39-C43 PolarHBondContact O-N 3.45Å; L39-C43 PolarHBondContact O-SG 3.45Å; Q40-C43 PolarHBondContact O-N 2.93Å; K41-C43 VanDerWaalsContact C-N 3.34Å; K41-C43 PolarHBondContact O-N 3.29Å; C43-T47 VanDerWaalsContact O-CB 3.29Å; C43-T47 WeakPolarHBondContact O-CB 3.29Å; C43-T47 PolarHBondContact O-N 2.71Å; C43-T47 PolarHBondContact O-OG1 2.87Å |
| 44 | S | 96.9 | Very high | 92.5 | Very high | 71 Ų | 71 | 105 Ų | 105 | 50% | 0.497 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -66.6 | -41 | 175.5 | 74.6 | 0 | 0 | 0 | 0 | 112.2 | Q40 K41 R42 T47 S48 | Q40-S44 WeakPolarHBondContact O-CB 3.46Å; Q40-S44 PolarHBondContact O-N 3.34Å; Q40-S44 PolarHBondContact O-OG 3.49Å; K41-S44 WeakPolarHBondContact O-CB 3.41Å; K41-S44 PolarHBondContact O-N 3.43Å; K41-S44 VanDerWaalsContact O-N 3.09Å; K41-S44 PolarHBondContact O-OG 2.83Å; R42-S44 VanDerWaalsContact C-N 3.32Å; R42-S44 PolarHBondContact O-N 2.63Å; S44-T47 PolarHBondContact O-N 2.8Å; S44-S48 PolarHBondContact O-N 3.44Å; S44-S48 PolarHBondContact O-OG 2.98Å |
| 45 | E | 96.6 | Very high | 91.1 | Very high | 89 Ų | 89 | 106.4 Ų | 106.4 | 42% | 0.416 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -61.2 | -52.6 | 175.5 | -73 | 170.5 | -179.1 | 0 | 0 | 110.9 | K41 R42 T47 S48 E49 | K41-E45 WeakPolarHBondContact CE-OE1 3.48Å; K41-E45 IonicContact NZ-OE1 3.89Å; K41-E45 WeakPolarHBondContact O-CG 3.5Å; K41-E45 PolarHBondContact O-N 3.25Å; R42-E45 PolarHBondContact O-N 3.09Å; E45-T47 VanDerWaalsContact C-N 3.27Å; E45-T47 PolarHBondContact O-N 2.67Å; E45-S48 WeakPolarHBondContact CA-OG 3.11Å; E45-S48 CarbonylContact O-C 3.57Å; E45-S48 WeakPolarHBondContact O-CA 3.5Å; E45-S48 PolarHBondContact O-N 2.71Å; E45-S48 PolarHBondContact O-OG 3.29Å; E45-E49 PolarHBondContact O-N 3.33Å |
| 46 | L | 95.5 | Very high | 89.7 | Confident | 90 Ų | 90 | 103.9 Ų | 103.9 | 47% | 0.471 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -60.5 | -36.1 | 177.2 | -70.4 | 171.6 | 0 | 0 | 0 | 112.7 | R42 R50 | R42-L46 HydrophobicContact CG-CD1 4.22Å; R42-L46 WeakPolarHBondContact O-CB 3.44Å; R42-L46 WeakPolarHBondContact O-CG 3.34Å; R42-L46 PolarHBondContact O-N 3.41Å; L46-R50 WeakPolarHBondContact O-CB 3.32Å; L46-R50 PolarHBondContact O-N 2.97Å |
| 47 | T | 94.1 | Very high | 88.8 | Confident | 71 Ų | 71 | 106.8 Ų | 106.8 | 44% | 0.436 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -67.2 | -40.5 | 175.2 | -59.6 | 0 | 0 | 0 | 0 | 111 | C43 S44 E45 K51 | C43-T47 VanDerWaalsContact O-CB 3.29Å; C43-T47 WeakPolarHBondContact O-CB 3.29Å; C43-T47 PolarHBondContact O-N 2.71Å; C43-T47 PolarHBondContact O-OG1 2.87Å; S44-T47 PolarHBondContact O-N 2.8Å; E45-T47 VanDerWaalsContact C-N 3.27Å; E45-T47 PolarHBondContact O-N 2.67Å; T47-K51 HydrophobicContact CG2-CD 4.28Å; T47-K51 VanDerWaalsContact O-CG 3.25Å; T47-K51 WeakPolarHBondContact O-CG 3.49Å; T47-K51 PolarHBondContact O-N 3.05Å; T47-K51 VanDerWaalsContact O-N 3.14Å |
| 48 | S | 91.3 | Very high | 88.2 | Confident | 68 Ų | 68 | 106 Ų | 106 | 48% | 0.476 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -67.4 | -42.5 | 174.6 | 69.8 | 0 | 0 | 0 | 0 | 112.1 | S44 E45 R50 K51 S52 | S44-S48 PolarHBondContact O-N 3.44Å; S44-S48 PolarHBondContact O-OG 2.98Å; E45-S48 WeakPolarHBondContact CA-OG 3.11Å; E45-S48 CarbonylContact O-C 3.57Å; E45-S48 WeakPolarHBondContact O-CA 3.5Å; E45-S48 PolarHBondContact O-N 2.71Å; E45-S48 PolarHBondContact O-OG 3.29Å; S48-R50 VanDerWaalsContact C-N 3.32Å; S48-R50 PolarHBondContact O-N 3.14Å; S48-K51 CarbonylContact O-C 3.57Å; S48-K51 PolarHBondContact O-N 3.14Å; S48-K51 VanDerWaalsContact O-N 3.1Å; S48-S52 WeakPolarHBondContact O-CB 3.25Å; S48-S52 PolarHBondContact O-N 3.15Å; S48-S52 PolarHBondContact O-OG 3.1Å |
| 49 | E | 91.5 | Very high | 87.7 | Confident | 88 Ų | 88 | 108.5 Ų | 108.5 | 41% | 0.411 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -61.7 | -40.5 | 177.5 | -166.3 | -164.5 | 149.5 | 0 | 0 | 111.5 | E45 K51 S52 K53 | E45-E49 PolarHBondContact O-N 3.33Å; E49-K51 VanDerWaalsContact C-N 3.33Å; E49-S52 WeakPolarHBondContact CA-OG 3.39Å; E49-S52 PolarHBondContact O-N 3.43Å; E49-S52 PolarHBondContact O-OG 3.4Å; E49-K53 WeakPolarHBondContact O-CB 3.37Å; E49-K53 WeakPolarHBondContact O-CG 3.45Å; E49-K53 PolarHBondContact O-N 2.89Å; E49-K53 WeakPolarHBondContact OE1-CE 3.41Å; E49-K53 IonicContact OE1-NZ 3.31Å; E49-K53 PolarHBondContact OE1-NZ 2.79Å |
| 50 | R | 87.1 | Confident | 87.3 | Confident | 213 Ų | 213 | 109.6 Ų | 109.6 | 80% | 0.804 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -67.6 | -33.3 | 175.7 | -170.6 | 179 | -177.6 | -166.7 | 1.4 | 112.6 | L46 S48 | L46-R50 WeakPolarHBondContact O-CB 3.32Å; L46-R50 PolarHBondContact O-N 2.97Å; S48-R50 VanDerWaalsContact C-N 3.32Å; S48-R50 PolarHBondContact O-N 3.14Å |
| 51 | K | 83.4 | Confident | 86.9 | Confident | 172 Ų | 172 | 108.5 Ų | 108.5 | 75% | 0.748 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -78.4 | -31.4 | 176.2 | -72.9 | 173 | -179.5 | -179 | 0 | 112.4 | T47 S48 E49 | T47-K51 HydrophobicContact CG2-CD 4.28Å; T47-K51 VanDerWaalsContact O-CG 3.25Å; T47-K51 WeakPolarHBondContact O-CG 3.49Å; T47-K51 PolarHBondContact O-N 3.05Å; T47-K51 VanDerWaalsContact O-N 3.14Å; S48-K51 CarbonylContact O-C 3.57Å; S48-K51 PolarHBondContact O-N 3.14Å; S48-K51 VanDerWaalsContact O-N 3.1Å; E49-K51 VanDerWaalsContact C-N 3.33Å |
| 52 | S | 81.2 | Confident | 86.6 | Confident | 89 Ų | 89 | 105.6 Ų | 105.6 | 62% | 0.622 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -84.8 | -23 | 179.7 | 66.8 | 0 | 0 | 0 | 0 | 112.9 | S48 E49 P54 | S48-S52 WeakPolarHBondContact O-CB 3.25Å; S48-S52 PolarHBondContact O-N 3.15Å; S48-S52 PolarHBondContact O-OG 3.1Å; E49-S52 WeakPolarHBondContact CA-OG 3.39Å; E49-S52 PolarHBondContact O-N 3.43Å; E49-S52 PolarHBondContact O-OG 3.4Å; S52-P54 VanDerWaalsContact O-CD 3.26Å; S52-P54 WeakPolarHBondContact O-CD 3.26Å |
| 53 | K | 76.6 | Confident | 86.5 | Confident | 127 Ų | 127 | 102.2 Ų | 102.2 | 55% | 0.552 | 54% | 0.544 | S | S | * | . | S | Bend | trans | -63.1 | 114.7 | 166.8 | -88.7 | 171.2 | 172.3 | 157 | 0 | 107.6 | E49 | E49-K53 WeakPolarHBondContact O-CB 3.37Å; E49-K53 WeakPolarHBondContact O-CG 3.45Å; E49-K53 PolarHBondContact O-N 2.89Å; E49-K53 WeakPolarHBondContact OE1-CE 3.41Å; E49-K53 IonicContact OE1-NZ 3.31Å; E49-K53 PolarHBondContact OE1-NZ 2.79Å |
| 54 | P | 66.2 | Low | 86.3 | Confident | 105 Ų | 105 | 104.1 Ų | 104.1 | 68% | 0.682 | 55% | 0.546 | S | S | * | . | P | Polyproline II helix | trans | -57.3 | 149.4 | 171.5 | 26 | -32.6 | 0 | 0 | 0 | 108.1 | S52 G56 | S52-P54 VanDerWaalsContact O-CD 3.26Å; S52-P54 WeakPolarHBondContact O-CD 3.26Å; P54-G56 PolarHBondContact O-N 3.07Å |
| 55 | P | 70.6 | Confident | 86.3 | Confident | 122 Ų | 122 | 104.2 Ų | 104.2 | 79% | 0.792 | 54% | 0.538 | S | S | * | . | P | Polyproline II helix | trans | -52.2 | 125.7 | 165.6 | 25.2 | -31.5 | 0 | 0 | 0 | 106.3 | ||
| 56 | G | 68.6 | Low | 86.2 | Confident | 60 Ų | 60 | 105.1 Ų | 105.1 | 62% | 0.619 | 54% | 0.543 | S | S | * | . | P | Polyproline II helix | trans | -53.7 | 160 | 168.4 | 0 | 0 | 0 | 0 | 0 | 109.2 | P54 T58 | P54-G56 PolarHBondContact O-N 3.07Å; G56-T58 PolarHBondContact O-N 3.16Å; G56-T58 VanDerWaalsContact O-N 3.16Å |
| 57 | R | 78.1 | Confident | 86.3 | Confident | 151 Ų | 151 | 107.4 Ų | 107.4 | 57% | 0.57 | 55% | 0.551 | S | S | * | * | S | Bend | trans | -40.2 | 127.4 | 176.8 | -72.9 | -179.3 | 177.5 | 172.2 | -5.7 | 109.7 | E61 L62 E65 | R57-E61 WeakPolarHBondContact CA-OE2 3.46Å; R57-E61 HydrophobicContact CB-CB 4.44Å; R57-L62 HydrophobicContact CB-CD2 3.77Å; R57-L62 HydrophobicContact CB-CG 3.88Å; R57-L62 HydrophobicContact CG-CD2 4.41Å; R57-E65 IonicContact CZ-OE1 2.71Å; R57-E65 IonicContact CZ-OE2 3.6Å; R57-E65 IonicContact NE-OE2 3.72Å; R57-E65 IonicContact NH1-OE1 3.57Å; R57-E65 PolarHBondContact NH1-OE1 3.27Å; R57-E65 IonicContact NH1-OE2 3.4Å; R57-E65 PolarHBondContact NH1-OE2 3.07Å; R57-E65 IonicContact NH2-OE1 2.94Å |
| 58 | T | 86.1 | Confident | 86.5 | Confident | 62 Ų | 62 | 110.6 Ų | 110.6 | 38% | 0.38 | 56% | 0.562 | S | S | . | * | trans | -62.5 | 151.9 | -178.2 | 61.7 | 0 | 0 | 0 | 0 | 108.9 | G56 I60 E61 L62 | G56-T58 PolarHBondContact O-N 3.16Å; G56-T58 VanDerWaalsContact O-N 3.16Å; T58-I60 PolarHBondContact O-N 3.13Å; T58-E61 WeakPolarHBondContact CG2-OE1 3.37Å; T58-E61 PolarHBondContact N-OE2 2.91Å; T58-E61 VanDerWaalsContact N-OE2 3.13Å; T58-E61 WeakPolarHBondContact O-CB 3.45Å; T58-E61 PolarHBondContact O-N 2.8Å; T58-E61 VanDerWaalsContact OG1-CG 3.26Å; T58-E61 WeakPolarHBondContact OG1-CG 3.5Å; T58-E61 PolarHBondContact OG1-N 3.02Å; T58-E61 PolarHBondContact OG1-OE1 3.03Å; T58-L62 PolarHBondContact O-N 3.37Å; T58-L62 VanDerWaalsContact O-N 3.07Å | ||
| 59 | Q | 87.1 | Confident | 86.8 | Confident | 132 Ų | 132 | 111.7 Ų | 111.7 | 62% | 0.617 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -53.6 | -30.1 | 178.7 | -175.8 | 63.3 | 41.4 | 0 | 0 | 111.9 | L63 | Q59-L63 HydrophobicContact CG-CD1 4.44Å; Q59-L63 VanDerWaalsContact O-CG 3.26Å; Q59-L63 WeakPolarHBondContact O-CG 3.45Å; Q59-L63 PolarHBondContact O-N 3.09Å |
| 60 | I | 90.1 | Very high | 87.1 | Confident | 113 Ų | 113 | 111.8 Ų | 111.8 | 58% | 0.579 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -70.5 | -49.2 | 177.6 | -60.4 | 170.6 | 0 | 0 | 0 | 110.6 | T58 L62 L63 E64 | T58-I60 PolarHBondContact O-N 3.13Å; I60-L62 PolarHBondContact O-N 2.94Å; I60-L63 PolarHBondContact O-N 3.21Å; I60-L63 VanDerWaalsContact O-N 3.09Å; I60-E64 WeakPolarHBondContact O-CG 3.33Å; I60-E64 PolarHBondContact O-N 2.6Å |
| 61 | E | 91.5 | Very high | 87.7 | Confident | 91 Ų | 91 | 104.2 Ų | 104.2 | 43% | 0.425 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -57.7 | -37.4 | 176.2 | -73.1 | 156.1 | -141.6 | 0 | 0 | 112.4 | R57 T58 E65 | R57-E61 WeakPolarHBondContact CA-OE2 3.46Å; R57-E61 HydrophobicContact CB-CB 4.44Å; T58-E61 WeakPolarHBondContact CG2-OE1 3.37Å; T58-E61 PolarHBondContact N-OE2 2.91Å; T58-E61 VanDerWaalsContact N-OE2 3.13Å; T58-E61 WeakPolarHBondContact O-CB 3.45Å; T58-E61 PolarHBondContact O-N 2.8Å; T58-E61 VanDerWaalsContact OG1-CG 3.26Å; T58-E61 WeakPolarHBondContact OG1-CG 3.5Å; T58-E61 PolarHBondContact OG1-N 3.02Å; T58-E61 PolarHBondContact OG1-OE1 3.03Å; E61-E65 WeakPolarHBondContact O-CB 3.36Å; E61-E65 PolarHBondContact O-N 2.79Å |
| 62 | L | 91.3 | Very high | 88.4 | Confident | 70 Ų | 70 | 103.8 Ų | 103.8 | 37% | 0.366 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -66.7 | -40.2 | 176.8 | -68.8 | 175 | 0 | 0 | 0 | 112.2 | R57 T58 I60 E65 E66 | R57-L62 HydrophobicContact CB-CD2 3.77Å; R57-L62 HydrophobicContact CB-CG 3.88Å; R57-L62 HydrophobicContact CG-CD2 4.41Å; T58-L62 PolarHBondContact O-N 3.37Å; T58-L62 VanDerWaalsContact O-N 3.07Å; I60-L62 PolarHBondContact O-N 2.94Å; L62-E65 PolarHBondContact O-N 3.47Å; L62-E66 WeakPolarHBondContact O-CB 3.26Å; L62-E66 PolarHBondContact O-N 2.96Å |
| 63 | L | 94.6 | Very high | 89.2 | Confident | 89 Ų | 89 | 102.8 Ų | 102.8 | 47% | 0.466 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -67.7 | -40.7 | 177.1 | -72 | 167.7 | 0 | 0 | 0 | 111.6 | Q59 I60 E66 E67 | Q59-L63 HydrophobicContact CG-CD1 4.44Å; Q59-L63 VanDerWaalsContact O-CG 3.26Å; Q59-L63 WeakPolarHBondContact O-CG 3.45Å; Q59-L63 PolarHBondContact O-N 3.09Å; I60-L63 PolarHBondContact O-N 3.21Å; I60-L63 VanDerWaalsContact O-N 3.09Å; L63-E66 PolarHBondContact O-N 3.41Å; L63-E67 WeakPolarHBondContact O-CB 3.26Å; L63-E67 PolarHBondContact O-N 2.94Å |
| 64 | E | 95 | Very high | 90.3 | Very high | 113 Ų | 113 | 102.1 Ų | 102.1 | 53% | 0.528 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -63.4 | -42.1 | 175.5 | -70.4 | 174.4 | 177.5 | 0 | 0 | 111.4 | I60 E67 M68 | I60-E64 WeakPolarHBondContact O-CG 3.33Å; I60-E64 PolarHBondContact O-N 2.6Å; E64-E67 PolarHBondContact O-N 2.9Å; E64-M68 WeakPolarHBondContact O-CB 3.26Å; E64-M68 WeakPolarHBondContact O-CG 3.42Å; E64-M68 PolarHBondContact O-N 3.27Å |
| 65 | E | 94.9 | Very high | 91.8 | Very high | 73 Ų | 73 | 102.3 Ų | 102.3 | 34% | 0.341 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65.2 | -41.3 | 176.1 | -173.1 | 176.8 | -163.5 | 0 | 0 | 111.9 | R57 E61 L62 M68 L69 | R57-E65 IonicContact CZ-OE1 2.71Å; R57-E65 IonicContact CZ-OE2 3.6Å; R57-E65 IonicContact NE-OE2 3.72Å; R57-E65 IonicContact NH1-OE1 3.57Å; R57-E65 PolarHBondContact NH1-OE1 3.27Å; R57-E65 IonicContact NH1-OE2 3.4Å; R57-E65 PolarHBondContact NH1-OE2 3.07Å; R57-E65 IonicContact NH2-OE1 2.94Å; E61-E65 WeakPolarHBondContact O-CB 3.36Å; E61-E65 PolarHBondContact O-N 2.79Å; L62-E65 PolarHBondContact O-N 3.47Å; E65-M68 PolarHBondContact O-N 3.43Å; E65-L69 HydrophobicContact CG-CD1 4.25Å; E65-L69 WeakPolarHBondContact O-CB 3.46Å; E65-L69 VanDerWaalsContact O-CG 3.26Å; E65-L69 WeakPolarHBondContact O-CG 3.27Å; E65-L69 PolarHBondContact O-N 3.49Å |
| 66 | E | 95.8 | Very high | 93.2 | Very high | 109 Ų | 109 | 100.9 Ų | 100.9 | 51% | 0.509 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.1 | -47.5 | 174.4 | -176 | 170 | -151.2 | 0 | 0 | 111.2 | L62 L63 M68 L69 E70 | L62-E66 WeakPolarHBondContact O-CB 3.26Å; L62-E66 PolarHBondContact O-N 2.96Å; L63-E66 PolarHBondContact O-N 3.41Å; E66-M68 VanDerWaalsContact C-N 3.35Å; E66-M68 PolarHBondContact O-N 3.26Å; E66-L69 PolarHBondContact O-N 2.87Å; E66-E70 WeakPolarHBondContact O-CB 3.43Å; E66-E70 WeakPolarHBondContact O-CG 3.21Å; E66-E70 PolarHBondContact O-N 2.83Å |
| 67 | E | 97.3 | Very high | 94.6 | Very high | 138 Ų | 138 | 103.5 Ų | 103.5 | 65% | 0.645 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -60.5 | -43.1 | 177.2 | -175.3 | 177.3 | -174.8 | 0 | 0 | 111.9 | L63 E64 E70 A71 | L63-E67 WeakPolarHBondContact O-CB 3.26Å; L63-E67 PolarHBondContact O-N 2.94Å; E64-E67 PolarHBondContact O-N 2.9Å; E67-E70 PolarHBondContact O-N 3.27Å; E67-A71 WeakPolarHBondContact O-CB 3.47Å; E67-A71 PolarHBondContact O-N 3.41Å |
| 68 | M | 97.9 | Very high | 95.6 | Very high | 137 Ų | 137 | 99.8 Ų | 99.8 | 68% | 0.675 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -64.5 | -41.3 | 177.2 | -74.4 | -64.3 | -58.7 | 0 | 0 | 112.3 | E64 E65 E66 A71 R72 | E64-M68 WeakPolarHBondContact O-CB 3.26Å; E64-M68 WeakPolarHBondContact O-CG 3.42Å; E64-M68 PolarHBondContact O-N 3.27Å; E65-M68 PolarHBondContact O-N 3.43Å; E66-M68 VanDerWaalsContact C-N 3.35Å; E66-M68 PolarHBondContact O-N 3.26Å; M68-A71 PolarHBondContact O-N 2.97Å; M68-R72 WeakPolarHBondContact O-CB 3.42Å; M68-R72 PolarHBondContact O-N 3Å |
| 69 | L | 98 | Very high | 96.2 | Very high | 92 Ų | 92 | 102.8 Ų | 102.8 | 48% | 0.482 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66.7 | -42.5 | 175.9 | -73.3 | 172.4 | 0 | 0 | 0 | 111.1 | E65 E66 A71 R72 C73 | E65-L69 HydrophobicContact CG-CD1 4.25Å; E65-L69 WeakPolarHBondContact O-CB 3.46Å; E65-L69 VanDerWaalsContact O-CG 3.26Å; E65-L69 WeakPolarHBondContact O-CG 3.27Å; E65-L69 PolarHBondContact O-N 3.49Å; E66-L69 PolarHBondContact O-N 2.87Å; L69-A71 PolarHBondContact O-N 3.44Å; L69-R72 PolarHBondContact O-N 3.45Å; L69-C73 WeakPolarHBondContact O-CB 3.34Å; L69-C73 PolarHBondContact O-N 3.37Å; L69-C73 PolarHBondContact O-SG 3.34Å |
| 70 | E | 98.4 | Very high | 96.7 | Very high | 90 Ų | 90 | 100.7 Ų | 100.7 | 42% | 0.421 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -59.9 | -45.2 | 173.8 | -78.8 | -168.2 | -167.9 | 0 | 0 | 112.1 | E66 E67 R72 C73 K74 | E66-E70 WeakPolarHBondContact O-CB 3.43Å; E66-E70 WeakPolarHBondContact O-CG 3.21Å; E66-E70 PolarHBondContact O-N 2.83Å; E67-E70 PolarHBondContact O-N 3.27Å; E70-R72 VanDerWaalsContact C-N 3.29Å; E70-R72 PolarHBondContact O-N 2.82Å; E70-C73 PolarHBondContact O-N 3.25Å; E70-K74 WeakPolarHBondContact O-CB 3.49Å; E70-K74 VanDerWaalsContact O-CG 3.27Å; E70-K74 WeakPolarHBondContact O-CG 3.39Å; E70-K74 PolarHBondContact O-N 2.93Å; E70-K74 IonicContact OE2-NZ 2.94Å; E70-K74 PolarHBondContact OE2-NZ 3.42Å |
| 71 | A | 98.4 | Very high | 97.1 | Very high | 53 Ų | 53 | 100 Ų | 100 | 44% | 0.438 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -60.2 | -42.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | E67 M68 L69 K74 E75 | E67-A71 WeakPolarHBondContact O-CB 3.47Å; E67-A71 PolarHBondContact O-N 3.41Å; M68-A71 PolarHBondContact O-N 2.97Å; L69-A71 PolarHBondContact O-N 3.44Å; A71-K74 PolarHBondContact O-N 2.9Å; A71-E75 PolarHBondContact O-N 2.88Å |
| 72 | R | 98.6 | Very high | 97.5 | Very high | 164 Ų | 164 | 101.8 Ų | 101.8 | 62% | 0.619 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -66.1 | -41 | 175.9 | -172.3 | -179.5 | 179.9 | -164 | 0.8 | 112.4 | M68 L69 E70 E75 L76 | M68-R72 WeakPolarHBondContact O-CB 3.42Å; M68-R72 PolarHBondContact O-N 3Å; L69-R72 PolarHBondContact O-N 3.45Å; E70-R72 VanDerWaalsContact C-N 3.29Å; E70-R72 PolarHBondContact O-N 2.82Å; R72-E75 PolarHBondContact O-N 3.38Å; R72-L76 HydrophobicContact CG-CD1 4.43Å; R72-L76 WeakPolarHBondContact O-CG 3.46Å; R72-L76 PolarHBondContact O-N 3.01Å |
| 73 | C | 98.5 | Very high | 97.8 | Very high | 68 Ų | 68 | 103.5 Ų | 103.5 | 46% | 0.459 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -61 | -47.5 | 175 | -73 | 0 | 0 | 0 | 0 | 110.7 | L69 E70 E75 L76 E77 | L69-C73 WeakPolarHBondContact O-CB 3.34Å; L69-C73 PolarHBondContact O-N 3.37Å; L69-C73 PolarHBondContact O-SG 3.34Å; E70-C73 PolarHBondContact O-N 3.25Å; C73-E75 VanDerWaalsContact C-N 3.32Å; C73-E75 PolarHBondContact O-N 3.36Å; C73-L76 PolarHBondContact O-N 3.1Å; C73-L76 VanDerWaalsContact O-N 3.12Å; C73-E77 WeakPolarHBondContact O-CG 3.39Å; C73-E77 PolarHBondContact O-N 3.42Å |
| 74 | K | 98.7 | Very high | 98 | Very high | 112 Ų | 112 | 104.6 Ų | 104.6 | 49% | 0.487 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -58.9 | -41.8 | 176.4 | -70.7 | 163.6 | -172.6 | 154.2 | 0 | 111.8 | E70 A71 E77 T78 | E70-K74 WeakPolarHBondContact O-CB 3.49Å; E70-K74 VanDerWaalsContact O-CG 3.27Å; E70-K74 WeakPolarHBondContact O-CG 3.39Å; E70-K74 PolarHBondContact O-N 2.93Å; E70-K74 IonicContact OE2-NZ 2.94Å; E70-K74 PolarHBondContact OE2-NZ 3.42Å; A71-K74 PolarHBondContact O-N 2.9Å; K74-E77 PolarHBondContact O-N 3.12Å; K74-T78 WeakPolarHBondContact O-CG2 3.34Å; K74-T78 PolarHBondContact O-N 3.49Å; K74-T78 PolarHBondContact O-OG1 3.41Å |
| 75 | E | 98.7 | Very high | 98.2 | Very high | 110 Ų | 110 | 106.7 Ų | 106.7 | 51% | 0.514 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.3 | -40 | 175.5 | -171.6 | -168.1 | 163.9 | 0 | 0 | 112.4 | A71 R72 C73 T78 R79 | A71-E75 PolarHBondContact O-N 2.88Å; R72-E75 PolarHBondContact O-N 3.38Å; C73-E75 VanDerWaalsContact C-N 3.32Å; C73-E75 PolarHBondContact O-N 3.36Å; E75-T78 PolarHBondContact O-OG1 2.96Å; E75-R79 WeakPolarHBondContact O-CB 3.41Å; E75-R79 VanDerWaalsContact O-CG 3.23Å; E75-R79 WeakPolarHBondContact O-CG 3.5Å; E75-R79 PolarHBondContact O-N 3.49Å; E75-R79 VanDerWaalsContact O-N 3.08Å |
| 76 | L | 98.6 | Very high | 98.4 | Very high | 91 Ų | 91 | 106.8 Ų | 106.8 | 48% | 0.476 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -69 | -37.5 | 177.5 | -70.4 | 174.9 | 0 | 0 | 0 | 111.9 | R72 C73 R79 L80 | R72-L76 HydrophobicContact CG-CD1 4.43Å; R72-L76 WeakPolarHBondContact O-CG 3.46Å; R72-L76 PolarHBondContact O-N 3.01Å; C73-L76 PolarHBondContact O-N 3.1Å; C73-L76 VanDerWaalsContact O-N 3.12Å; L76-R79 PolarHBondContact O-N 2.87Å; L76-L80 WeakPolarHBondContact O-CB 3.41Å; L76-L80 PolarHBondContact O-N 2.87Å |
| 77 | E | 98.6 | Very high | 98.5 | Very high | 116 Ų | 116 | 105.5 Ų | 105.5 | 54% | 0.542 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61.1 | -50.3 | 174 | -73.8 | 169.3 | -178 | 0 | 0 | 111.1 | C73 K74 R79 L80 D81 | C73-E77 WeakPolarHBondContact O-CG 3.39Å; C73-E77 PolarHBondContact O-N 3.42Å; K74-E77 PolarHBondContact O-N 3.12Å; E77-R79 VanDerWaalsContact C-N 3.31Å; E77-R79 PolarHBondContact O-N 2.98Å; E77-L80 WeakPolarHBondContact O-CB 3.42Å; E77-L80 PolarHBondContact O-N 3Å; E77-L80 VanDerWaalsContact O-N 3.1Å; E77-D81 PolarHBondContact O-N 3.39Å |
| 78 | T | 98.7 | Very high | 98.6 | Very high | 72 Ų | 72 | 99.9 Ų | 99.9 | 44% | 0.442 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -61.4 | -40.5 | 178.4 | 57.5 | 0 | 0 | 0 | 0 | 112.1 | K74 E75 L80 D81 E82 | K74-T78 WeakPolarHBondContact O-CG2 3.34Å; K74-T78 PolarHBondContact O-N 3.49Å; K74-T78 PolarHBondContact O-OG1 3.41Å; E75-T78 PolarHBondContact O-OG1 2.96Å; T78-L80 VanDerWaalsContact C-N 3.33Å; T78-L80 PolarHBondContact O-N 3.32Å; T78-D81 PolarHBondContact O-N 3.07Å; T78-E82 WeakPolarHBondContact O-CG 3.42Å; T78-E82 PolarHBondContact O-N 3.38Å |
| 79 | R | 98.8 | Very high | 98.6 | Very high | 125 Ų | 125 | 96.3 Ų | 96.3 | 47% | 0.472 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -65.6 | -35.6 | 176.1 | -73.2 | 177.9 | 68.4 | -170.7 | -0.9 | 112.5 | E75 L76 E77 Q83 | E75-R79 WeakPolarHBondContact O-CB 3.41Å; E75-R79 VanDerWaalsContact O-CG 3.23Å; E75-R79 WeakPolarHBondContact O-CG 3.5Å; E75-R79 PolarHBondContact O-N 3.49Å; E75-R79 VanDerWaalsContact O-N 3.08Å; L76-R79 PolarHBondContact O-N 2.87Å; E77-R79 VanDerWaalsContact C-N 3.31Å; E77-R79 PolarHBondContact O-N 2.98Å; R79-Q83 VanDerWaalsContact O-CG 3.29Å; R79-Q83 WeakPolarHBondContact O-CG 3.41Å; R79-Q83 PolarHBondContact O-N 3.49Å; R79-Q83 VanDerWaalsContact O-N 3.17Å |
| 80 | L | 98.8 | Very high | 98.7 | Very high | 88 Ų | 88 | 96.8 Ų | 96.8 | 46% | 0.461 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -66.8 | -46.1 | 174.4 | -179.1 | 65.9 | 0 | 0 | 0 | 110.3 | L76 E77 T78 E82 Q83 E84 | L76-L80 WeakPolarHBondContact O-CB 3.41Å; L76-L80 PolarHBondContact O-N 2.87Å; E77-L80 WeakPolarHBondContact O-CB 3.42Å; E77-L80 PolarHBondContact O-N 3Å; E77-L80 VanDerWaalsContact O-N 3.1Å; T78-L80 VanDerWaalsContact C-N 3.33Å; T78-L80 PolarHBondContact O-N 3.32Å; L80-E82 VanDerWaalsContact C-N 3.33Å; L80-E82 PolarHBondContact O-N 2.83Å; L80-Q83 CarbonylContact O-C 3.59Å; L80-Q83 WeakPolarHBondContact O-CA 3.29Å; L80-Q83 WeakPolarHBondContact O-CB 3.23Å; L80-Q83 PolarHBondContact O-N 3.33Å; L80-Q83 VanDerWaalsContact O-N 3.07Å; L80-E84 HydrophobicContact CD1-CG 4.41Å; L80-E84 HydrophobicContact CG-CG 4.41Å; L80-E84 WeakPolarHBondContact O-CG 3.34Å; L80-E84 PolarHBondContact O-N 3.48Å |
| 81 | D | 98.6 | Very high | 98.7 | Very high | 99 Ų | 99 | 100.6 Ų | 100.6 | 53% | 0.529 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -59.1 | -42.9 | 178.4 | -71 | -20.8 | 0 | 0 | 0 | 112.1 | E77 T78 Q83 E84 Y85 | E77-D81 PolarHBondContact O-N 3.39Å; T78-D81 PolarHBondContact O-N 3.07Å; D81-Q83 VanDerWaalsContact C-N 3.34Å; D81-Q83 PolarHBondContact O-N 3.17Å; D81-E84 PolarHBondContact O-N 3.46Å; D81-Y85 WeakPolarHBondContact O-CB 3.35Å; D81-Y85 PolarHBondContact O-N 2.69Å |
| 82 | E | 98.7 | Very high | 98.7 | Very high | 128 Ų | 128 | 104.4 Ų | 104.4 | 60% | 0.598 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -60.9 | -42.3 | 174.2 | -73.6 | 174.9 | 179 | 0 | 0 | 112 | T78 L80 Y85 T86 | T78-E82 WeakPolarHBondContact O-CG 3.42Å; T78-E82 PolarHBondContact O-N 3.38Å; L80-E82 VanDerWaalsContact C-N 3.33Å; L80-E82 PolarHBondContact O-N 2.83Å; E82-Y85 PolarHBondContact O-N 2.99Å; E82-T86 VanDerWaalsContact O-CG2 3.3Å; E82-T86 WeakPolarHBondContact O-CG2 3.22Å; E82-T86 PolarHBondContact O-N 3.07Å; E82-T86 PolarHBondContact O-OG1 3.3Å; E82-T86 VanDerWaalsContact O-OG1 3.06Å |
| 83 | Q | 98.7 | Very high | 98.7 | Very high | 107 Ų | 107 | 101.1 Ų | 101.1 | 50% | 0.5 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.6 | -43 | 175.9 | -73.9 | 178 | 11.5 | 0 | 0 | 111.7 | R79 L80 D81 Y85 T86 L87 | R79-Q83 VanDerWaalsContact O-CG 3.29Å; R79-Q83 WeakPolarHBondContact O-CG 3.41Å; R79-Q83 PolarHBondContact O-N 3.49Å; R79-Q83 VanDerWaalsContact O-N 3.17Å; L80-Q83 CarbonylContact O-C 3.59Å; L80-Q83 WeakPolarHBondContact O-CA 3.29Å; L80-Q83 WeakPolarHBondContact O-CB 3.23Å; L80-Q83 PolarHBondContact O-N 3.33Å; L80-Q83 VanDerWaalsContact O-N 3.07Å; D81-Q83 VanDerWaalsContact C-N 3.34Å; D81-Q83 PolarHBondContact O-N 3.17Å; Q83-Y85 VanDerWaalsContact C-N 3.34Å; Q83-Y85 PolarHBondContact O-N 3.12Å; Q83-T86 WeakPolarHBondContact CA-OG1 3.42Å; Q83-T86 PolarHBondContact O-N 2.92Å; Q83-T86 PolarHBondContact O-OG1 2.99Å; Q83-L87 WeakPolarHBondContact O-CB 3.41Å; Q83-L87 VanDerWaalsContact O-CG 3.22Å; Q83-L87 WeakPolarHBondContact O-CG 3.34Å; Q83-L87 PolarHBondContact O-N 3.32Å |
| 84 | E | 98.7 | Very high | 98.7 | Very high | 111 Ų | 111 | 104 Ų | 104 | 52% | 0.519 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.2 | -40.9 | 177.7 | -71.5 | -171.7 | 173.3 | 0 | 0 | 111.7 | L80 D81 L87 G88 | L80-E84 HydrophobicContact CD1-CG 4.41Å; L80-E84 HydrophobicContact CG-CG 4.41Å; L80-E84 WeakPolarHBondContact O-CG 3.34Å; L80-E84 PolarHBondContact O-N 3.48Å; D81-E84 PolarHBondContact O-N 3.46Å; E84-L87 PolarHBondContact O-N 3.08Å; E84-G88 PolarHBondContact O-N 2.94Å |
| 85 | Y | 98.8 | Very high | 98.7 | Very high | 157 Ų | 157 | 100.8 Ų | 100.8 | 62% | 0.616 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -60.2 | -51.8 | 174.1 | 178.3 | -96.5 | 0 | 0 | 0 | 111.6 | D81 E82 Q83 L87 G88 E89 | D81-Y85 WeakPolarHBondContact O-CB 3.35Å; D81-Y85 PolarHBondContact O-N 2.69Å; E82-Y85 PolarHBondContact O-N 2.99Å; Q83-Y85 VanDerWaalsContact C-N 3.34Å; Q83-Y85 PolarHBondContact O-N 3.12Å; Y85-L87 PolarHBondContact O-N 3.06Å; Y85-G88 WeakPolarHBondContact O-CA 3.42Å; Y85-G88 PolarHBondContact O-N 3.5Å; Y85-E89 HydrophobicContact CD1-CG 4.44Å; Y85-E89 HydrophobicContact CE1-CG 3.94Å; Y85-E89 HydrophobicContact CE2-CG 4.49Å; Y85-E89 PolarHBondContact O-N 3.43Å |
| 86 | T | 98.6 | Very high | 98.7 | Very high | 75 Ų | 75 | 102.1 Ų | 102.1 | 46% | 0.46 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.7 | -40.7 | 179.8 | 53.8 | 0 | 0 | 0 | 0 | 112.1 | E82 Q83 G88 E89 L90 | E82-T86 VanDerWaalsContact O-CG2 3.3Å; E82-T86 WeakPolarHBondContact O-CG2 3.22Å; E82-T86 PolarHBondContact O-N 3.07Å; E82-T86 PolarHBondContact O-OG1 3.3Å; E82-T86 VanDerWaalsContact O-OG1 3.06Å; Q83-T86 WeakPolarHBondContact CA-OG1 3.42Å; Q83-T86 PolarHBondContact O-N 2.92Å; Q83-T86 PolarHBondContact O-OG1 2.99Å; T86-G88 VanDerWaalsContact C-N 3.3Å; T86-G88 PolarHBondContact O-N 2.9Å; T86-E89 PolarHBondContact O-N 3.41Å; T86-L90 WeakPolarHBondContact O-CG 3.27Å; T86-L90 PolarHBondContact O-N 2.93Å |
| 87 | L | 98.8 | Very high | 98.7 | Very high | 82 Ų | 82 | 103.2 Ų | 103.2 | 43% | 0.429 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.2 | -38 | 172.4 | -73.1 | 173.1 | 0 | 0 | 0 | 111.9 | Q83 E84 Y85 L90 R91 | Q83-L87 WeakPolarHBondContact O-CB 3.41Å; Q83-L87 VanDerWaalsContact O-CG 3.22Å; Q83-L87 WeakPolarHBondContact O-CG 3.34Å; Q83-L87 PolarHBondContact O-N 3.32Å; E84-L87 PolarHBondContact O-N 3.08Å; Y85-L87 PolarHBondContact O-N 3.06Å; L87-L90 PolarHBondContact O-N 3.45Å; L87-R91 VanDerWaalsContact O-CG 3.27Å; L87-R91 WeakPolarHBondContact O-CG 3.46Å; L87-R91 PolarHBondContact O-N 3.06Å |
| 88 | G | 98.8 | Very high | 98.8 | Very high | 20 Ų | 20 | 99.8 Ų | 99.8 | 21% | 0.206 | 50% | 0.497 | C | S | . | . | H | α-helix | trans | -58.8 | -49 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | E84 Y85 T86 R91 K92 | E84-G88 PolarHBondContact O-N 2.94Å; Y85-G88 WeakPolarHBondContact O-CA 3.42Å; Y85-G88 PolarHBondContact O-N 3.5Å; T86-G88 VanDerWaalsContact C-N 3.3Å; T86-G88 PolarHBondContact O-N 2.9Å; G88-R91 PolarHBondContact O-N 2.97Å; G88-K92 WeakPolarHBondContact O-CG 3.34Å; G88-K92 PolarHBondContact O-N 2.97Å; G88-K92 VanDerWaalsContact O-N 3.07Å |
| 89 | E | 98.8 | Very high | 98.8 | Very high | 62 Ų | 62 | 99.5 Ų | 99.5 | 29% | 0.29 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -62.9 | -44.9 | 177.2 | -67.8 | -54 | 118.2 | 0 | 0 | 111.9 | Y85 T86 R91 K92 E93 | Y85-E89 HydrophobicContact CD1-CG 4.44Å; Y85-E89 HydrophobicContact CE1-CG 3.94Å; Y85-E89 HydrophobicContact CE2-CG 4.49Å; Y85-E89 PolarHBondContact O-N 3.43Å; T86-E89 PolarHBondContact O-N 3.41Å; E89-R91 VanDerWaalsContact C-N 3.3Å; E89-R91 PolarHBondContact O-N 3.32Å; E89-K92 WeakPolarHBondContact O-CB 3.3Å; E89-K92 PolarHBondContact O-N 2.97Å; E89-K92 VanDerWaalsContact O-N 3.12Å; E89-K92 IonicContact OE1-NZ 2.6Å; E89-K92 PolarHBondContact OE1-NZ 3.22Å; E89-E93 PolarHBondContact O-N 2.93Å |
| 90 | L | 98.8 | Very high | 98.8 | Very high | 102 Ų | 102 | 97.9 Ų | 97.9 | 53% | 0.534 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.2 | -38.3 | 176.1 | -71.5 | 173.3 | 0 | 0 | 0 | 112.5 | T86 L87 E93 L94 | T86-L90 WeakPolarHBondContact O-CG 3.27Å; T86-L90 PolarHBondContact O-N 2.93Å; L87-L90 PolarHBondContact O-N 3.45Å; L90-E93 PolarHBondContact O-N 2.9Å; L90-L94 VanDerWaalsContact O-CB 3.31Å; L90-L94 WeakPolarHBondContact O-CB 3.38Å; L90-L94 PolarHBondContact O-N 2.85Å |
| 91 | R | 98.9 | Very high | 98.8 | Very high | 171 Ų | 171 | 96.6 Ų | 96.6 | 65% | 0.645 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -65.1 | -42 | 174.8 | -74.7 | 175.2 | -171.9 | 127.9 | -2.5 | 111.8 | L87 G88 E89 L94 G95 | L87-R91 VanDerWaalsContact O-CG 3.27Å; L87-R91 WeakPolarHBondContact O-CG 3.46Å; L87-R91 PolarHBondContact O-N 3.06Å; G88-R91 PolarHBondContact O-N 2.97Å; E89-R91 VanDerWaalsContact C-N 3.3Å; E89-R91 PolarHBondContact O-N 3.32Å; R91-L94 PolarHBondContact O-N 3.39Å; R91-G95 PolarHBondContact O-N 3.47Å |
| 92 | K | 98.8 | Very high | 98.8 | Very high | 133 Ų | 133 | 93.5 Ų | 93.5 | 58% | 0.578 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -62.3 | -46.7 | 175.8 | -68.1 | 171.5 | -171.3 | 168.5 | 0 | 111 | G88 E89 L94 G95 H96 | G88-K92 WeakPolarHBondContact O-CG 3.34Å; G88-K92 PolarHBondContact O-N 2.97Å; G88-K92 VanDerWaalsContact O-N 3.07Å; E89-K92 WeakPolarHBondContact O-CB 3.3Å; E89-K92 PolarHBondContact O-N 2.97Å; E89-K92 VanDerWaalsContact O-N 3.12Å; E89-K92 IonicContact OE1-NZ 2.6Å; E89-K92 PolarHBondContact OE1-NZ 3.22Å; K92-L94 PolarHBondContact O-N 2.9Å; K92-G95 PolarHBondContact O-N 3.31Å; K92-H96 PolarHBondContact O-N 2.84Å |
| 93 | E | 98.8 | Very high | 98.8 | Very high | 94 Ų | 94 | 90.2 Ų | 90.2 | 44% | 0.439 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60 | -45 | 176.2 | -77 | -169 | -156.4 | 0 | 0 | 112.4 | E89 L90 G95 H96 K97 | E89-E93 PolarHBondContact O-N 2.93Å; L90-E93 PolarHBondContact O-N 2.9Å; E93-G95 VanDerWaalsContact C-N 3.29Å; E93-G95 PolarHBondContact O-N 3.24Å; E93-H96 PolarHBondContact O-N 2.91Å; E93-K97 WeakPolarHBondContact O-CB 3.31Å; E93-K97 VanDerWaalsContact O-CG 3.3Å; E93-K97 WeakPolarHBondContact O-CG 3.3Å; E93-K97 PolarHBondContact O-N 3.47Å; E93-K97 IonicContact OE2-NZ 2.79Å; E93-K97 PolarHBondContact OE2-NZ 3.48Å |
| 94 | L | 98.8 | Very high | 98.8 | Very high | 128 Ų | 128 | 90.3 Ų | 90.3 | 67% | 0.67 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -62.5 | -40.3 | 178 | -174.9 | 63.9 | 0 | 0 | 0 | 110.9 | L90 R91 K92 G98 | L90-L94 VanDerWaalsContact O-CB 3.31Å; L90-L94 WeakPolarHBondContact O-CB 3.38Å; L90-L94 PolarHBondContact O-N 2.85Å; R91-L94 PolarHBondContact O-N 3.39Å; K92-L94 PolarHBondContact O-N 2.9Å; L94-G98 PolarHBondContact O-N 3.26Å |
| 95 | G | 98.8 | Very high | 98.8 | Very high | 46 Ų | 46 | 93.1 Ų | 93.1 | 47% | 0.474 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -60.3 | -47.4 | 173 | 0 | 0 | 0 | 0 | 0 | 112.6 | R91 K92 E93 G98 A99 | R91-G95 PolarHBondContact O-N 3.47Å; K92-G95 PolarHBondContact O-N 3.31Å; E93-G95 VanDerWaalsContact C-N 3.29Å; E93-G95 PolarHBondContact O-N 3.24Å; G95-G98 PolarHBondContact O-N 3.46Å; G95-A99 PolarHBondContact O-N 3.26Å |
| 96 | H | 98.8 | Very high | 98.8 | Very high | 137 Ų | 137 | 88.3 Ų | 88.3 | 63% | 0.634 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -62.9 | -47.7 | 177.7 | -179.7 | 70.4 | 0 | 0 | 0 | 112.3 | K92 E93 G98 A99 L100 | K92-H96 PolarHBondContact O-N 2.84Å; E93-H96 PolarHBondContact O-N 2.91Å; H96-G98 VanDerWaalsContact C-N 3.29Å; H96-G98 PolarHBondContact O-N 2.9Å; H96-A99 PolarHBondContact O-N 2.97Å; H96-L100 PolarHBondContact O-N 3.49Å |
| 97 | K | 98.8 | Very high | 98.8 | Very high | 115 Ų | 115 | 88.5 Ų | 88.5 | 50% | 0.5 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.1 | -41.2 | 175.6 | -71.8 | 168.1 | -179.3 | 157.5 | 0 | 110.8 | E93 L100 V101 | E93-K97 WeakPolarHBondContact O-CB 3.31Å; E93-K97 VanDerWaalsContact O-CG 3.3Å; E93-K97 WeakPolarHBondContact O-CG 3.3Å; E93-K97 PolarHBondContact O-N 3.47Å; E93-K97 IonicContact OE2-NZ 2.79Å; E93-K97 PolarHBondContact OE2-NZ 3.48Å; K97-L100 PolarHBondContact O-N 3.47Å; K97-V101 WeakPolarHBondContact O-CB 3.45Å; K97-V101 VanDerWaalsContact O-CG2 3.29Å; K97-V101 WeakPolarHBondContact O-CG2 3.48Å; K97-V101 PolarHBondContact O-N 2.91Å |
| 98 | G | 98.8 | Very high | 98.8 | Very high | 43 Ų | 43 | 90 Ų | 90 | 44% | 0.443 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60 | -45.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | L94 G95 H96 V101 G102 | L94-G98 PolarHBondContact O-N 3.26Å; G95-G98 PolarHBondContact O-N 3.46Å; H96-G98 VanDerWaalsContact C-N 3.29Å; H96-G98 PolarHBondContact O-N 2.9Å; G98-V101 PolarHBondContact O-N 3.49Å; G98-G102 PolarHBondContact O-N 3.21Å |
| 99 | A | 98.8 | Very high | 98.8 | Very high | 67 Ų | 67 | 95.4 Ų | 95.4 | 55% | 0.554 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -62.8 | -44.5 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112 | G95 H96 G102 A103 | G95-A99 PolarHBondContact O-N 3.26Å; H96-A99 PolarHBondContact O-N 2.97Å; A99-G102 PolarHBondContact O-N 2.9Å; A99-A103 PolarHBondContact O-N 3.19Å |
| 100 | L | 98.8 | Very high | 98.8 | Very high | 91 Ų | 91 | 96.6 Ų | 96.6 | 48% | 0.476 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -60.9 | -47 | 176.7 | 178.5 | 61 | 0 | 0 | 0 | 111.7 | H96 K97 G102 A103 L104 | H96-L100 PolarHBondContact O-N 3.49Å; K97-L100 PolarHBondContact O-N 3.47Å; L100-G102 VanDerWaalsContact C-N 3.27Å; L100-G102 PolarHBondContact O-N 3.38Å; L100-A103 PolarHBondContact O-N 2.92Å; L100-L104 HydrophobicContact CD1-CD1 4.36Å; L100-L104 HydrophobicContact CD1-CG 4.31Å; L100-L104 HydrophobicContact CG-CD1 4.21Å; L100-L104 WeakPolarHBondContact O-CG 3.5Å; L100-L104 PolarHBondContact O-N 2.93Å |
| 101 | V | 98.9 | Very high | 98.8 | Very high | 60 Ų | 60 | 97 Ų | 97 | 36% | 0.364 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.4 | -40.2 | 175.6 | 170 | 0 | 0 | 0 | 0 | 110.8 | K97 G98 L104 R105 | K97-V101 WeakPolarHBondContact O-CB 3.45Å; K97-V101 VanDerWaalsContact O-CG2 3.29Å; K97-V101 WeakPolarHBondContact O-CG2 3.48Å; K97-V101 PolarHBondContact O-N 2.91Å; G98-V101 PolarHBondContact O-N 3.49Å; V101-L104 PolarHBondContact O-N 2.95Å; V101-R105 HydrophobicContact CG1-CG 4.42Å; V101-R105 WeakPolarHBondContact O-CB 3.29Å; V101-R105 VanDerWaalsContact O-CG 3.27Å; V101-R105 WeakPolarHBondContact O-CG 3.33Å; V101-R105 PolarHBondContact O-N 2.89Å |
| 102 | G | 98.9 | Very high | 98.8 | Very high | 35 Ų | 35 | 93.9 Ų | 93.9 | 36% | 0.361 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -58.1 | -48.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | G98 A99 L100 R105 A106 | G98-G102 PolarHBondContact O-N 3.21Å; A99-G102 PolarHBondContact O-N 2.9Å; L100-G102 VanDerWaalsContact C-N 3.27Å; L100-G102 PolarHBondContact O-N 3.38Å; G102-R105 PolarHBondContact O-N 3.39Å; G102-A106 WeakPolarHBondContact O-CB 3.48Å; G102-A106 PolarHBondContact O-N 3.37Å |
| 103 | A | 98.9 | Very high | 98.8 | Very high | 59 Ų | 59 | 94.4 Ų | 94.4 | 49% | 0.488 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.5 | -45.1 | 178 | 0 | 0 | 0 | 0 | 0 | 112.3 | A99 L100 R105 A106 N107 | A99-A103 PolarHBondContact O-N 3.19Å; L100-A103 PolarHBondContact O-N 2.92Å; A103-R105 PolarHBondContact O-N 2.95Å; A103-A106 PolarHBondContact O-N 3.41Å; A103-N107 WeakPolarHBondContact O-CB 3.36Å; A103-N107 PolarHBondContact O-N 3.44Å |
| 104 | L | 98.8 | Very high | 98.8 | Very high | 109 Ų | 109 | 94.9 Ų | 94.9 | 57% | 0.571 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -62.7 | -42.6 | 177.3 | -69.9 | 175 | 0 | 0 | 0 | 112 | L100 V101 A106 N107 L108 | L100-L104 HydrophobicContact CD1-CD1 4.36Å; L100-L104 HydrophobicContact CD1-CG 4.31Å; L100-L104 HydrophobicContact CG-CD1 4.21Å; L100-L104 WeakPolarHBondContact O-CG 3.5Å; L100-L104 PolarHBondContact O-N 2.93Å; V101-L104 PolarHBondContact O-N 2.95Å; L104-A106 PolarHBondContact O-N 2.87Å; L104-N107 PolarHBondContact O-N 3.2Å; L104-L108 WeakPolarHBondContact O-CB 3.27Å; L104-L108 PolarHBondContact O-N 3.19Å |
| 105 | R | 98.9 | Very high | 98.8 | Very high | 169 Ų | 169 | 95.4 Ų | 95.4 | 64% | 0.638 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -62.2 | -42 | 175 | -75.3 | 174 | 179.1 | 154.2 | 1.2 | 112 | V101 G102 A103 K109 | V101-R105 HydrophobicContact CG1-CG 4.42Å; V101-R105 WeakPolarHBondContact O-CB 3.29Å; V101-R105 VanDerWaalsContact O-CG 3.27Å; V101-R105 WeakPolarHBondContact O-CG 3.33Å; V101-R105 PolarHBondContact O-N 2.89Å; G102-R105 PolarHBondContact O-N 3.39Å; A103-R105 PolarHBondContact O-N 2.95Å; R105-K109 WeakPolarHBondContact O-CG 3.4Å; R105-K109 PolarHBondContact O-N 3.42Å; R105-K109 VanDerWaalsContact O-N 3.11Å |
| 106 | A | 98.8 | Very high | 98.8 | Very high | 56 Ų | 56 | 97.3 Ų | 97.3 | 46% | 0.463 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.3 | -43 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | G102 A103 L104 K109 E110 | G102-A106 WeakPolarHBondContact O-CB 3.48Å; G102-A106 PolarHBondContact O-N 3.37Å; A103-A106 PolarHBondContact O-N 3.41Å; L104-A106 PolarHBondContact O-N 2.87Å; A106-K109 PolarHBondContact O-N 3.34Å; A106-E110 PolarHBondContact O-N 3.24Å |
| 107 | N | 98.8 | Very high | 98.8 | Very high | 79 Ų | 79 | 96.2 Ų | 96.2 | 42% | 0.422 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.6 | -44.8 | 177.2 | -168 | -91.8 | 0 | 0 | 0 | 111.9 | A103 L104 K109 E110 K111 | A103-N107 WeakPolarHBondContact O-CB 3.36Å; A103-N107 PolarHBondContact O-N 3.44Å; L104-N107 PolarHBondContact O-N 3.2Å; N107-K109 VanDerWaalsContact C-N 3.34Å; N107-K109 PolarHBondContact O-N 3.11Å; N107-E110 WeakPolarHBondContact O-CB 3.5Å; N107-E110 PolarHBondContact O-N 2.85Å; N107-E110 VanDerWaalsContact O-N 3.1Å; N107-K111 WeakPolarHBondContact O-CG 3.38Å; N107-K111 PolarHBondContact O-N 2.94Å |
| 108 | L | 98.8 | Very high | 98.8 | Very high | 114 Ų | 114 | 93.4 Ų | 93.4 | 60% | 0.597 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -59.4 | -46.1 | 176.8 | -169.1 | 157.1 | 0 | 0 | 0 | 111.2 | L104 E110 K111 E112 | L104-L108 WeakPolarHBondContact O-CB 3.27Å; L104-L108 PolarHBondContact O-N 3.19Å; L108-E110 VanDerWaalsContact C-N 3.27Å; L108-E110 PolarHBondContact O-N 2.98Å; L108-K111 PolarHBondContact O-N 3.36Å; L108-E112 WeakPolarHBondContact O-CB 3.48Å; L108-E112 PolarHBondContact O-N 2.92Å |
| 109 | K | 98.8 | Very high | 98.8 | Very high | 134 Ų | 134 | 96.8 Ų | 96.8 | 58% | 0.583 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -61.9 | -33.8 | 175.2 | -73.3 | -179.3 | 178.3 | -174.3 | 0 | 113 | R105 A106 N107 R113 | R105-K109 WeakPolarHBondContact O-CG 3.4Å; R105-K109 PolarHBondContact O-N 3.42Å; R105-K109 VanDerWaalsContact O-N 3.11Å; A106-K109 PolarHBondContact O-N 3.34Å; N107-K109 VanDerWaalsContact C-N 3.34Å; N107-K109 PolarHBondContact O-N 3.11Å; K109-R113 WeakPolarHBondContact O-CG 3.38Å; K109-R113 PolarHBondContact O-N 2.79Å; K109-R113 PolarHBondContact O-NE 2.93Å |
| 110 | E | 98.8 | Very high | 98.8 | Very high | 86 Ų | 86 | 100.8 Ų | 100.8 | 40% | 0.402 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -69.8 | -45.7 | 174.5 | -179.7 | 169.1 | -135.1 | 0 | 0 | 111.6 | A106 N107 L108 E112 R113 H114 | A106-E110 PolarHBondContact O-N 3.24Å; N107-E110 WeakPolarHBondContact O-CB 3.5Å; N107-E110 PolarHBondContact O-N 2.85Å; N107-E110 VanDerWaalsContact O-N 3.1Å; L108-E110 VanDerWaalsContact C-N 3.27Å; L108-E110 PolarHBondContact O-N 2.98Å; E110-E112 VanDerWaalsContact C-N 3.33Å; E110-E112 PolarHBondContact O-N 3.46Å; E110-R113 WeakPolarHBondContact O-CB 3.26Å; E110-R113 PolarHBondContact O-N 2.99Å; E110-H114 VanDerWaalsContact CG-CE1 3.5Å; E110-H114 WeakPolarHBondContact CG-CE1 3.46Å; E110-H114 PolarHBondContact O-N 3.1Å; E110-H114 PolarHBondContact O-ND1 3.47Å; E110-H114 IonicContact OE1-CE1 3.92Å |
| 111 | K | 98.7 | Very high | 98.8 | Very high | 110 Ų | 110 | 103.7 Ų | 103.7 | 48% | 0.478 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.5 | -43.1 | 175.5 | -66.2 | -65.5 | -179.4 | -177.7 | 0 | 111.6 | N107 L108 R113 H114 F115 | N107-K111 WeakPolarHBondContact O-CG 3.38Å; N107-K111 PolarHBondContact O-N 2.94Å; L108-K111 PolarHBondContact O-N 3.36Å; K111-R113 PolarHBondContact O-N 3.38Å; K111-H114 PolarHBondContact O-N 3.25Å; K111-F115 HydrophobicContact CB-CD2 4.36Å; K111-F115 HydrophobicContact CB-CE2 4.06Å; K111-F115 WeakPolarHBondContact O-CD2 3.36Å; K111-F115 WeakPolarHBondContact O-CG 3.43Å; K111-F115 PolarHBondContact O-N 3Å |
| 112 | E | 98.7 | Very high | 98.8 | Very high | 107 Ų | 107 | 107 Ų | 107 | 50% | 0.5 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -56.3 | -48.1 | 174.2 | -177 | -178.5 | -175.5 | 0 | 0 | 111.8 | L108 E110 H114 F115 L116 | L108-E112 WeakPolarHBondContact O-CB 3.48Å; L108-E112 PolarHBondContact O-N 2.92Å; E110-E112 VanDerWaalsContact C-N 3.33Å; E110-E112 PolarHBondContact O-N 3.46Å; E112-H114 PolarHBondContact O-N 3.33Å; E112-F115 PolarHBondContact O-N 3.11Å; E112-L116 HydrophobicContact CG-CD1 4.31Å; E112-L116 WeakPolarHBondContact O-CG 3.4Å; E112-L116 PolarHBondContact O-N 3.44Å |
| 113 | R | 98.8 | Very high | 98.8 | Very high | 143 Ų | 143 | 108.7 Ų | 108.7 | 54% | 0.54 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -57.7 | -48 | 175.5 | -76.1 | -179.2 | -75 | 154.8 | -2.3 | 111.8 | K109 E110 K111 F115 L116 E117 | K109-R113 WeakPolarHBondContact O-CG 3.38Å; K109-R113 PolarHBondContact O-N 2.79Å; K109-R113 PolarHBondContact O-NE 2.93Å; E110-R113 WeakPolarHBondContact O-CB 3.26Å; E110-R113 PolarHBondContact O-N 2.99Å; K111-R113 PolarHBondContact O-N 3.38Å; R113-F115 PolarHBondContact O-N 3.43Å; R113-L116 PolarHBondContact O-N 3.45Å; R113-E117 WeakPolarHBondContact O-CG 3Å; R113-E117 PolarHBondContact O-N 2.88Å |
| 114 | H | 98.8 | Very high | 98.8 | Very high | 105 Ų | 105 | 112 Ų | 112 | 49% | 0.486 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.1 | -42.5 | 177.9 | -76.2 | 76.6 | 0 | 0 | 0 | 112.4 | E110 K111 E112 L116 E117 E118 | E110-H114 VanDerWaalsContact CG-CE1 3.5Å; E110-H114 WeakPolarHBondContact CG-CE1 3.46Å; E110-H114 PolarHBondContact O-N 3.1Å; E110-H114 PolarHBondContact O-ND1 3.47Å; E110-H114 IonicContact OE1-CE1 3.92Å; K111-H114 PolarHBondContact O-N 3.25Å; E112-H114 PolarHBondContact O-N 3.33Å; H114-L116 VanDerWaalsContact C-N 3.34Å; H114-L116 PolarHBondContact O-N 3.23Å; H114-E117 PolarHBondContact O-N 3.47Å; H114-E118 WeakPolarHBondContact O-CB 3.37Å; H114-E118 PolarHBondContact O-N 2.86Å |
| 115 | F | 98.8 | Very high | 98.8 | Very high | 138 Ų | 138 | 110 Ų | 110 | 61% | 0.605 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -63.9 | -39.4 | 177.5 | -73.2 | -55.9 | 0 | 0 | 0 | 112.2 | K111 E112 R113 E118 L119 | K111-F115 HydrophobicContact CB-CD2 4.36Å; K111-F115 HydrophobicContact CB-CE2 4.06Å; K111-F115 WeakPolarHBondContact O-CD2 3.36Å; K111-F115 WeakPolarHBondContact O-CG 3.43Å; K111-F115 PolarHBondContact O-N 3Å; E112-F115 PolarHBondContact O-N 3.11Å; R113-F115 PolarHBondContact O-N 3.43Å; F115-E118 PolarHBondContact O-N 3.22Å; F115-L119 VanDerWaalsContact O-CB 3.25Å; F115-L119 WeakPolarHBondContact O-CB 3.37Å; F115-L119 PolarHBondContact O-N 2.92Å |
| 116 | L | 98.8 | Very high | 98.8 | Very high | 86 Ų | 86 | 104.9 Ų | 104.9 | 45% | 0.45 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -67.5 | -40.5 | 176.9 | -70.9 | 173.3 | 0 | 0 | 0 | 112.2 | E112 R113 H114 L119 K120 | E112-L116 HydrophobicContact CG-CD1 4.31Å; E112-L116 WeakPolarHBondContact O-CG 3.4Å; E112-L116 PolarHBondContact O-N 3.44Å; R113-L116 PolarHBondContact O-N 3.45Å; H114-L116 VanDerWaalsContact C-N 3.34Å; H114-L116 PolarHBondContact O-N 3.23Å; L116-L119 PolarHBondContact O-N 3.27Å; L116-K120 WeakPolarHBondContact O-CB 3.43Å; L116-K120 VanDerWaalsContact O-CG 3.26Å; L116-K120 WeakPolarHBondContact O-CG 3.31Å; L116-K120 PolarHBondContact O-N 3.45Å |
| 117 | E | 98.8 | Very high | 98.8 | Very high | 115 Ų | 115 | 106 Ų | 106 | 54% | 0.537 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63 | -45.5 | 175 | -73.2 | 168.9 | -166.4 | 0 | 0 | 111.4 | R113 H114 L119 K120 R121 | R113-E117 WeakPolarHBondContact O-CG 3Å; R113-E117 PolarHBondContact O-N 2.88Å; H114-E117 PolarHBondContact O-N 3.47Å; E117-L119 VanDerWaalsContact C-N 3.34Å; E117-L119 PolarHBondContact O-N 2.94Å; E117-K120 PolarHBondContact O-N 3.04Å; E117-R121 WeakPolarHBondContact O-CB 3.34Å; E117-R121 PolarHBondContact O-N 3.48Å |
| 118 | E | 98.8 | Very high | 98.8 | Very high | 56 Ų | 56 | 105.6 Ų | 105.6 | 26% | 0.262 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.2 | -40.2 | 177.2 | -178.3 | 62.8 | -171.5 | 0 | 0 | 111.6 | H114 F115 R121 R122 | H114-E118 WeakPolarHBondContact O-CB 3.37Å; H114-E118 PolarHBondContact O-N 2.86Å; F115-E118 PolarHBondContact O-N 3.22Å; E118-R121 PolarHBondContact O-N 3Å; E118-R121 IonicContact OE1-CZ 2.87Å; E118-R121 IonicContact OE1-NE 3Å; E118-R121 IonicContact OE1-NH2 3.33Å; E118-R121 PolarHBondContact OE1-NH2 3.05Å; E118-R121 IonicContact OE2-CZ 2.69Å; E118-R121 IonicContact OE2-NE 3.7Å; E118-R121 PolarHBondContact OE2-NE 2.79Å; E118-R121 IonicContact OE2-NH2 3.95Å; E118-R121 PolarHBondContact OE2-NH2 3.2Å; E118-R122 WeakPolarHBondContact O-CB 3.43Å; E118-R122 VanDerWaalsContact O-CG 3.3Å; E118-R122 WeakPolarHBondContact O-CG 3.13Å; E118-R122 PolarHBondContact O-N 3.46Å; E118-R122 IonicContact OE1-CZ 3.16Å; E118-R122 VanDerWaalsContact OE1-CZ 3.31Å; E118-R122 IonicContact OE1-NE 2.82Å; E118-R122 PolarHBondContact OE1-NE 2.94Å; E118-R122 IonicContact OE1-NH2 2.78Å; E118-R122 PolarHBondContact OE1-NH2 2.87Å |
| 119 | L | 98.8 | Very high | 98.8 | Very high | 114 Ų | 114 | 105.5 Ų | 105.5 | 60% | 0.597 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -62.1 | -46.1 | 174.6 | -176.8 | 64.2 | 0 | 0 | 0 | 111.4 | F115 L116 E117 R121 R122 S123 | F115-L119 VanDerWaalsContact O-CB 3.25Å; F115-L119 WeakPolarHBondContact O-CB 3.37Å; F115-L119 PolarHBondContact O-N 2.92Å; L116-L119 PolarHBondContact O-N 3.27Å; E117-L119 VanDerWaalsContact C-N 3.34Å; E117-L119 PolarHBondContact O-N 2.94Å; L119-R121 PolarHBondContact O-N 3.12Å; L119-R122 PolarHBondContact O-N 3.18Å; L119-S123 VanDerWaalsContact O-CB 3.31Å; L119-S123 WeakPolarHBondContact O-CB 3.49Å; L119-S123 PolarHBondContact O-N 3.46Å |
| 120 | K | 98.8 | Very high | 98.8 | Very high | 150 Ų | 150 | 103.7 Ų | 103.7 | 65% | 0.652 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -59.3 | -46.6 | 175.4 | -74.8 | 171.4 | -177.1 | 177.3 | 0 | 111.3 | L116 E117 R122 S123 H124 | L116-K120 WeakPolarHBondContact O-CB 3.43Å; L116-K120 VanDerWaalsContact O-CG 3.26Å; L116-K120 WeakPolarHBondContact O-CG 3.31Å; L116-K120 PolarHBondContact O-N 3.45Å; E117-K120 PolarHBondContact O-N 3.04Å; K120-R122 PolarHBondContact O-N 3.32Å; K120-S123 PolarHBondContact O-N 3.37Å; K120-H124 WeakPolarHBondContact O-CB 3.3Å; K120-H124 PolarHBondContact O-N 2.88Å |
| 121 | R | 98.8 | Very high | 98.8 | Very high | 152 Ų | 152 | 102.8 Ų | 102.8 | 57% | 0.574 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -60.3 | -46.3 | 178.9 | -171.4 | -175.1 | 71.6 | 90.8 | -1.2 | 111.8 | E117 E118 L119 H124 C125 | E117-R121 WeakPolarHBondContact O-CB 3.34Å; E117-R121 PolarHBondContact O-N 3.48Å; E118-R121 PolarHBondContact O-N 3Å; E118-R121 IonicContact OE1-CZ 2.87Å; E118-R121 IonicContact OE1-NE 3Å; E118-R121 IonicContact OE1-NH2 3.33Å; E118-R121 PolarHBondContact OE1-NH2 3.05Å; E118-R121 IonicContact OE2-CZ 2.69Å; E118-R121 IonicContact OE2-NE 3.7Å; E118-R121 PolarHBondContact OE2-NE 2.79Å; E118-R121 IonicContact OE2-NH2 3.95Å; E118-R121 PolarHBondContact OE2-NH2 3.2Å; L119-R121 PolarHBondContact O-N 3.12Å; R121-H124 PolarHBondContact O-N 3.4Å; R121-C125 WeakPolarHBondContact O-CB 3.25Å; R121-C125 PolarHBondContact O-N 2.65Å |
| 122 | R | 98.8 | Very high | 98.8 | Very high | 129 Ų | 129 | 101.4 Ų | 101.4 | 49% | 0.487 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -66.6 | -41.7 | 178 | -72.1 | 179.4 | -173 | -160.4 | 4.3 | 112.3 | E118 L119 K120 C125 S126 C214 | E118-R122 WeakPolarHBondContact O-CB 3.43Å; E118-R122 VanDerWaalsContact O-CG 3.3Å; E118-R122 WeakPolarHBondContact O-CG 3.13Å; E118-R122 PolarHBondContact O-N 3.46Å; E118-R122 IonicContact OE1-CZ 3.16Å; E118-R122 VanDerWaalsContact OE1-CZ 3.31Å; E118-R122 IonicContact OE1-NE 2.82Å; E118-R122 PolarHBondContact OE1-NE 2.94Å; E118-R122 IonicContact OE1-NH2 2.78Å; E118-R122 PolarHBondContact OE1-NH2 2.87Å; L119-R122 PolarHBondContact O-N 3.18Å; K120-R122 PolarHBondContact O-N 3.32Å; R122-C125 PolarHBondContact O-N 3Å; R122-S126 WeakPolarHBondContact O-CB 3.17Å; R122-S126 PolarHBondContact O-N 2.92Å; R122-C214 PolarHBondContact NH1-O 3.36Å |
| 123 | S | 98.7 | Very high | 98.8 | Very high | 71 Ų | 71 | 101 Ų | 101 | 50% | 0.497 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -58.6 | -48.8 | 175.3 | 175.8 | 0 | 0 | 0 | 0 | 110.8 | L119 K120 C125 S126 T127 | L119-S123 VanDerWaalsContact O-CB 3.31Å; L119-S123 WeakPolarHBondContact O-CB 3.49Å; L119-S123 PolarHBondContact O-N 3.46Å; K120-S123 PolarHBondContact O-N 3.37Å; S123-C125 PolarHBondContact O-N 3.49Å; S123-S126 WeakPolarHBondContact O-CB 3.48Å; S123-S126 PolarHBondContact O-N 3.28Å; S123-T127 PolarHBondContact O-N 3.37Å; S123-T127 PolarHBondContact O-OG1 3.18Å |
| 124 | H | 98.8 | Very high | 98.8 | Very high | 130 Ų | 130 | 99 Ų | 99 | 60% | 0.602 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -59.3 | -45.8 | 176.6 | -178.3 | 63.2 | 0 | 0 | 0 | 112.2 | K120 R121 S126 T127 V128 | K120-H124 WeakPolarHBondContact O-CB 3.3Å; K120-H124 PolarHBondContact O-N 2.88Å; R121-H124 PolarHBondContact O-N 3.4Å; H124-S126 VanDerWaalsContact C-N 3.33Å; H124-S126 PolarHBondContact O-N 3.5Å; H124-T127 WeakPolarHBondContact O-CB 3.42Å; H124-T127 PolarHBondContact O-N 2.87Å; H124-V128 WeakPolarHBondContact O-CG2 3.45Å; H124-V128 PolarHBondContact O-N 3.15Å |
| 125 | C | 98.7 | Very high | 98.8 | Very high | 66 Ų | 66 | 99.4 Ų | 99.4 | 45% | 0.446 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -58.9 | -43.7 | 175.9 | -173.9 | 0 | 0 | 0 | 0 | 112 | R121 R122 S123 T127 V128 L129 | R121-C125 WeakPolarHBondContact O-CB 3.25Å; R121-C125 PolarHBondContact O-N 2.65Å; R122-C125 PolarHBondContact O-N 3Å; S123-C125 PolarHBondContact O-N 3.49Å; C125-T127 VanDerWaalsContact C-N 3.34Å; C125-T127 PolarHBondContact O-N 3Å; C125-V128 PolarHBondContact O-N 3.14Å; C125-L129 WeakPolarHBondContact O-CG 3.45Å; C125-L129 PolarHBondContact O-N 3.33Å |
| 126 | S | 98.8 | Very high | 98.7 | Very high | 62 Ų | 62 | 98.4 Ų | 98.4 | 43% | 0.434 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.2 | -39.9 | 176 | -176.4 | 0 | 0 | 0 | 0 | 112.2 | R122 S123 H124 N130 | R122-S126 WeakPolarHBondContact O-CB 3.17Å; R122-S126 PolarHBondContact O-N 2.92Å; S123-S126 WeakPolarHBondContact O-CB 3.48Å; S123-S126 PolarHBondContact O-N 3.28Å; H124-S126 VanDerWaalsContact C-N 3.33Å; H124-S126 PolarHBondContact O-N 3.5Å; S126-N130 WeakPolarHBondContact O-CB 3.41Å; S126-N130 PolarHBondContact O-N 2.88Å; S126-N130 PolarHBondContact O-ND2 3.28Å |
| 127 | T | 98.8 | Very high | 98.7 | Very high | 79 Ų | 79 | 97.8 Ų | 97.8 | 49% | 0.485 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -61.9 | -48.4 | 174.1 | -57.1 | 0 | 0 | 0 | 0 | 111.1 | S123 H124 C125 L129 N130 T131 | S123-T127 PolarHBondContact O-N 3.37Å; S123-T127 PolarHBondContact O-OG1 3.18Å; H124-T127 WeakPolarHBondContact O-CB 3.42Å; H124-T127 PolarHBondContact O-N 2.87Å; C125-T127 VanDerWaalsContact C-N 3.34Å; C125-T127 PolarHBondContact O-N 3Å; T127-L129 PolarHBondContact O-N 2.7Å; T127-N130 PolarHBondContact O-N 2.82Å; T127-T131 WeakPolarHBondContact O-CG2 3.37Å; T127-T131 PolarHBondContact O-N 2.94Å; T127-T131 PolarHBondContact O-OG1 3.44Å |
| 128 | V | 98.8 | Very high | 98.7 | Very high | 71 Ų | 71 | 97.5 Ų | 97.5 | 43% | 0.43 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -58.3 | -49.1 | 178.7 | 173 | 0 | 0 | 0 | 0 | 110.9 | H124 C125 N130 T131 E132 | H124-V128 WeakPolarHBondContact O-CG2 3.45Å; H124-V128 PolarHBondContact O-N 3.15Å; C125-V128 PolarHBondContact O-N 3.14Å; V128-N130 PolarHBondContact O-N 3.16Å; V128-T131 PolarHBondContact O-N 2.96Å; V128-T131 PolarHBondContact O-OG1 3.15Å; V128-E132 PolarHBondContact O-N 3.18Å |
| 129 | L | 98.8 | Very high | 98.7 | Very high | 112 Ų | 112 | 97.3 Ų | 97.3 | 59% | 0.586 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -63.1 | -39.5 | 178.5 | -69.1 | 175.1 | 0 | 0 | 0 | 112.8 | C125 T127 E132 L133 | C125-L129 WeakPolarHBondContact O-CG 3.45Å; C125-L129 PolarHBondContact O-N 3.33Å; T127-L129 PolarHBondContact O-N 2.7Å; L129-E132 PolarHBondContact O-N 2.93Å; L129-L133 WeakPolarHBondContact O-CB 3.45Å; L129-L133 PolarHBondContact O-N 3.18Å |
| 130 | N | 98.8 | Very high | 98.7 | Very high | 95 Ų | 95 | 94.4 Ų | 94.4 | 51% | 0.508 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.2 | -42.4 | 174.7 | -89.8 | -63.8 | 0 | 0 | 0 | 111.9 | S126 T127 V128 E132 L133 Q134 | S126-N130 WeakPolarHBondContact O-CB 3.41Å; S126-N130 PolarHBondContact O-N 2.88Å; S126-N130 PolarHBondContact O-ND2 3.28Å; T127-N130 PolarHBondContact O-N 2.82Å; V128-N130 PolarHBondContact O-N 3.16Å; N130-E132 VanDerWaalsContact C-N 3.28Å; N130-E132 PolarHBondContact O-N 3.46Å; N130-L133 PolarHBondContact O-N 2.71Å; N130-Q134 WeakPolarHBondContact O-CB 3.32Å; N130-Q134 PolarHBondContact O-N 3.48Å |
| 131 | T | 98.7 | Very high | 98.7 | Very high | 68 Ų | 68 | 90 Ų | 90 | 42% | 0.417 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64.1 | -36.5 | 176.3 | 62 | 0 | 0 | 0 | 0 | 111.7 | T127 V128 Q134 K135 | T127-T131 WeakPolarHBondContact O-CG2 3.37Å; T127-T131 PolarHBondContact O-N 2.94Å; T127-T131 PolarHBondContact O-OG1 3.44Å; V128-T131 PolarHBondContact O-N 2.96Å; V128-T131 PolarHBondContact O-OG1 3.15Å; T131-Q134 PolarHBondContact O-N 2.93Å; T131-K135 VanDerWaalsContact O-CG 3.32Å; T131-K135 WeakPolarHBondContact O-CG 3.39Å; T131-K135 PolarHBondContact O-N 3.26Å |
| 132 | E | 98.7 | Very high | 98.7 | Very high | 81 Ų | 81 | 89.6 Ų | 89.6 | 38% | 0.379 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -70.1 | -42.6 | 177.2 | -167.3 | 55 | -147.1 | 0 | 0 | 111.9 | V128 L129 N130 Q134 K135 Q136 | V128-E132 PolarHBondContact O-N 3.18Å; L129-E132 PolarHBondContact O-N 2.93Å; N130-E132 VanDerWaalsContact C-N 3.28Å; N130-E132 PolarHBondContact O-N 3.46Å; E132-Q134 VanDerWaalsContact C-N 3.3Å; E132-Q134 PolarHBondContact O-N 2.88Å; E132-K135 PolarHBondContact O-N 2.88Å; E132-K135 IonicContact OE2-NZ 2.7Å; E132-K135 PolarHBondContact OE2-NZ 2.78Å; E132-K135 VanDerWaalsContact OE2-NZ 3.16Å; E132-Q136 WeakPolarHBondContact O-CG 3.34Å; E132-Q136 PolarHBondContact O-N 3.41Å |
| 133 | L | 98.8 | Very high | 98.7 | Very high | 97 Ų | 97 | 88 Ų | 88 | 51% | 0.508 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -60.1 | -41.2 | 173.1 | -179.6 | 64 | 0 | 0 | 0 | 111.9 | L129 N130 Q136 T137 | L129-L133 WeakPolarHBondContact O-CB 3.45Å; L129-L133 PolarHBondContact O-N 3.18Å; N130-L133 PolarHBondContact O-N 2.71Å; L133-Q136 PolarHBondContact O-N 3.42Å; L133-T137 WeakPolarHBondContact O-CB 3.37Å; L133-T137 PolarHBondContact O-N 2.74Å; L133-T137 PolarHBondContact O-OG1 3.25Å |
| 134 | Q | 98.7 | Very high | 98.7 | Very high | 101 Ų | 101 | 87.4 Ų | 87.4 | 47% | 0.472 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -62.7 | -46.1 | 177.2 | -178.2 | 61.6 | 24.2 | 0 | 0 | 111.3 | N130 T131 E132 Q136 T137 E138 | N130-Q134 WeakPolarHBondContact O-CB 3.32Å; N130-Q134 PolarHBondContact O-N 3.48Å; T131-Q134 PolarHBondContact O-N 2.93Å; E132-Q134 VanDerWaalsContact C-N 3.3Å; E132-Q134 PolarHBondContact O-N 2.88Å; Q134-Q136 VanDerWaalsContact C-N 3.32Å; Q134-Q136 PolarHBondContact O-N 2.95Å; Q134-T137 WeakPolarHBondContact O-CB 3.46Å; Q134-T137 PolarHBondContact O-N 2.96Å; Q134-T137 VanDerWaalsContact O-N 3.13Å; Q134-E138 WeakPolarHBondContact CG-OE1 3.42Å; Q134-E138 PolarHBondContact NE2-OE1 3.48Å; Q134-E138 WeakPolarHBondContact O-CG 3.44Å; Q134-E138 PolarHBondContact O-N 2.84Å |
| 135 | K | 98.8 | Very high | 98.7 | Very high | 115 Ų | 115 | 88.2 Ų | 88.2 | 50% | 0.5 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -58 | -43.8 | 174.4 | -69.6 | 170.9 | -164.3 | 165.7 | 0 | 112 | T131 E132 T137 E138 A139 | T131-K135 VanDerWaalsContact O-CG 3.32Å; T131-K135 WeakPolarHBondContact O-CG 3.39Å; T131-K135 PolarHBondContact O-N 3.26Å; E132-K135 PolarHBondContact O-N 2.88Å; E132-K135 IonicContact OE2-NZ 2.7Å; E132-K135 PolarHBondContact OE2-NZ 2.78Å; E132-K135 VanDerWaalsContact OE2-NZ 3.16Å; K135-T137 VanDerWaalsContact C-N 3.32Å; K135-T137 PolarHBondContact O-N 3.32Å; K135-E138 PolarHBondContact O-N 3.19Å; K135-A139 WeakPolarHBondContact O-CB 3.38Å; K135-A139 PolarHBondContact O-N 2.9Å |
| 136 | Q | 98.7 | Very high | 98.7 | Very high | 116 Ų | 116 | 89.1 Ų | 89.1 | 54% | 0.542 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -64 | -39.2 | 176.8 | -70.2 | -179.8 | 10.8 | 0 | 0 | 111.7 | E132 L133 Q134 A139 A140 | E132-Q136 WeakPolarHBondContact O-CG 3.34Å; E132-Q136 PolarHBondContact O-N 3.41Å; L133-Q136 PolarHBondContact O-N 3.42Å; Q134-Q136 VanDerWaalsContact C-N 3.32Å; Q134-Q136 PolarHBondContact O-N 2.95Å; Q136-A139 PolarHBondContact O-N 3.08Å; Q136-A140 WeakPolarHBondContact O-CB 3.45Å; Q136-A140 PolarHBondContact O-N 3.29Å |
| 137 | T | 98.7 | Very high | 98.6 | Very high | 74 Ų | 74 | 91.2 Ų | 91.2 | 45% | 0.454 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -65.2 | -43.5 | 177 | -56 | 0 | 0 | 0 | 0 | 111.4 | L133 Q134 K135 A140 A141 | L133-T137 WeakPolarHBondContact O-CB 3.37Å; L133-T137 PolarHBondContact O-N 2.74Å; L133-T137 PolarHBondContact O-OG1 3.25Å; Q134-T137 WeakPolarHBondContact O-CB 3.46Å; Q134-T137 PolarHBondContact O-N 2.96Å; Q134-T137 VanDerWaalsContact O-N 3.13Å; K135-T137 VanDerWaalsContact C-N 3.32Å; K135-T137 PolarHBondContact O-N 3.32Å; T137-A140 PolarHBondContact O-N 2.98Å; T137-A141 WeakPolarHBondContact O-CB 3.44Å; T137-A141 PolarHBondContact O-N 3.05Å |
| 138 | E | 98.6 | Very high | 98.6 | Very high | 109 Ų | 109 | 92.8 Ų | 92.8 | 51% | 0.509 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.9 | -44.4 | 175.4 | -73.5 | 170 | -168.2 | 0 | 0 | 111.9 | Q134 K135 A140 A141 Y142 | Q134-E138 WeakPolarHBondContact CG-OE1 3.42Å; Q134-E138 PolarHBondContact NE2-OE1 3.48Å; Q134-E138 WeakPolarHBondContact O-CG 3.44Å; Q134-E138 PolarHBondContact O-N 2.84Å; K135-E138 PolarHBondContact O-N 3.19Å; E138-A140 PolarHBondContact O-N 3.43Å; E138-A141 PolarHBondContact O-N 3.45Å; E138-Y142 WeakPolarHBondContact O-CB 3.38Å; E138-Y142 PolarHBondContact O-N 3.23Å |
| 139 | A | 98.7 | Very high | 98.6 | Very high | 52 Ų | 52 | 90.7 Ų | 90.7 | 43% | 0.43 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -61.6 | -43.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | K135 Q136 Y142 L143 | K135-A139 WeakPolarHBondContact O-CB 3.38Å; K135-A139 PolarHBondContact O-N 2.9Å; Q136-A139 PolarHBondContact O-N 3.08Å; A139-Y142 PolarHBondContact O-N 2.89Å; A139-L143 WeakPolarHBondContact O-CG 3.42Å; A139-L143 PolarHBondContact O-N 3.39Å |
| 140 | A | 98.7 | Very high | 98.5 | Very high | 53 Ų | 53 | 88 Ų | 88 | 44% | 0.438 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -63.7 | -40.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q136 T137 E138 S144 | Q136-A140 WeakPolarHBondContact O-CB 3.45Å; Q136-A140 PolarHBondContact O-N 3.29Å; T137-A140 PolarHBondContact O-N 2.98Å; E138-A140 PolarHBondContact O-N 3.43Å; A140-S144 WeakPolarHBondContact O-CB 3.48Å; A140-S144 PolarHBondContact O-N 3.44Å; A140-S144 PolarHBondContact O-OG 3.28Å |
| 141 | A | 98.7 | Very high | 98.4 | Very high | 58 Ų | 58 | 90 Ų | 90 | 48% | 0.479 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -64 | -42.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | T137 E138 S144 F145 | T137-A141 WeakPolarHBondContact O-CB 3.44Å; T137-A141 PolarHBondContact O-N 3.05Å; E138-A141 PolarHBondContact O-N 3.45Å; A141-S144 WeakPolarHBondContact O-CB 3.43Å; A141-S144 PolarHBondContact O-N 2.93Å; A141-F145 PolarHBondContact O-N 2.93Å |
| 142 | Y | 98.8 | Very high | 98.3 | Very high | 142 Ų | 142 | 92.5 Ų | 92.5 | 56% | 0.557 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -61.2 | -47.8 | 176.6 | 178.4 | -109.7 | 0 | 0 | 0 | 112.3 | E138 A139 S144 F145 Q146 | E138-Y142 WeakPolarHBondContact O-CB 3.38Å; E138-Y142 PolarHBondContact O-N 3.23Å; A139-Y142 PolarHBondContact O-N 2.89Å; Y142-S144 VanDerWaalsContact C-N 3.32Å; Y142-S144 PolarHBondContact O-N 2.98Å; Y142-F145 WeakPolarHBondContact O-CB 3.44Å; Y142-F145 PolarHBondContact O-N 2.89Å; Y142-Q146 HydrophobicContact CE1-CG 4.34Å; Y142-Q146 WeakPolarHBondContact O-CG 3.47Å; Y142-Q146 PolarHBondContact O-N 3.4Å; Y142-Q146 PolarHBondContact OH-NE2 2.88Å |
| 143 | L | 98.6 | Very high | 98.2 | Very high | 97 Ų | 97 | 96.3 Ų | 96.3 | 51% | 0.508 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.5 | -38.7 | 175.8 | -68.5 | 173.4 | 0 | 0 | 0 | 111.9 | A139 Q146 L147 | A139-L143 WeakPolarHBondContact O-CG 3.42Å; A139-L143 PolarHBondContact O-N 3.39Å; L143-Q146 PolarHBondContact O-N 2.87Å; L143-L147 WeakPolarHBondContact O-CB 3.42Å; L143-L147 WeakPolarHBondContact O-CG 3.35Å; L143-L147 PolarHBondContact O-N 3.3Å |
| 144 | S | 98.4 | Very high | 98.1 | Very high | 58 Ų | 58 | 95.6 Ų | 95.6 | 41% | 0.406 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62 | -44.5 | 174.5 | -60.7 | 0 | 0 | 0 | 0 | 111.3 | A140 A141 Y142 L147 H148 | A140-S144 WeakPolarHBondContact O-CB 3.48Å; A140-S144 PolarHBondContact O-N 3.44Å; A140-S144 PolarHBondContact O-OG 3.28Å; A141-S144 WeakPolarHBondContact O-CB 3.43Å; A141-S144 PolarHBondContact O-N 2.93Å; Y142-S144 VanDerWaalsContact C-N 3.32Å; Y142-S144 PolarHBondContact O-N 2.98Å; S144-L147 PolarHBondContact O-N 3.39Å; S144-H148 PolarHBondContact O-CD2 3Å; S144-H148 PolarHBondContact O-N 2.87Å |
| 145 | F | 98.5 | Very high | 97.9 | Very high | 147 Ų | 147 | 96.3 Ų | 96.3 | 65% | 0.645 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -59.9 | -46 | 174.3 | 175.9 | -99.7 | 0 | 0 | 0 | 111.6 | A141 Y142 L147 H148 A149 | A141-F145 PolarHBondContact O-N 2.93Å; Y142-F145 WeakPolarHBondContact O-CB 3.44Å; Y142-F145 PolarHBondContact O-N 2.89Å; F145-L147 PolarHBondContact O-N 3.42Å; F145-H148 PolarHBondContact O-N 2.94Å; F145-A149 WeakPolarHBondContact O-CB 3.34Å; F145-A149 PolarHBondContact O-N 3.45Å |
| 146 | Q | 98.4 | Very high | 97.7 | Very high | 84 Ų | 84 | 96.2 Ų | 96.2 | 39% | 0.393 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -59.4 | -44.6 | 175.4 | -72.3 | -170.8 | -5.2 | 0 | 0 | 112.3 | Y142 L143 A149 A150 | Y142-Q146 HydrophobicContact CE1-CG 4.34Å; Y142-Q146 WeakPolarHBondContact O-CG 3.47Å; Y142-Q146 PolarHBondContact O-N 3.4Å; Y142-Q146 PolarHBondContact OH-NE2 2.88Å; L143-Q146 PolarHBondContact O-N 2.87Å; Q146-A149 PolarHBondContact O-N 3.49Å; Q146-A150 WeakPolarHBondContact O-CB 3.37Å; Q146-A150 PolarHBondContact O-N 3.13Å |
| 147 | L | 98.2 | Very high | 97.4 | Very high | 107 Ų | 107 | 96.6 Ų | 96.6 | 56% | 0.56 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -63 | -43.1 | 177.1 | -76.7 | 173.1 | 0 | 0 | 0 | 111.7 | L143 S144 F145 A150 K151 | L143-L147 WeakPolarHBondContact O-CB 3.42Å; L143-L147 WeakPolarHBondContact O-CG 3.35Å; L143-L147 PolarHBondContact O-N 3.3Å; S144-L147 PolarHBondContact O-N 3.39Å; F145-L147 PolarHBondContact O-N 3.42Å; L147-A150 PolarHBondContact O-N 3.13Å; L147-K151 WeakPolarHBondContact O-CB 3.37Å; L147-K151 VanDerWaalsContact O-CG 3.25Å; L147-K151 WeakPolarHBondContact O-CG 3.48Å; L147-K151 PolarHBondContact O-N 3.3Å |
| 148 | H | 97.8 | Very high | 97.2 | Very high | 112 Ų | 112 | 100.8 Ų | 100.8 | 52% | 0.519 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.9 | -43.7 | 175.2 | -79.6 | -66.9 | 0 | 0 | 0 | 111.8 | S144 F145 A150 K151 Q152 | S144-H148 PolarHBondContact O-CD2 3Å; S144-H148 PolarHBondContact O-N 2.87Å; F145-H148 PolarHBondContact O-N 2.94Å; H148-A150 PolarHBondContact O-N 2.92Å; H148-K151 PolarHBondContact O-N 2.9Å; H148-Q152 WeakPolarHBondContact O-CB 3.38Å; H148-Q152 VanDerWaalsContact O-CG 3.31Å; H148-Q152 WeakPolarHBondContact O-CG 3.37Å; H148-Q152 PolarHBondContact O-N 2.79Å |
| 149 | A | 98.2 | Very high | 96.8 | Very high | 27 Ų | 27 | 98.6 Ų | 98.6 | 22% | 0.223 | 50% | 0.498 | C | S | . | . | H | α-helix | trans | -61.2 | -43.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | F145 Q146 Q152 K153 | F145-A149 WeakPolarHBondContact O-CB 3.34Å; F145-A149 PolarHBondContact O-N 3.45Å; Q146-A149 PolarHBondContact O-N 3.49Å; A149-Q152 PolarHBondContact O-N 3.32Å; A149-K153 WeakPolarHBondContact O-CG 3.25Å; A149-K153 PolarHBondContact O-N 3.1Å |
| 150 | A | 97.4 | Very high | 96.3 | Very high | 55 Ų | 55 | 102.5 Ų | 102.5 | 46% | 0.455 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.4 | -45 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | Q146 L147 H148 Q152 K153 L154 | Q146-A150 WeakPolarHBondContact O-CB 3.37Å; Q146-A150 PolarHBondContact O-N 3.13Å; L147-A150 PolarHBondContact O-N 3.13Å; H148-A150 PolarHBondContact O-N 2.92Å; A150-Q152 VanDerWaalsContact C-N 3.34Å; A150-Q152 PolarHBondContact O-N 2.99Å; A150-K153 PolarHBondContact O-N 3.33Å; A150-L154 PolarHBondContact O-N 2.9Å |
| 151 | K | 97.1 | Very high | 95.7 | Very high | 136 Ų | 136 | 106 Ų | 106 | 59% | 0.591 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -59.8 | -42.8 | 174.6 | -76.3 | 175.1 | -178.3 | 178.9 | 0 | 111.8 | L147 H148 L154 H155 | L147-K151 WeakPolarHBondContact O-CB 3.37Å; L147-K151 VanDerWaalsContact O-CG 3.25Å; L147-K151 WeakPolarHBondContact O-CG 3.48Å; L147-K151 PolarHBondContact O-N 3.3Å; H148-K151 PolarHBondContact O-N 2.9Å; K151-L154 PolarHBondContact O-N 3.45Å; K151-H155 WeakPolarHBondContact O-CB 3.36Å; K151-H155 PolarHBondContact O-N 2.88Å |
| 152 | Q | 96.6 | Very high | 95.1 | Very high | 122 Ų | 122 | 110.6 Ų | 110.6 | 57% | 0.57 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -62.2 | -48.5 | 176 | -75.4 | 177 | 8.7 | 0 | 0 | 110.9 | H148 A149 A150 L154 H155 H156 | H148-Q152 WeakPolarHBondContact O-CB 3.38Å; H148-Q152 VanDerWaalsContact O-CG 3.31Å; H148-Q152 WeakPolarHBondContact O-CG 3.37Å; H148-Q152 PolarHBondContact O-N 2.79Å; A149-Q152 PolarHBondContact O-N 3.32Å; A150-Q152 VanDerWaalsContact C-N 3.34Å; A150-Q152 PolarHBondContact O-N 2.99Å; Q152-L154 VanDerWaalsContact C-N 3.35Å; Q152-L154 PolarHBondContact O-N 3.29Å; Q152-H155 PolarHBondContact O-N 2.85Å; Q152-H156 PolarHBondContact O-N 3.48Å; Q152-H156 PolarHBondContact O-ND1 3.28Å |
| 153 | K | 96 | Very high | 94.2 | Very high | 161 Ų | 161 | 109.7 Ų | 109.7 | 70% | 0.7 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -57.5 | -45.5 | 177 | -72.1 | 175.5 | -178 | -178.7 | 0 | 112.2 | A149 A150 H155 H156 Q157 | A149-K153 WeakPolarHBondContact O-CG 3.25Å; A149-K153 PolarHBondContact O-N 3.1Å; A150-K153 PolarHBondContact O-N 3.33Å; K153-H155 PolarHBondContact O-N 3.34Å; K153-H156 PolarHBondContact O-N 3.35Å; K153-Q157 PolarHBondContact O-N 2.91Å |
| 154 | L | 95.6 | Very high | 93.1 | Very high | 82 Ų | 82 | 107 Ų | 107 | 43% | 0.429 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.9 | -42.4 | 176.1 | -175.9 | 75 | 0 | 0 | 0 | 112.1 | A150 K151 Q152 Q157 R158 | A150-L154 PolarHBondContact O-N 2.9Å; K151-L154 PolarHBondContact O-N 3.45Å; Q152-L154 VanDerWaalsContact C-N 3.35Å; Q152-L154 PolarHBondContact O-N 3.29Å; L154-Q157 PolarHBondContact O-N 3.25Å; L154-R158 PolarHBondContact O-N 3.11Å |
| 155 | H | 95.5 | Very high | 91.8 | Very high | 115 Ų | 115 | 109.4 Ų | 109.4 | 53% | 0.532 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64.1 | -44.2 | 177.9 | -176.2 | 69.5 | 0 | 0 | 0 | 111.8 | K151 Q152 K153 Q157 R158 M159 | K151-H155 WeakPolarHBondContact O-CB 3.36Å; K151-H155 PolarHBondContact O-N 2.88Å; Q152-H155 PolarHBondContact O-N 2.85Å; K153-H155 PolarHBondContact O-N 3.34Å; H155-Q157 VanDerWaalsContact C-N 3.34Å; H155-Q157 PolarHBondContact O-N 2.86Å; H155-R158 PolarHBondContact O-N 2.89Å; H155-M159 WeakPolarHBondContact O-CG 3.31Å; H155-M159 PolarHBondContact O-N 3.45Å |
| 156 | H | 94 | Very high | 90.3 | Very high | 114 Ų | 114 | 107.6 Ų | 107.6 | 53% | 0.528 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -59.6 | -44.3 | 174.1 | -74.4 | 84.4 | 0 | 0 | 0 | 111.4 | Q152 K153 R158 M159 Q160 | Q152-H156 PolarHBondContact O-N 3.48Å; Q152-H156 PolarHBondContact O-ND1 3.28Å; K153-H156 PolarHBondContact O-N 3.35Å; H156-R158 PolarHBondContact O-N 3.31Å; H156-M159 PolarHBondContact O-N 2.93Å; H156-Q160 WeakPolarHBondContact O-CG 3.45Å; H156-Q160 PolarHBondContact O-N 2.85Å |
| 157 | Q | 93.7 | Very high | 88.6 | Confident | 123 Ų | 123 | 106.2 Ų | 106.2 | 58% | 0.575 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -60 | -46.2 | 175.7 | -172.9 | -174.3 | 39.5 | 0 | 0 | 112 | K153 L154 H155 M159 Q160 Q161 | K153-Q157 PolarHBondContact O-N 2.91Å; L154-Q157 PolarHBondContact O-N 3.25Å; H155-Q157 VanDerWaalsContact C-N 3.34Å; H155-Q157 PolarHBondContact O-N 2.86Å; Q157-M159 VanDerWaalsContact C-N 3.33Å; Q157-M159 PolarHBondContact O-N 3.29Å; Q157-Q160 PolarHBondContact O-N 2.94Å; Q157-Q161 PolarHBondContact O-N 2.96Å |
| 158 | R | 93.1 | Very high | 86.7 | Confident | 162 Ų | 162 | 109.5 Ų | 109.5 | 61% | 0.611 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -60.8 | -40.9 | 175.7 | -79.3 | -177.1 | 179.1 | 169.9 | 0.3 | 112.2 | L154 H155 H156 Q161 R162 | L154-R158 PolarHBondContact O-N 3.11Å; H155-R158 PolarHBondContact O-N 2.89Å; H156-R158 PolarHBondContact O-N 3.31Å; R158-Q161 PolarHBondContact O-N 3.3Å; R158-R162 WeakPolarHBondContact O-CB 3.36Å; R158-R162 PolarHBondContact O-N 2.94Å |
| 159 | M | 90.7 | Very high | 84.7 | Confident | 63 Ų | 63 | 107.1 Ų | 107.1 | 31% | 0.31 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -65.5 | -41.8 | 176.8 | -75.1 | -61.6 | -71.4 | 0 | 0 | 112 | H155 H156 Q157 R162 Q163 | H155-M159 WeakPolarHBondContact O-CG 3.31Å; H155-M159 PolarHBondContact O-N 3.45Å; H156-M159 PolarHBondContact O-N 2.93Å; Q157-M159 VanDerWaalsContact C-N 3.33Å; Q157-M159 PolarHBondContact O-N 3.29Å; M159-R162 PolarHBondContact O-N 3.36Å; M159-Q163 WeakPolarHBondContact O-CG 3.44Å; M159-Q163 PolarHBondContact O-N 3.32Å |
| 160 | Q | 88.8 | Confident | 82.6 | Confident | 134 Ų | 134 | 110.7 Ų | 110.7 | 63% | 0.626 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -63.2 | -42.8 | 173.7 | -72.7 | 173.8 | -7.6 | 0 | 0 | 112.1 | H156 Q157 R162 Q163 G164 | H156-Q160 WeakPolarHBondContact O-CG 3.45Å; H156-Q160 PolarHBondContact O-N 2.85Å; Q157-Q160 PolarHBondContact O-N 2.94Å; Q160-R162 VanDerWaalsContact C-N 3.32Å; Q160-R162 PolarHBondContact O-N 2.76Å; Q160-Q163 PolarHBondContact O-N 3.04Å; Q160-G164 PolarHBondContact O-N 3.48Å |
| 161 | Q | 86.8 | Confident | 80.4 | Confident | 127 Ų | 127 | 112.7 Ų | 112.7 | 59% | 0.593 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -60.6 | -43 | 174.3 | -173.2 | -177.1 | 23.1 | 0 | 0 | 111.2 | Q157 R158 Q163 G164 L165 | Q157-Q161 PolarHBondContact O-N 2.96Å; R158-Q161 PolarHBondContact O-N 3.3Å; Q161-Q163 PolarHBondContact O-N 3.46Å; Q161-G164 PolarHBondContact O-N 3.43Å; Q161-L165 HydrophobicContact CG-CD1 4.35Å; Q161-L165 WeakPolarHBondContact O-CG 3.37Å; Q161-L165 PolarHBondContact O-N 2.84Å |
| 162 | R | 84.8 | Confident | 78 | Confident | 155 Ų | 155 | 113.8 Ų | 113.8 | 59% | 0.585 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -63.6 | -41.4 | 177.1 | -156.1 | 176.2 | 84.5 | 168.6 | 6.3 | 111.6 | R158 M159 Q160 L165 L166 | R158-R162 WeakPolarHBondContact O-CB 3.36Å; R158-R162 PolarHBondContact O-N 2.94Å; M159-R162 PolarHBondContact O-N 3.36Å; Q160-R162 VanDerWaalsContact C-N 3.32Å; Q160-R162 PolarHBondContact O-N 2.76Å; R162-L165 PolarHBondContact O-N 3.04Å; R162-L166 WeakPolarHBondContact O-CB 3.36Å; R162-L166 VanDerWaalsContact O-CG 3.28Å; R162-L166 WeakPolarHBondContact O-CG 3.46Å; R162-L166 PolarHBondContact O-N 3.48Å |
| 163 | Q | 80.6 | Confident | 75.3 | Confident | 122 Ų | 122 | 110.8 Ų | 110.8 | 57% | 0.57 | 57% | 0.571 | S | S | * | * | H | α-helix | trans | -65.9 | -39.3 | 174.6 | -71.7 | 174.3 | 23.1 | 0 | 0 | 112.1 | M159 Q160 Q161 L166 A167 | M159-Q163 WeakPolarHBondContact O-CG 3.44Å; M159-Q163 PolarHBondContact O-N 3.32Å; Q160-Q163 PolarHBondContact O-N 3.04Å; Q161-Q163 PolarHBondContact O-N 3.46Å; Q163-L166 PolarHBondContact O-N 2.89Å; Q163-A167 VanDerWaalsContact O-CB 3.32Å; Q163-A167 WeakPolarHBondContact O-CB 3.4Å; Q163-A167 PolarHBondContact O-N 3.41Å |
| 164 | G | 75.4 | Confident | 72.8 | Confident | 41 Ų | 41 | 109.4 Ų | 109.4 | 42% | 0.423 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -66.4 | -37.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | Q160 Q161 R168 | Q160-G164 PolarHBondContact O-N 3.48Å; Q161-G164 PolarHBondContact O-N 3.43Å; G164-R168 WeakPolarHBondContact O-CB 3.32Å; G164-R168 PolarHBondContact O-N 2.97Å |
| 165 | L | 70.3 | Confident | 70.2 | Confident | 109 Ų | 109 | 113.3 Ų | 113.3 | 57% | 0.571 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -67.8 | -40.4 | 173 | -72 | 174.8 | 0 | 0 | 0 | 111.9 | Q161 R162 R168 A169 | Q161-L165 HydrophobicContact CG-CD1 4.35Å; Q161-L165 WeakPolarHBondContact O-CG 3.37Å; Q161-L165 PolarHBondContact O-N 2.84Å; R162-L165 PolarHBondContact O-N 3.04Å; L165-R168 PolarHBondContact O-N 2.91Å; L165-A169 WeakPolarHBondContact O-CB 3.37Å; L165-A169 PolarHBondContact O-N 2.74Å |
| 166 | L | 67.6 | Low | 67.6 | Low | 108 Ų | 108 | 115.7 Ų | 115.7 | 57% | 0.565 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -68 | -37.9 | 174.6 | -71.3 | 170.5 | 0 | 0 | 0 | 112.3 | R162 Q163 A169 S170 | R162-L166 WeakPolarHBondContact O-CB 3.36Å; R162-L166 VanDerWaalsContact O-CG 3.28Å; R162-L166 WeakPolarHBondContact O-CG 3.46Å; R162-L166 PolarHBondContact O-N 3.48Å; Q163-L166 PolarHBondContact O-N 2.89Å; L166-A169 PolarHBondContact O-N 3.18Å; L166-S170 WeakPolarHBondContact O-CB 3.35Å; L166-S170 PolarHBondContact O-N 2.92Å |
| 167 | A | 61.8 | Low | 64.8 | Low | 56 Ų | 56 | 113.8 Ų | 113.8 | 46% | 0.463 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -65.5 | -38.4 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q163 S170 S171 | Q163-A167 VanDerWaalsContact O-CB 3.32Å; Q163-A167 WeakPolarHBondContact O-CB 3.4Å; Q163-A167 PolarHBondContact O-N 3.41Å; A167-S170 PolarHBondContact O-N 3.46Å; A167-S171 PolarHBondContact O-N 3.38Å; A167-S171 PolarHBondContact O-OG 3.25Å |
| 168 | R | 58.9 | Low | 62.5 | Low | 176 Ų | 176 | 112.5 Ų | 112.5 | 66% | 0.664 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -70.7 | -36 | 175 | -167.3 | 165.1 | -178.9 | 128.6 | -2.5 | 112.7 | G164 L165 S171 Q172 | G164-R168 WeakPolarHBondContact O-CB 3.32Å; G164-R168 PolarHBondContact O-N 2.97Å; L165-R168 PolarHBondContact O-N 2.91Å; R168-S171 PolarHBondContact O-N 2.8Å; R168-Q172 PolarHBondContact O-N 3.49Å |
| 169 | A | 56.6 | Low | 59.9 | Low | 61 Ų | 61 | 112.2 Ų | 112.2 | 50% | 0.504 | 64% | 0.635 | S | S | . | * | H | α-helix | trans | -66.7 | -36.5 | 170.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | L165 L166 S171 Q172 | L165-A169 WeakPolarHBondContact O-CB 3.37Å; L165-A169 PolarHBondContact O-N 2.74Å; L166-A169 PolarHBondContact O-N 3.18Å; A169-S171 VanDerWaalsContact C-N 3.27Å; A169-S171 PolarHBondContact O-N 2.91Å; A169-Q172 CarbonylContact O-C 3.54Å; A169-Q172 PolarHBondContact O-N 2.88Å |
| 170 | S | 53.8 | Low | 57.7 | Low | 102 Ų | 102 | 116.3 Ų | 116.3 | 71% | 0.713 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -72.3 | -19 | 174.4 | -166.5 | 0 | 0 | 0 | 0 | 113.6 | L166 A167 | L166-S170 WeakPolarHBondContact O-CB 3.35Å; L166-S170 PolarHBondContact O-N 2.92Å; A167-S170 PolarHBondContact O-N 3.46Å |
| 171 | S | 51.2 | Low | 55.1 | Low | 98 Ų | 98 | 116.7 Ų | 116.7 | 69% | 0.685 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.8 | -14.6 | 175.1 | -50.9 | 0 | 0 | 0 | 0 | 112.9 | A167 R168 A169 | A167-S171 PolarHBondContact O-N 3.38Å; A167-S171 PolarHBondContact O-OG 3.25Å; R168-S171 PolarHBondContact O-N 2.8Å; A169-S171 VanDerWaalsContact C-N 3.27Å; A169-S171 PolarHBondContact O-N 2.91Å |
| 172 | Q | 47.1 | Very low | 52.7 | Low | 158 Ų | 158 | 116.4 Ų | 116.4 | 74% | 0.738 | 67% | 0.672 | S | S | * | * | S | Bend | trans | -114.5 | 62.4 | 175.9 | -70.7 | -179.7 | -27.4 | 0 | 0 | 108.8 | R168 A169 | R168-Q172 PolarHBondContact O-N 3.49Å; A169-Q172 CarbonylContact O-C 3.54Å; A169-Q172 PolarHBondContact O-N 2.88Å |
| 173 | G | 39.4 | Very low | 50.9 | Low | 59 Ų | 59 | 114.7 Ų | 114.7 | 61% | 0.608 | 68% | 0.683 | S | S | * | * | trans | -132.8 | 57.6 | -176.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 174 | V | 43.4 | Very low | 49.4 | Very low | 133 Ų | 133 | 114.3 Ų | 114.3 | 81% | 0.806 | 69% | 0.691 | S | S | * | * | trans | -140.7 | 88 | 151 | -174 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 175 | Q | 40 | Very low | 47.8 | Very low | 164 Ų | 164 | 121.1 Ų | 121.1 | 77% | 0.766 | 72% | 0.717 | S | S | * | * | 175.6 | 118.2 | 115.5 | -88.7 | -166.2 | 50.2 | 0 | 0 | 111.6 | |||||
| 176 | L | 42.5 | Very low | 46.7 | Very low | 165 Ų | 165 | 120.7 Ų | 120.7 | 86% | 0.864 | 73% | 0.729 | S | S | * | * | trans | 49.7 | 125.9 | 132.8 | -64.2 | 162.5 | 0 | 0 | 0 | 119.9 | ||||
| 177 | G | 35.4 | Very low | 45.6 | Very low | 74 Ų | 74 | 119.1 Ų | 119.1 | 76% | 0.763 | 74% | 0.739 | S | S | * | * | trans | 160.8 | 87.7 | 154.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 178 | A | 44.9 | Very low | 44.6 | Very low | 95 Ų | 95 | 121 Ų | 121 | 79% | 0.785 | 75% | 0.754 | S | S | * | * | trans | -51.5 | 149.4 | 159.9 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 179 | E | 37.9 | Very low | 43.8 | Very low | 157 Ų | 157 | 118.2 Ų | 118.2 | 73% | 0.734 | 76% | 0.762 | S | S | * | * | 170.4 | 112 | 129.1 | -78.3 | -107.2 | 103.5 | 0 | 0 | 110.1 | |||||
| 180 | Q | 44 | Very low | 43.2 | Very low | 149 Ų | 149 | 121.1 Ų | 121.1 | 70% | 0.696 | 78% | 0.776 | S | S | * | * | trans | 53.1 | 133.8 | 131 | -54.2 | -166 | 63.5 | 0 | 0 | 122.5 | ||||
| 181 | N | 35.6 | Very low | 42.3 | Very low | 142 Ų | 142 | 121.7 Ų | 121.7 | 76% | 0.759 | 78% | 0.78 | S | S | * | * | trans | 69.3 | 100.5 | 146.9 | -77 | -9.6 | 0 | 0 | 0 | 119.4 | ||||
| 182 | S | 35.8 | Very low | 42.2 | Very low | 121 Ų | 121 | 121.3 Ų | 121.3 | 85% | 0.846 | 78% | 0.777 | S | S | * | * | 152.7 | 121.1 | 94.2 | 53.5 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 183 | S | 45.5 | Very low | 42 | Very low | 118 Ų | 118 | 119.2 Ų | 119.2 | 83% | 0.825 | 78% | 0.778 | S | S | * | * | trans | -102.8 | 172 | 160.3 | -53.8 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 184 | P | 49.2 | Very low | 42.3 | Very low | 114 Ų | 114 | 122.3 Ų | 122.3 | 74% | 0.74 | 78% | 0.784 | S | S | * | * | -125.3 | 144.4 | -56.9 | 33.8 | -19.1 | 0 | 0 | 0 | 110.3 | A186 | P184-A186 PolarHBondContact O-N 3.42Š| |||
| 185 | L | 43.6 | Very low | 42.4 | Very low | 185 Ų | 185 | 121.8 Ų | 121.8 | 97% | 0.969 | 78% | 0.781 | S | S | * | * | trans | -86.1 | 93.7 | 163.9 | -97.4 | 94.4 | 0 | 0 | 0 | 110.2 | ||||
| 186 | A | 47.3 | Very low | 43.3 | Very low | 99 Ų | 99 | 122.5 Ų | 122.5 | 82% | 0.818 | 78% | 0.781 | S | S | * | * | trans | -65.7 | 125.2 | 150.5 | 0 | 0 | 0 | 0 | 0 | 108.6 | P184 | P184-A186 PolarHBondContact O-N 3.42Š| ||
| 187 | G | 44.5 | Very low | 43.4 | Very low | 75 Ų | 75 | 120.4 Ų | 120.4 | 77% | 0.773 | 78% | 0.778 | S | S | * | * | trans | 170.7 | 74.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 188 | A | 39.1 | Very low | 43.8 | Very low | 95 Ų | 95 | 125.7 Ų | 125.7 | 79% | 0.785 | 78% | 0.78 | S | S | * | * | trans | 166.2 | 81.9 | 141 | 0 | 0 | 0 | 0 | 0 | 109.2 | P190 | A188-P190 WeakPolarHBondContact O-CD 3.46Š| ||
| 189 | S | 42.3 | Very low | 44.1 | Very low | 118 Ų | 118 | 132.3 Ų | 132.3 | 83% | 0.825 | 79% | 0.785 | S | S | * | * | trans | -70.5 | 122.2 | 152.4 | -69.6 | 0 | 0 | 0 | 0 | 107.1 | S191 | S189-S191 PolarHBondContact O-N 3.44Š| ||
| 190 | P | 44.9 | Very low | 44.5 | Very low | 123 Ų | 123 | 132.3 Ų | 132.3 | 80% | 0.799 | 78% | 0.782 | S | S | * | * | trans | -69.2 | 103.1 | 167.6 | 26.8 | -29.4 | 0 | 0 | 0 | 107.5 | A188 S192 | A188-P190 WeakPolarHBondContact O-CD 3.46Å; P190-S192 PolarHBondContact O-N 3.3Å | ||
| 191 | S | 35.4 | Very low | 44.6 | Very low | 113 Ų | 113 | 132.6 Ų | 132.6 | 79% | 0.79 | 79% | 0.789 | S | S | * | * | trans | -54.3 | 107.4 | 167.9 | 173.2 | 0 | 0 | 0 | 0 | 108.7 | S189 | S189-S191 PolarHBondContact O-N 3.44Š| ||
| 192 | S | 47.3 | Very low | 45.3 | Very low | 90 Ų | 90 | 132.1 Ų | 132.1 | 63% | 0.629 | 78% | 0.784 | S | S | * | * | trans | -43.6 | 126.1 | 165.2 | -49 | 0 | 0 | 0 | 0 | 110.4 | P190 V194 | P190-S192 PolarHBondContact O-N 3.3Å; S192-V194 VanDerWaalsContact C-N 3.35Å; S192-V194 PolarHBondContact O-N 2.92Å | ||
| 193 | P | 43.9 | Very low | 46.1 | Very low | 115 Ų | 115 | 137 Ų | 137 | 75% | 0.747 | 78% | 0.784 | S | S | * | * | trans | -74.3 | 97.4 | 164.8 | 29.6 | -28.8 | 0 | 0 | 0 | 107 | V195 | P193-V195 HydrophobicContact CB-CG2 4.4Å; P193-V195 PolarHBondContact O-N 3.28Å | ||
| 194 | V | 44.5 | Very low | 46.1 | Very low | 124 Ų | 124 | 137.6 Ų | 137.6 | 75% | 0.752 | 78% | 0.783 | S | S | * | * | trans | -67.6 | 84.9 | 164 | 176.7 | 0 | 0 | 0 | 0 | 107.1 | S192 K196 | S192-V194 VanDerWaalsContact C-N 3.35Å; S192-V194 PolarHBondContact O-N 2.92Å; V194-K196 PolarHBondContact O-N 2.94Å | ||
| 195 | V | 46.9 | Very low | 46 | Very low | 121 Ų | 121 | 136.2 Ų | 136.2 | 73% | 0.733 | 78% | 0.776 | S | S | * | * | trans | -74.1 | 101.9 | 166.4 | -179.3 | 0 | 0 | 0 | 0 | 106.6 | P193 P197 | P193-V195 HydrophobicContact CB-CG2 4.4Å; P193-V195 PolarHBondContact O-N 3.28Å; V195-P197 WeakPolarHBondContact O-CD 3.37Å | ||
| 196 | K | 57.5 | Low | 46.4 | Very low | 179 Ų | 179 | 131.3 Ų | 131.3 | 78% | 0.778 | 76% | 0.757 | S | S | * | * | trans | -56.6 | 122.5 | 167.2 | -62.8 | 178 | -178.9 | 178.1 | 0 | 108.3 | V194 K198 | V194-K196 PolarHBondContact O-N 2.94Å; K196-K198 PolarHBondContact O-N 3.47Å; K196-K198 VanDerWaalsContact O-N 3.12Å | ||
| 197 | P | 45.9 | Very low | 46.4 | Very low | 122 Ų | 122 | 136.7 Ų | 136.7 | 79% | 0.792 | 76% | 0.756 | S | S | * | * | trans | -73.1 | 112 | 171.2 | 27.9 | -29.3 | 0 | 0 | 0 | 108.3 | V195 R199 | V195-P197 WeakPolarHBondContact O-CD 3.37Å; P197-R199 PolarHBondContact O-N 2.8Å; P197-R199 VanDerWaalsContact O-N 3.08Å | ||
| 198 | K | 43.5 | Very low | 46.5 | Very low | 185 Ų | 185 | 137.9 Ų | 137.9 | 80% | 0.804 | 75% | 0.748 | S | S | * | * | trans | -60.5 | 108.5 | 168.3 | -165.7 | 160.9 | -178.5 | 169.4 | 0 | 107.1 | K196 K200 | K196-K198 PolarHBondContact O-N 3.47Å; K196-K198 VanDerWaalsContact O-N 3.12Å; K198-K200 VanDerWaalsContact C-N 3.29Å; K198-K200 PolarHBondContact O-N 3.36Å | ||
| 199 | R | 52.2 | Low | 46.9 | Very low | 234 Ų | 234 | 140.3 Ų | 140.3 | 88% | 0.883 | 74% | 0.743 | S | S | * | * | trans | -56.2 | 93.4 | 169.8 | -79.6 | 173.1 | 81 | 160.4 | 1.9 | 108.4 | P197 | P197-R199 PolarHBondContact O-N 2.8Å; P197-R199 VanDerWaalsContact O-N 3.08Å | ||
| 200 | K | 45.5 | Very low | 47.3 | Very low | 156 Ų | 156 | 143.5 Ų | 143.5 | 68% | 0.678 | 74% | 0.737 | S | S | * | * | trans | -94.6 | 108.1 | 154.9 | -68.5 | -174 | 179.1 | -177.1 | 0 | 105.3 | K198 I202 | K198-K200 VanDerWaalsContact C-N 3.29Å; K198-K200 PolarHBondContact O-N 3.36Å; K200-I202 HydrophobicContact CB-CD1 4.32Å; K200-I202 HydrophobicContact CB-CG1 4.26Å; K200-I202 PolarHBondContact O-N 3.08Å | ||
| 201 | N | 46.7 | Very low | 47.6 | Very low | 156 Ų | 156 | 141.7 Ų | 141.7 | 83% | 0.834 | 73% | 0.733 | S | S | * | * | trans | -62.5 | 82.7 | 166.2 | -100.7 | -6.5 | 0 | 0 | 0 | 108.1 | ||||
| 202 | I | 49.8 | Very low | 48.5 | Very low | 131 Ų | 131 | 145.5 Ų | 145.5 | 67% | 0.672 | 73% | 0.73 | S | S | * | * | trans | -98.5 | 98.7 | 165.6 | -65 | 171.6 | 0 | 0 | 0 | 105.4 | K200 V204 | K200-I202 HydrophobicContact CB-CD1 4.32Å; K200-I202 HydrophobicContact CB-CG1 4.26Å; K200-I202 PolarHBondContact O-N 3.08Å; I202-V204 PolarHBondContact O-N 2.88Å | ||
| 203 | R | 51.8 | Low | 48.7 | Very low | 224 Ų | 224 | 148.7 Ų | 148.7 | 85% | 0.845 | 74% | 0.735 | S | S | * | * | trans | -5.6 | 93.3 | 161.8 | -142.8 | 178.3 | -86.2 | -165.1 | -5 | 113.3 | S205 | R203-S205 PolarHBondContact O-N 3.48Š| ||
| 204 | V | 46.2 | Very low | 49.2 | Very low | 130 Ų | 130 | 148 Ų | 148 | 79% | 0.788 | 73% | 0.732 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.2 | 17.5 | 175.8 | -172.1 | 0 | 0 | 0 | 0 | 111.9 | I202 | I202-V204 PolarHBondContact O-N 2.88Š|
| 205 | S | 47.2 | Very low | 49.6 | Very low | 86 Ų | 86 | 147 Ų | 147 | 60% | 0.601 | 73% | 0.726 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.5 | -17.6 | -175.5 | -166.8 | 0 | 0 | 0 | 0 | 114.2 | R203 | R203-S205 PolarHBondContact O-N 3.48Š|
| 206 | S | 51.2 | Low | 49.8 | Very low | 81 Ų | 81 | 146.4 Ų | 146.4 | 57% | 0.566 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -93 | -12.2 | -170.4 | 65.4 | 0 | 0 | 0 | 0 | 115.4 | ||
| 207 | R | 47.7 | Very low | 49.9 | Very low | 212 Ų | 212 | 144.7 Ų | 144.7 | 80% | 0.8 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.1 | -11.5 | -176 | -133 | 179.9 | -172.1 | -173.6 | 1.9 | 114.3 | ||
| 208 | V | 47.4 | Very low | 50.7 | Low | 100 Ų | 100 | 146 Ų | 146 | 61% | 0.606 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.1 | -21.4 | 175.7 | 177.6 | 0 | 0 | 0 | 0 | 111.8 | ||
| 209 | E | 47.8 | Very low | 51.6 | Low | 147 Ų | 147 | 145.7 Ų | 145.7 | 69% | 0.687 | 72% | 0.716 | S | S | * | * | G | 310 helix | trans | -74.7 | -34.4 | 178.2 | -81.4 | -176.7 | 146.3 | 0 | 0 | 113.5 | A211 R212 | E209-A211 PolarHBondContact O-N 3.28Å; E209-A211 VanDerWaalsContact O-N 3.13Å; E209-R212 PolarHBondContact O-N 2.83Å; E209-R212 VanDerWaalsContact O-N 3.1Å |
| 210 | R | 50.8 | Low | 51.9 | Low | 184 Ų | 184 | 140 Ų | 140 | 69% | 0.694 | 71% | 0.707 | S | S | * | * | G | 310 helix | trans | -73.8 | -5.3 | -174.9 | -142.8 | -179.7 | -76.3 | 147.2 | -6.8 | 114.6 | ||
| 211 | A | 50.5 | Low | 52.7 | Low | 86 Ų | 86 | 140 Ų | 140 | 71% | 0.711 | 71% | 0.714 | S | S | * | * | G | 310 helix | trans | -98.6 | -3.4 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.2 | E209 | E209-A211 PolarHBondContact O-N 3.28Å; E209-A211 VanDerWaalsContact O-N 3.13Å |
| 212 | R | 55.3 | Low | 53.8 | Low | 193 Ų | 193 | 134.7 Ų | 134.7 | 73% | 0.728 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -115.7 | 18.9 | 178.8 | -63.2 | -170 | 178.7 | -117.2 | 1.2 | 113 | E209 C214 | E209-R212 PolarHBondContact O-N 2.83Å; E209-R212 VanDerWaalsContact O-N 3.1Å; R212-C214 PolarHBondContact O-N 3.5Å |
| 213 | E | 50.9 | Low | 54.6 | Low | 156 Ų | 156 | 134.7 Ų | 134.7 | 73% | 0.729 | 70% | 0.704 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74 | -3.5 | 176.2 | -112.3 | 166.9 | -176.9 | 0 | 0 | 113.5 | ||
| 214 | C | 53.8 | Low | 55.6 | Low | 101 Ų | 101 | 128.5 Ų | 128.5 | 68% | 0.682 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.5 | 2.1 | -178.3 | -60.7 | 0 | 0 | 0 | 0 | 115.2 | R122 R212 | R122-C214 PolarHBondContact NH1-O 3.36Å; R212-C214 PolarHBondContact O-N 3.5Å |
| 215 | V | 52.6 | Low | 56.9 | Low | 104 Ų | 104 | 130.7 Ų | 130.7 | 63% | 0.63 | 70% | 0.702 | S | S | * | * | S | Bend | trans | -117.3 | 121 | 169.5 | -175.8 | 0 | 0 | 0 | 0 | 106.9 | I217 | V215-I217 PolarHBondContact O-N 3.27Š|
| 216 | P | 52.2 | Low | 57.8 | Low | 108 Ų | 108 | 132.2 Ų | 132.2 | 70% | 0.701 | 71% | 0.71 | S | S | * | * | trans | -55 | 111 | 167.5 | -18.9 | 30.3 | 0 | 0 | 0 | 107.8 | E218 | P216-E218 PolarHBondContact O-N 3.45Š| ||
| 217 | I | 59.4 | Low | 58.9 | Low | 142 Ų | 142 | 134.5 Ų | 134.5 | 73% | 0.728 | 72% | 0.721 | S | S | * | * | trans | -77.5 | 73.1 | 164.8 | -55.9 | 174.6 | 0 | 0 | 0 | 105.2 | V215 K219 | V215-I217 PolarHBondContact O-N 3.27Å; I217-K219 HydrophobicContact CG2-CG 4.44Å; I217-K219 PolarHBondContact O-N 2.92Å; I217-K219 VanDerWaalsContact O-N 3.08Å | ||
| 218 | E | 62.2 | Low | 60.3 | Low | 150 Ų | 150 | 128.7 Ų | 128.7 | 70% | 0.701 | 72% | 0.718 | S | S | * | * | trans | -62.9 | 109.1 | 158.4 | -164.7 | 169.6 | -169.5 | 0 | 0 | 104.5 | P216 V220 | P216-E218 PolarHBondContact O-N 3.45Å; E218-V220 HydrophobicContact CB-CG2 4.42Å; E218-V220 HydrophobicContact CG-CG2 4.32Å; E218-V220 PolarHBondContact O-N 3.3Å | ||
| 219 | K | 62.3 | Low | 62 | Low | 179 Ų | 179 | 131.6 Ų | 131.6 | 78% | 0.778 | 73% | 0.727 | S | S | * | * | trans | -66.2 | 81.4 | 168.9 | -68.2 | 177.9 | -179.3 | 177.2 | 0 | 106 | I217 L221 | I217-K219 HydrophobicContact CG2-CG 4.44Å; I217-K219 PolarHBondContact O-N 2.92Å; I217-K219 VanDerWaalsContact O-N 3.08Å; K219-L221 PolarHBondContact O-N 2.94Å | ||
| 220 | V | 58 | Low | 63.5 | Low | 114 Ų | 114 | 128.9 Ų | 128.9 | 69% | 0.691 | 72% | 0.722 | S | S | * | * | trans | -64.2 | 91.7 | 165.8 | -178.8 | 0 | 0 | 0 | 0 | 104.4 | E218 G222 | E218-V220 HydrophobicContact CB-CG2 4.42Å; E218-V220 HydrophobicContact CG-CG2 4.32Å; E218-V220 PolarHBondContact O-N 3.3Å; V220-G222 VanDerWaalsContact C-N 3.26Å; V220-G222 PolarHBondContact O-N 2.85Å | ||
| 221 | L | 62.9 | Low | 64.9 | Low | 157 Ų | 157 | 124.7 Ų | 124.7 | 82% | 0.822 | 71% | 0.713 | S | S | * | * | trans | -58.3 | 107.9 | 154.2 | -88.9 | 88.1 | 0 | 0 | 0 | 103.7 | K219 | K219-L221 PolarHBondContact O-N 2.94Š| ||
| 222 | G | 68.9 | Low | 66 | Low | 43 Ų | 43 | 124.8 Ų | 124.8 | 44% | 0.443 | 71% | 0.707 | S | S | . | * | trans | -52.9 | 161.8 | 168 | 0 | 0 | 0 | 0 | 0 | 109.3 | V220 A224 | V220-G222 VanDerWaalsContact C-N 3.26Å; V220-G222 PolarHBondContact O-N 2.85Å; G222-A224 PolarHBondContact O-N 3.12Å | ||
| 223 | P | 67.2 | Low | 66.8 | Low | 132 Ų | 132 | 117.9 Ų | 117.9 | 86% | 0.857 | 69% | 0.691 | S | S | * | * | S | Bend | trans | -45.4 | 131.8 | 171.7 | -22.5 | 31.3 | 0 | 0 | 0 | 109 | E225 | P223-E225 PolarHBondContact O-N 3.17Š|
| 224 | A | 72.9 | Confident | 67.5 | Low | 93 Ų | 93 | 116.1 Ų | 116.1 | 77% | 0.769 | 69% | 0.686 | S | S | * | * | trans | -46.3 | 132.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 108.9 | G222 P226 | G222-A224 PolarHBondContact O-N 3.12Å; A224-P226 VanDerWaalsContact O-N 3.13Å | ||
| 225 | E | 72.8 | Confident | 68.3 | Low | 176 Ų | 176 | 119.3 Ų | 119.3 | 82% | 0.822 | 69% | 0.689 | S | S | * | * | trans | -48.2 | 123.2 | -179.2 | -169.2 | 174.2 | -169.1 | 0 | 0 | 108.3 | P223 T227 | P223-E225 PolarHBondContact O-N 3.17Å; E225-T227 PolarHBondContact O-N 3.02Å | ||
| 226 | P | 66.6 | Low | 68.9 | Low | 118 Ų | 118 | 120.8 Ų | 120.8 | 77% | 0.766 | 69% | 0.693 | S | S | * | * | trans | -59.2 | 111.7 | -174.3 | 21.5 | -30.8 | 0 | 0 | 0 | 107.6 | A224 A228 | A224-P226 VanDerWaalsContact O-N 3.13Å; P226-A228 PolarHBondContact O-N 2.7Å; P226-A228 VanDerWaalsContact O-N 3.15Å | ||
| 227 | T | 75.6 | Confident | 69.7 | Low | 130 Ų | 130 | 122.6 Ų | 122.6 | 80% | 0.798 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 125.1 | 172.8 | -54.6 | 0 | 0 | 0 | 0 | 106.6 | E225 M229 | E225-T227 PolarHBondContact O-N 3.02Å; T227-M229 PolarHBondContact O-N 3.35Å; T227-M229 VanDerWaalsContact O-N 3.14Å |
| 228 | A | 76.6 | Confident | 69.8 | Low | 89 Ų | 89 | 121 Ų | 121 | 74% | 0.736 | 69% | 0.69 | S | S | * | * | P | Polyproline II helix | trans | -49.6 | 126.3 | 178.3 | 0 | 0 | 0 | 0 | 0 | 108.6 | P226 | P226-A228 PolarHBondContact O-N 2.7Å; P226-A228 VanDerWaalsContact O-N 3.15Å |
| 229 | M | 82.9 | Confident | 69.6 | Low | 162 Ų | 162 | 124.8 Ų | 124.8 | 80% | 0.798 | 70% | 0.698 | S | S | * | * | P | Polyproline II helix | trans | -53.3 | 135.2 | 178.7 | -75.7 | -64.8 | -61 | 0 | 0 | 108.8 | T227 D231 | T227-M229 PolarHBondContact O-N 3.35Å; T227-M229 VanDerWaalsContact O-N 3.14Å; M229-D231 PolarHBondContact O-N 2.83Å |
| 230 | P | 78.9 | Confident | 69.2 | Low | 89 Ų | 89 | 127 Ų | 127 | 58% | 0.578 | 70% | 0.702 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 135.3 | 173.7 | 24 | -32.2 | 0 | 0 | 0 | 108.7 | P232 | P230-P232 WeakPolarHBondContact O-CD 3.28Å; P230-P232 VanDerWaalsContact O-N 3.08Å |
| 231 | D | 81 | Confident | 68.7 | Low | 96 Ų | 96 | 129.9 Ų | 129.9 | 51% | 0.513 | 71% | 0.707 | S | S | . | * | trans | -53 | 114.9 | -174 | -179.1 | 1.9 | 0 | 0 | 0 | 110.7 | M229 A233 L234 | M229-D231 PolarHBondContact O-N 2.83Å; D231-A233 PolarHBondContact O-N 2.99Å; D231-A233 VanDerWaalsContact O-N 3.12Å; D231-A233 WeakPolarHBondContact OD1-CB 3.42Å; D231-A233 PolarHBondContact OD1-N 2.87Å; D231-L234 PolarHBondContact O-N 2.99Å | ||
| 232 | P | 73.7 | Confident | 67.9 | Low | 88 Ų | 88 | 134 Ų | 134 | 57% | 0.571 | 71% | 0.712 | S | S | * | * | G | 310 helix | trans | -64.2 | -17.1 | -179.1 | 26.5 | -34.2 | 0 | 0 | 0 | 112.3 | P230 L234 F235 L236 | P230-P232 WeakPolarHBondContact O-CD 3.28Å; P230-P232 VanDerWaalsContact O-N 3.08Å; P232-L234 PolarHBondContact O-N 3.38Å; P232-F235 PolarHBondContact O-N 3.39Å; P232-L236 PolarHBondContact O-N 2.95Å |
| 233 | A | 71.8 | Confident | 66.7 | Low | 49 Ų | 49 | 136 Ų | 136 | 41% | 0.405 | 73% | 0.725 | S | S | . | * | G | 310 helix | trans | -63 | -19.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | D231 F235 L236 | D231-A233 PolarHBondContact O-N 2.99Å; D231-A233 VanDerWaalsContact O-N 3.12Å; D231-A233 WeakPolarHBondContact OD1-CB 3.42Å; D231-A233 PolarHBondContact OD1-N 2.87Å; A233-F235 PolarHBondContact O-N 3Å; A233-L236 PolarHBondContact O-N 3.42Å |
| 234 | L | 65.9 | Low | 65.5 | Low | 118 Ų | 118 | 139.6 Ų | 139.6 | 62% | 0.618 | 72% | 0.721 | S | S | * | * | G | 310 helix | trans | -65.8 | -26.5 | 172.8 | -64.5 | -179.5 | 0 | 0 | 0 | 112.9 | D231 P232 | D231-L234 PolarHBondContact O-N 2.99Å; P232-L234 PolarHBondContact O-N 3.38Å |
| 235 | F | 69.3 | Low | 64.1 | Low | 169 Ų | 169 | 140.6 Ų | 140.6 | 74% | 0.741 | 72% | 0.722 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -93.7 | -14.7 | 178.6 | -58.2 | -81.9 | 0 | 0 | 0 | 112.8 | P232 A233 Q237 | P232-F235 PolarHBondContact O-N 3.39Å; A233-F235 PolarHBondContact O-N 3Å; F235-Q237 VanDerWaalsContact C-N 3.34Å |
| 236 | L | 66.4 | Low | 62.6 | Low | 135 Ų | 135 | 140 Ų | 140 | 71% | 0.707 | 71% | 0.713 | S | S | * | * | trans | -94.6 | 14.3 | 179.7 | -62 | 178.9 | 0 | 0 | 0 | 113.1 | P232 A233 P238 | P232-L236 PolarHBondContact O-N 2.95Å; A233-L236 PolarHBondContact O-N 3.42Å; L236-P238 WeakPolarHBondContact O-CD 3.35Å | ||
| 237 | Q | 67.7 | Low | 61.3 | Low | 145 Ų | 145 | 142.2 Ų | 142.2 | 68% | 0.678 | 71% | 0.712 | S | S | * | * | S | Bend | trans | -67.1 | 115.2 | 165.8 | -64.5 | -161.5 | -11.4 | 0 | 0 | 108 | F235 R239 | F235-Q237 VanDerWaalsContact C-N 3.34Å; Q237-R239 PolarHBondContact O-N 2.85Å |
| 238 | P | 63 | Low | 59.4 | Low | 109 Ų | 109 | 142.6 Ų | 142.6 | 71% | 0.708 | 72% | 0.715 | S | S | * | * | trans | -56.7 | 119.8 | 168.5 | -17.8 | 32.2 | 0 | 0 | 0 | 105.9 | L236 R240 | L236-P238 WeakPolarHBondContact O-CD 3.35Å; P238-R240 PolarHBondContact O-N 3.31Å | ||
| 239 | R | 57.5 | Low | 57.5 | Low | 229 Ų | 229 | 145.2 Ų | 145.2 | 86% | 0.864 | 72% | 0.721 | S | S | * | * | trans | -61.6 | 77.8 | 170.9 | -86.6 | -173.8 | 163.5 | -171.7 | -2 | 108.3 | Q237 H241 | Q237-R239 PolarHBondContact O-N 2.85Å; R239-H241 PolarHBondContact O-N 3.41Å; R239-H241 VanDerWaalsContact O-N 3.11Å | ||
| 240 | R | 54.3 | Low | 55.3 | Low | 227 Ų | 227 | 141.7 Ų | 141.7 | 86% | 0.857 | 72% | 0.718 | S | S | * | * | trans | -70.8 | 104.4 | 156.9 | -70.9 | -162.5 | 174.8 | -166.7 | -0.5 | 104.4 | P238 R242 | P238-R240 PolarHBondContact O-N 3.31Å; R240-R242 VanDerWaalsContact C-N 3.31Å; R240-R242 PolarHBondContact O-N 3.33Å | ||
| 241 | H | 47.6 | Very low | 53.4 | Low | 174 Ų | 174 | 146 Ų | 146 | 81% | 0.806 | 73% | 0.73 | S | S | * | * | trans | -46.5 | 99.8 | 169.7 | -70.4 | -85.6 | 0 | 0 | 0 | 108.4 | R239 A243 | R239-H241 PolarHBondContact O-N 3.41Å; R239-H241 VanDerWaalsContact O-N 3.11Å; H241-A243 PolarHBondContact O-N 2.98Å | ||
| 242 | R | 45.6 | Very low | 51.2 | Low | 242 Ų | 242 | 152 Ų | 152 | 91% | 0.913 | 75% | 0.746 | S | S | * | * | trans | -75.1 | 101.2 | 172.4 | -155.7 | 177.9 | -167.3 | 172.6 | 4.2 | 105.2 | R240 R244 | R240-R242 VanDerWaalsContact C-N 3.31Å; R240-R242 PolarHBondContact O-N 3.33Å; R242-R244 PolarHBondContact O-N 3.38Å | ||
| 243 | A | 43.3 | Very low | 49.3 | Very low | 87 Ų | 87 | 156.8 Ų | 156.8 | 72% | 0.719 | 76% | 0.761 | S | S | * | * | trans | -48.6 | 125.5 | 164.2 | 0 | 0 | 0 | 0 | 0 | 107.8 | H241 S245 | H241-A243 PolarHBondContact O-N 2.98Å; A243-S245 VanDerWaalsContact C-N 3.31Å; A243-S245 PolarHBondContact O-N 3.23Å | ||
| 244 | R | 43.2 | Very low | 48 | Very low | 207 Ų | 207 | 159.4 Ų | 159.4 | 78% | 0.781 | 77% | 0.773 | S | S | * | * | trans | -68.2 | 86.6 | -178.3 | -163.6 | -173.4 | -164.4 | -162.8 | 8.2 | 108.4 | R242 | R242-R244 PolarHBondContact O-N 3.38Š| ||
| 245 | S | 42.4 | Very low | 47 | Very low | 113 Ų | 113 | 158.8 Ų | 158.8 | 79% | 0.79 | 78% | 0.777 | S | S | * | * | trans | -84.9 | 111.2 | 167.1 | -171.9 | 0 | 0 | 0 | 0 | 108.9 | A243 | A243-S245 VanDerWaalsContact C-N 3.31Å; A243-S245 PolarHBondContact O-N 3.23Å | ||
| 246 | R | 41.8 | Very low | 45.4 | Very low | 165 Ų | 165 | 159 Ų | 159 | 62% | 0.623 | 79% | 0.785 | S | S | * | * | trans | -88.8 | 145.2 | 167.3 | -74.7 | -175.4 | 168.7 | -165.2 | -2.6 | 108.8 | ||||
| 247 | H | 38.1 | Very low | 43.6 | Very low | 163 Ų | 163 | 156.5 Ų | 156.5 | 76% | 0.755 | 79% | 0.791 | S | S | * | * | trans | 82.8 | 132 | 171.7 | -44.3 | -70.5 | 0 | 0 | 0 | 112.9 | ||||
| 248 | T | 35.7 | Very low | 42.1 | Very low | 138 Ų | 138 | 157.5 Ų | 157.5 | 85% | 0.847 | 80% | 0.8 | S | S | * | * | cis | -155.2 | 163 | 34.2 | 41.5 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 249 | V | 38 | Very low | 40.5 | Very low | 144 Ų | 144 | 161 Ų | 161 | 87% | 0.873 | 81% | 0.807 | S | S | * | * | trans | -63.7 | 139.5 | 167.2 | 167.5 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 250 | A | 35.2 | Very low | 39.3 | Very low | 89 Ų | 89 | 160.8 Ų | 160.8 | 74% | 0.736 | 81% | 0.806 | S | S | * | * | trans | 147.1 | 117.9 | 134.6 | 0 | 0 | 0 | 0 | 0 | 114.1 | ||||
| 251 | Q | 39.5 | Very low | 38.1 | Very low | 179 Ų | 179 | 158.2 Ų | 158.2 | 84% | 0.836 | 81% | 0.81 | S | S | * | * | trans | 28.1 | 128.1 | 136.7 | -115.7 | -179.5 | 10.3 | 0 | 0 | 121.7 | ||||
| 252 | R | 34.3 | Very low | 37.3 | Very low | 222 Ų | 222 | 152.9 Ų | 152.9 | 84% | 0.838 | 80% | 0.801 | S | S | * | * | trans | 93.7 | 92.3 | 131.7 | -151.1 | 176 | -165.6 | 165.9 | 1.9 | 119.6 | ||||
| 253 | Q | 34.7 | Very low | 36.8 | Very low | 189 Ų | 189 | 149.6 Ų | 149.6 | 88% | 0.883 | 80% | 0.797 | S | S | * | * | trans | 54.5 | 159.4 | 134.2 | -81.9 | -135 | -10 | 0 | 0 | 122.4 | ||||
| 254 | P | 43.8 | Very low | 36.3 | Very low | 103 Ų | 103 | 153.8 Ų | 153.8 | 67% | 0.669 | 80% | 0.801 | S | S | * | * | trans | -94.3 | -169 | -139.5 | 44.6 | -40.3 | 0 | 0 | 0 | 113.4 | ||||
| 255 | P | 46.8 | Very low | 35.9 | Very low | 106 Ų | 106 | 153 Ų | 153 | 69% | 0.688 | 81% | 0.807 | S | S | * | * | cis | -152.8 | -172.5 | 18.9 | 48 | -25.8 | 0 | 0 | 0 | 118.9 | ||||
| 256 | L | 33.8 | Very low | 35.4 | Very low | 174 Ų | 174 | 151.4 Ų | 151.4 | 91% | 0.911 | 81% | 0.807 | S | S | * | * | trans | 60.4 | 129.9 | 150.6 | -67.7 | 167.5 | 0 | 0 | 0 | 122.9 | ||||
| 257 | G | 29.3 | Very low | 34.9 | Very low | 82 Ų | 82 | 147.7 Ų | 147.7 | 85% | 0.845 | 82% | 0.821 | S | S | * | * | trans | 114.3 | 97.8 | 138 | 0 | 0 | 0 | 0 | 0 | 117 | ||||
| 258 | L | 35.4 | Very low | 34.6 | Very low | 165 Ų | 165 | 144 Ų | 144 | 86% | 0.864 | 83% | 0.827 | S | S | * | * | trans | -127.8 | 122.9 | 163.7 | -121.1 | 160.9 | 0 | 0 | 0 | 106.8 | ||||
| 259 | E | 30.8 | Very low | 34.4 | Very low | 183 Ų | 183 | 147.1 Ų | 147.1 | 86% | 0.855 | 83% | 0.832 | S | S | * | * | trans | -145.8 | 141.6 | 157.3 | -90.3 | -57.4 | 153.9 | 0 | 0 | 110.3 | ||||
| 260 | R | 31 | Very low | 34.1 | Very low | 224 Ų | 224 | 143.9 Ų | 143.9 | 85% | 0.845 | 83% | 0.827 | S | S | * | * | trans | 86.1 | 100.2 | 161.1 | -162 | 171 | -89.9 | -136.6 | -5.6 | 118.6 | ||||
| 261 | D | 29.4 | Very low | 33.9 | Very low | 174 Ų | 174 | 144.5 Ų | 144.5 | 93% | 0.93 | 83% | 0.832 | S | S | * | * | trans | -105.7 | 147.5 | 133.6 | -85.4 | -32.2 | 0 | 0 | 0 | 109.2 | ||||
| 262 | G | 31.7 | Very low | 33.9 | Very low | 61 Ų | 61 | 142.2 Ų | 142.2 | 63% | 0.629 | 83% | 0.831 | S | S | * | * | trans | -133.4 | 140.4 | 171.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 263 | Q | 33.8 | Very low | 33.8 | Very low | 174 Ų | 174 | 140.4 Ų | 140.4 | 81% | 0.813 | 83% | 0.832 | S | S | * | * | trans | 61.6 | 111.9 | 154.9 | -88 | 135.8 | 17 | 0 | 0 | 118.8 | ||||
| 264 | E | 33.8 | Very low | 34.2 | Very low | 174 Ų | 174 | 137 Ų | 137 | 81% | 0.813 | 82% | 0.823 | S | S | * | * | 83.1 | 115.3 | 80.9 | -85.1 | -169.9 | 168.3 | 0 | 0 | 112.5 | |||||
| 265 | E | 35.5 | Very low | 33.6 | Very low | 192 Ų | 192 | 140.2 Ų | 140.2 | 90% | 0.897 | 83% | 0.829 | S | S | * | * | 156.5 | 147.9 | 113.8 | -101.4 | -157.1 | 148.4 | 0 | 0 | 112.9 | |||||
| 266 | G | 31.1 | Very low | 33 | Very low | 78 Ų | 78 | 141.9 Ų | 141.9 | 80% | 0.804 | 83% | 0.832 | S | S | * | * | trans | 81.9 | 118.2 | 156.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 267 | G | 30.2 | Very low | 33 | Very low | 88 Ų | 88 | 142.2 Ų | 142.2 | 91% | 0.907 | 83% | 0.829 | S | S | * | * | cis | 106.4 | 115.8 | 35.2 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 268 | G | 31.7 | Very low | 33.3 | Very low | 85 Ų | 85 | 142.6 Ų | 142.6 | 88% | 0.876 | 82% | 0.824 | S | S | * | * | trans | 146.2 | 116.6 | 170.1 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 269 | E | 32.6 | Very low | 33.3 | Very low | 203 Ų | 203 | 139.4 Ų | 139.4 | 95% | 0.949 | 82% | 0.822 | S | S | * | * | trans | -71.4 | 158 | -175.3 | -61.3 | 165.7 | 128.9 | 0 | 0 | 114.7 | ||||
| 270 | G | 31.1 | Very low | 33.7 | Very low | 76 Ų | 76 | 141.9 Ų | 141.9 | 78% | 0.784 | 82% | 0.823 | S | S | * | * | trans | 117.3 | 136.7 | 130.6 | 0 | 0 | 0 | 0 | 0 | 118.7 | ||||
| 271 | A | 31.3 | Very low | 34.2 | Very low | 102 Ų | 102 | 139.5 Ų | 139.5 | 84% | 0.843 | 83% | 0.826 | S | S | * | * | trans | 91.5 | 97.2 | 153.8 | 0 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 272 | V | 39 | Very low | 34.7 | Very low | 132 Ų | 132 | 139.9 Ų | 139.9 | 80% | 0.8 | 83% | 0.825 | S | S | * | * | 3.3 | 123.6 | 128.7 | -171.1 | 0 | 0 | 0 | 0 | 117 | |||||
| 273 | E | 33.1 | Very low | 34.9 | Very low | 184 Ų | 184 | 142.9 Ų | 142.9 | 86% | 0.86 | 84% | 0.836 | S | S | * | * | trans | -137.1 | 128.7 | 147.9 | -105.6 | -166.1 | 162.9 | 0 | 0 | 110.5 | ||||
| 274 | V | 42.1 | Very low | 34.9 | Very low | 117 Ų | 117 | 140.5 Ų | 140.5 | 71% | 0.709 | 84% | 0.839 | S | S | * | * | trans | -89.2 | 133.7 | 166 | 169.4 | 0 | 0 | 0 | 0 | 106.6 | ||||
| 275 | H | 32 | Very low | 35 | Very low | 170 Ų | 170 | 136.5 Ų | 136.5 | 79% | 0.787 | 84% | 0.835 | S | S | * | * | trans | -147.9 | 117.7 | 155.7 | -125 | -77.6 | 0 | 0 | 0 | 111.5 | ||||
| 276 | D | 33.9 | Very low | 35 | Very low | 142 Ų | 142 | 132.1 Ų | 132.1 | 76% | 0.759 | 83% | 0.832 | S | S | * | * | trans | -48.3 | 146.8 | 152.2 | -92.3 | -62.5 | 0 | 0 | 0 | 110.9 | ||||
| 277 | E | 33.5 | Very low | 35.9 | Very low | 181 Ų | 181 | 133.1 Ų | 133.1 | 85% | 0.846 | 83% | 0.832 | S | S | * | * | 179.6 | 145.3 | 114.8 | -165 | 167.1 | 166.2 | 0 | 0 | 112.1 | |||||
| 278 | A | 36.9 | Very low | 36.7 | Very low | 89 Ų | 89 | 134.4 Ų | 134.4 | 74% | 0.736 | 83% | 0.825 | S | S | * | * | trans | -53.5 | 144.7 | 179.5 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 279 | A | 34.8 | Very low | 37.5 | Very low | 98 Ų | 98 | 136.4 Ų | 136.4 | 81% | 0.81 | 82% | 0.822 | S | S | * | * | trans | -146.3 | 101.4 | 150.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 280 | R | 39.1 | Very low | 38 | Very low | 236 Ų | 236 | 131.6 Ų | 131.6 | 89% | 0.891 | 82% | 0.817 | S | S | * | * | trans | -44.7 | 132.5 | 160.3 | -67.4 | 170.5 | 170.2 | 175.3 | -3.3 | 110.8 | ||||
| 281 | L | 41.8 | Very low | 38.5 | Very low | 174 Ų | 174 | 132.4 Ų | 132.4 | 91% | 0.911 | 82% | 0.816 | S | S | * | * | trans | -142.5 | 99.6 | 148 | -76.3 | -179.2 | 0 | 0 | 0 | 110.5 | ||||
| 282 | M | 39.8 | Very low | 39.2 | Very low | 182 Ų | 182 | 136.4 Ų | 136.4 | 90% | 0.897 | 82% | 0.818 | S | S | * | * | trans | -64 | 124.2 | 153.3 | -81.5 | -88.8 | 140.3 | 0 | 0 | 109 | ||||
| 283 | S | 35.2 | Very low | 39.8 | Very low | 123 Ų | 123 | 136.5 Ų | 136.5 | 86% | 0.86 | 82% | 0.819 | S | S | * | * | trans | -169.7 | 107.2 | 151.8 | -89 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 284 | S | 34.7 | Very low | 40.4 | Very low | 125 Ų | 125 | 135.2 Ų | 135.2 | 87% | 0.874 | 82% | 0.818 | S | S | * | * | trans | -148.8 | 113.7 | 131.6 | -164.9 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 285 | A | 35.5 | Very low | 40.7 | Very low | 90 Ų | 90 | 133.8 Ų | 133.8 | 74% | 0.744 | 82% | 0.818 | S | S | * | * | trans | -79.2 | 175.5 | 164.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 286 | A | 34.6 | Very low | 41.4 | Very low | 100 Ų | 100 | 137.2 Ų | 137.2 | 83% | 0.826 | 84% | 0.842 | S | S | * | * | trans | 92.1 | 84.9 | 157.6 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 287 | A | 50 | Low | 41.7 | Very low | 98 Ų | 98 | 137 Ų | 137 | 81% | 0.81 | 85% | 0.846 | S | S | * | * | P | Polyproline II helix | trans | -73.7 | 145.9 | 151.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||
| 288 | P | 47.8 | Very low | 42.2 | Very low | 116 Ų | 116 | 134.6 Ų | 134.6 | 75% | 0.753 | 85% | 0.847 | S | S | * | * | P | Polyproline II helix | trans | -96 | 158 | 162 | 34.8 | -26.6 | 0 | 0 | 0 | 111.5 | ||
| 289 | P | 49.7 | Very low | 42.5 | Very low | 127 Ų | 127 | 137.2 Ų | 137.2 | 83% | 0.825 | 85% | 0.853 | S | S | * | * | P | Polyproline II helix | trans | -80.7 | 143.1 | -165.5 | 32.1 | -34.1 | 0 | 0 | 0 | 113 | ||
| 290 | A | 41.7 | Very low | 42.9 | Very low | 102 Ų | 102 | 139.5 Ų | 139.5 | 84% | 0.843 | 86% | 0.855 | S | S | * | * | P | Polyproline II helix | trans | -71.5 | 127 | 170 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||
| 291 | A | 42.7 | Very low | 43.1 | Very low | 92 Ų | 92 | 133.4 Ų | 133.4 | 76% | 0.76 | 85% | 0.853 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 126.6 | 168.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||
| 292 | Q | 45.3 | Very low | 43.2 | Very low | 186 Ų | 186 | 130.7 Ų | 130.7 | 87% | 0.869 | 85% | 0.849 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 130.1 | 168.2 | -76 | 165.4 | -13.9 | 0 | 0 | 110.1 | ||
| 293 | T | 50.7 | Low | 43.5 | Very low | 135 Ų | 135 | 127.1 Ų | 127.1 | 83% | 0.828 | 85% | 0.846 | S | S | * | * | trans | -115.7 | 111.6 | 161 | 54.6 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 294 | N | 46.7 | Very low | 44.1 | Very low | 157 Ų | 157 | 127.4 Ų | 127.4 | 84% | 0.84 | 85% | 0.845 | S | S | * | * | trans | -78.7 | 161.4 | 157.9 | -76 | -40.5 | 0 | 0 | 0 | 109.6 | ||||
| 295 | A | 47.9 | Very low | 44.9 | Very low | 87 Ų | 87 | 127.6 Ų | 127.6 | 72% | 0.719 | 84% | 0.842 | S | S | * | * | trans | 96.4 | 122.8 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 296 | D | 46.2 | Very low | 45.8 | Very low | 241 Ų | 241 | 131 Ų | 131 | 100% | 1.289 | 85% | 0.851 | S | S | * | * | cis | -139 | 0 | 14.7 | -80.2 | -47.8 | 0 | 0 | 0 | 111.4 |
Retrieved 296 of 296 residues in 191.6 ms
(Link to these results)