| 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 | 41 | Very low | 59.9 | Low | 190 Ų | 190 | 133.1 Ų | 133.1 | 94% | 0.936 | 60% | 0.603 | S | S | * | * | 0 | -67 | 0 | -130.6 | 175.1 | -120.1 | 0 | 0 | 113.6 | R3 L4 L5 | M1-R3 VanDerWaalsContact C-N 3.29Å; M1-R3 PolarHBondContact O-N 3.46Å; M1-L4 WeakPolarHBondContact O-CA 3.41Å; M1-L4 WeakPolarHBondContact O-CB 3.47Å; M1-L4 PolarHBondContact O-N 3.17Å; M1-L5 PolarHBondContact O-N 2.97Å | |||
| 2 | R | 48 | Very low | 60.5 | Low | 212 Ų | 212 | 135.8 Ų | 135.8 | 80% | 0.8 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -56 | -34.8 | -179.2 | -69.2 | -172.3 | -160 | 168.6 | 6.3 | 115.3 | R6 | R2-R6 PolarHBondContact O-N 2.96Å |
| 3 | R | 53.6 | Low | 60.8 | Low | 217 Ų | 217 | 131.2 Ų | 131.2 | 82% | 0.819 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -67.6 | -38.6 | 173.9 | -72 | -174.3 | -174.6 | 171.7 | 1.2 | 112.4 | M1 R6 K7 | M1-R3 VanDerWaalsContact C-N 3.29Å; M1-R3 PolarHBondContact O-N 3.46Å; R3-R6 PolarHBondContact O-N 2.95Å; R3-K7 WeakPolarHBondContact O-CB 3.49Å; R3-K7 PolarHBondContact O-N 3.33Å |
| 4 | L | 54.5 | Low | 61.2 | Low | 125 Ų | 125 | 126.1 Ų | 126.1 | 65% | 0.654 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -67.2 | -41.1 | 175.4 | -65 | 172 | 0 | 0 | 0 | 110.8 | M1 K7 S8 | M1-L4 WeakPolarHBondContact O-CA 3.41Å; M1-L4 WeakPolarHBondContact O-CB 3.47Å; M1-L4 PolarHBondContact O-N 3.17Å; L4-K7 PolarHBondContact O-N 2.98Å; L4-S8 WeakPolarHBondContact O-CB 3.41Å; L4-S8 PolarHBondContact O-N 3.33Å; L4-S8 PolarHBondContact O-OG 3.37Å |
| 5 | L | 58.1 | Low | 60.9 | Low | 106 Ų | 106 | 121.5 Ų | 121.5 | 56% | 0.555 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -64.1 | -41.8 | 174.9 | -72.9 | 169.5 | 0 | 0 | 0 | 112.4 | M1 S8 Q9 | M1-L5 PolarHBondContact O-N 2.97Å; L5-S8 WeakPolarHBondContact CA-OG 3.42Å; L5-S8 PolarHBondContact O-N 2.72Å; L5-S8 PolarHBondContact O-OG 2.89Å; L5-Q9 VanDerWaalsContact O-CB 3.24Å; L5-Q9 WeakPolarHBondContact O-CB 3.47Å; L5-Q9 PolarHBondContact O-N 2.83Å |
| 6 | R | 66 | Low | 61.3 | Low | 168 Ų | 168 | 120.8 Ų | 120.8 | 63% | 0.634 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -64.4 | -41.8 | 174.6 | -102.5 | -170.7 | -85.5 | 177.8 | -10.3 | 111.9 | R2 R3 Q9 I10 | R2-R6 PolarHBondContact O-N 2.96Å; R3-R6 PolarHBondContact O-N 2.95Å; R6-Q9 PolarHBondContact O-N 2.95Å; R6-I10 WeakPolarHBondContact O-CD1 3.46Å; R6-I10 VanDerWaalsContact O-CG1 3.27Å; R6-I10 WeakPolarHBondContact O-CG1 3.37Å; R6-I10 PolarHBondContact O-N 2.91Å |
| 7 | K | 69.5 | Low | 61.6 | Low | 133 Ų | 133 | 119.7 Ų | 119.7 | 58% | 0.578 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -62.1 | -49.3 | 175.8 | -163.9 | 176.2 | 179.8 | -177.5 | 0 | 110.5 | R3 L4 Q9 I10 D11 | R3-K7 WeakPolarHBondContact O-CB 3.49Å; R3-K7 PolarHBondContact O-N 3.33Å; L4-K7 PolarHBondContact O-N 2.98Å; K7-Q9 PolarHBondContact O-N 3.46Å; K7-I10 PolarHBondContact O-N 2.96Å; K7-I10 VanDerWaalsContact O-N 3.15Å; K7-D11 WeakPolarHBondContact O-CB 3.27Å; K7-D11 PolarHBondContact O-N 3.15Å; K7-D11 VanDerWaalsContact O-OD2 3.09Å |
| 8 | S | 68.1 | Low | 61.1 | Low | 59 Ų | 59 | 114.3 Ų | 114.3 | 41% | 0.413 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -61.6 | -31.7 | 177.2 | 69.5 | 0 | 0 | 0 | 0 | 113.2 | L4 L5 Y12 | L4-S8 WeakPolarHBondContact O-CB 3.41Å; L4-S8 PolarHBondContact O-N 3.33Å; L4-S8 PolarHBondContact O-OG 3.37Å; L5-S8 WeakPolarHBondContact CA-OG 3.42Å; L5-S8 PolarHBondContact O-N 2.72Å; L5-S8 PolarHBondContact O-OG 2.89Å; S8-Y12 WeakPolarHBondContact O-CB 3.41Å; S8-Y12 PolarHBondContact O-N 3.27Å |
| 9 | Q | 63 | Low | 61.1 | Low | 133 Ų | 133 | 114.3 Ų | 114.3 | 62% | 0.621 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -74.3 | -38.8 | 177.9 | -164.8 | 172.5 | -9.4 | 0 | 0 | 111.7 | L5 R6 K7 Y12 T13 | L5-Q9 VanDerWaalsContact O-CB 3.24Å; L5-Q9 WeakPolarHBondContact O-CB 3.47Å; L5-Q9 PolarHBondContact O-N 2.83Å; R6-Q9 PolarHBondContact O-N 2.95Å; K7-Q9 PolarHBondContact O-N 3.46Å; Q9-Y12 PolarHBondContact O-N 3.23Å; Q9-T13 PolarHBondContact O-N 3.02Å; Q9-T13 VanDerWaalsContact O-N 3.08Å; Q9-T13 PolarHBondContact O-OG1 3.29Å |
| 10 | I | 69.4 | Low | 61.4 | Low | 90 Ų | 90 | 113.7 Ų | 113.7 | 46% | 0.462 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -63 | -47.5 | 170.9 | -67.3 | 162.8 | 0 | 0 | 0 | 109.8 | R6 K7 Y12 T13 E14 | R6-I10 WeakPolarHBondContact O-CD1 3.46Å; R6-I10 VanDerWaalsContact O-CG1 3.27Å; R6-I10 WeakPolarHBondContact O-CG1 3.37Å; R6-I10 PolarHBondContact O-N 2.91Å; K7-I10 PolarHBondContact O-N 2.96Å; K7-I10 VanDerWaalsContact O-N 3.15Å; I10-Y12 VanDerWaalsContact C-N 3.26Å; I10-Y12 PolarHBondContact O-N 2.84Å; I10-T13 WeakPolarHBondContact CA-OG1 3.24Å; I10-T13 PolarHBondContact O-N 3.08Å; I10-T13 VanDerWaalsContact O-N 3.15Å; I10-T13 PolarHBondContact O-OG1 3.15Å; I10-E14 WeakPolarHBondContact O-CG 3.27Å; I10-E14 PolarHBondContact O-N 2.92Å |
| 11 | D | 68.1 | Low | 61.2 | Low | 31 Ų | 31 | 112.6 Ų | 112.6 | 17% | 0.166 | 52% | 0.523 | C | S | . | . | H | α-helix | trans | -57.5 | -39.9 | 176.9 | -61.1 | -28.2 | 0 | 0 | 0 | 110.9 | K7 L15 L143 | K7-D11 WeakPolarHBondContact O-CB 3.27Å; K7-D11 PolarHBondContact O-N 3.15Å; K7-D11 VanDerWaalsContact O-OD2 3.09Å; D11-L15 VanDerWaalsContact O-CG 3.27Å; D11-L15 WeakPolarHBondContact O-CG 3.48Å; D11-L15 PolarHBondContact O-N 3.16Å; D11-L15 VanDerWaalsContact O-N 3.16Å; D11-L143 HydrophobicContact CB-CD1 3.83Å; D11-L143 HydrophobicContact CB-CD2 4.31Å; D11-L143 VanDerWaalsContact OD2-CD2 3.3Å; D11-L143 WeakPolarHBondContact OD2-CD2 3.48Å |
| 12 | Y | 66.7 | Low | 61.8 | Low | 166 Ų | 166 | 110.6 Ų | 110.6 | 65% | 0.651 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -68 | -39.8 | 177.7 | -151.8 | -85.5 | 0 | 0 | 0 | 112.9 | S8 Q9 I10 L15 Q16 | S8-Y12 WeakPolarHBondContact O-CB 3.41Å; S8-Y12 PolarHBondContact O-N 3.27Å; Q9-Y12 PolarHBondContact O-N 3.23Å; I10-Y12 VanDerWaalsContact C-N 3.26Å; I10-Y12 PolarHBondContact O-N 2.84Å; Y12-L15 PolarHBondContact O-N 3.19Å; Y12-Q16 PolarHBondContact O-N 3.38Å |
| 13 | T | 64.7 | Low | 62.4 | Low | 75 Ų | 75 | 105.2 Ų | 105.2 | 46% | 0.46 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66.7 | -38.5 | 176.6 | 47.7 | 0 | 0 | 0 | 0 | 112.3 | Q9 I10 L15 Q16 E17 | Q9-T13 PolarHBondContact O-N 3.02Å; Q9-T13 VanDerWaalsContact O-N 3.08Å; Q9-T13 PolarHBondContact O-OG1 3.29Å; I10-T13 WeakPolarHBondContact CA-OG1 3.24Å; I10-T13 PolarHBondContact O-N 3.08Å; I10-T13 VanDerWaalsContact O-N 3.15Å; I10-T13 PolarHBondContact O-OG1 3.15Å; T13-L15 VanDerWaalsContact C-N 3.35Å; T13-Q16 PolarHBondContact O-N 3.38Å; T13-E17 PolarHBondContact O-N 3.28Å; T13-E17 VanDerWaalsContact O-N 3.11Å |
| 14 | E | 65.7 | Low | 62.7 | Low | 61 Ų | 61 | 99.2 Ų | 99.2 | 29% | 0.285 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.2 | -37.5 | 176.3 | -71.4 | 178.2 | 179.3 | 0 | 0 | 112 | I10 F18 | I10-E14 WeakPolarHBondContact O-CG 3.27Å; I10-E14 PolarHBondContact O-N 2.92Å; E14-F18 WeakPolarHBondContact O-CB 3.3Å; E14-F18 PolarHBondContact O-N 3.43Å |
| 15 | L | 57.1 | Low | 62.3 | Low | 57 Ų | 57 | 97.9 Ų | 97.9 | 30% | 0.298 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -63.8 | -40.9 | 175.1 | -71.2 | 169.3 | 0 | 0 | 0 | 112.3 | D11 Y12 T13 F18 E19 L146 | D11-L15 VanDerWaalsContact O-CG 3.27Å; D11-L15 WeakPolarHBondContact O-CG 3.48Å; D11-L15 PolarHBondContact O-N 3.16Å; D11-L15 VanDerWaalsContact O-N 3.16Å; Y12-L15 PolarHBondContact O-N 3.19Å; T13-L15 VanDerWaalsContact C-N 3.35Å; L15-F18 PolarHBondContact O-N 3.11Å; L15-E19 PolarHBondContact O-N 3.26Å; L15-L146 HydrophobicContact CD2-CB 4.34Å; L15-L146 HydrophobicContact CD2-CD1 3.74Å; L15-L146 HydrophobicContact CD2-CD2 4.37Å; L15-L146 HydrophobicContact CD2-CG 4.37Å |
| 16 | Q | 67.1 | Low | 61.3 | Low | 109 Ų | 109 | 100.3 Ų | 100.3 | 51% | 0.509 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -68.1 | -42.7 | -179.9 | -163 | 170.4 | -12.8 | 0 | 0 | 111.5 | Y12 T13 F18 E19 D20 | Y12-Q16 PolarHBondContact O-N 3.38Å; T13-Q16 PolarHBondContact O-N 3.38Å; Q16-F18 VanDerWaalsContact C-N 3.29Å; Q16-F18 PolarHBondContact O-N 3.02Å; Q16-E19 PolarHBondContact O-N 3.32Å; Q16-D20 PolarHBondContact O-N 2.98Å |
| 17 | E | 66.2 | Low | 60 | Low | 103 Ų | 103 | 97.9 Ų | 97.9 | 48% | 0.481 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -59.4 | -39 | 171.6 | -76.7 | -171.3 | -179.1 | 0 | 0 | 112.4 | T13 D20 L21 Y150 | T13-E17 PolarHBondContact O-N 3.28Å; T13-E17 VanDerWaalsContact O-N 3.11Å; E17-D20 PolarHBondContact O-N 3.21Å; E17-L21 WeakPolarHBondContact O-CB 3.41Å; E17-L21 WeakPolarHBondContact O-CG 3.35Å; E17-L21 PolarHBondContact O-N 3.04Å; E17-Y150 PolarHBondContact OE2-OH 3.05Å |
| 18 | F | 53.8 | Low | 58.5 | Low | 23 Ų | 23 | 98.3 Ų | 98.3 | 10% | 0.101 | 50% | 0.504 | C | S | . | . | H | α-helix | trans | -65.9 | -41 | 176.9 | -180 | -100.4 | 0 | 0 | 0 | 112.5 | E14 L15 Q16 L21 R22 Y150 | E14-F18 WeakPolarHBondContact O-CB 3.3Å; E14-F18 PolarHBondContact O-N 3.43Å; L15-F18 PolarHBondContact O-N 3.11Å; Q16-F18 VanDerWaalsContact C-N 3.29Å; Q16-F18 PolarHBondContact O-N 3.02Å; F18-L21 PolarHBondContact O-N 3.09Å; F18-R22 WeakPolarHBondContact O-CB 3.48Å; F18-R22 PolarHBondContact O-N 3.3Å; F18-Y150 HydrophobicContact CB-CD2 4.15Å; F18-Y150 HydrophobicContact CD2-CD2 4.06Å |
| 19 | E | 61.1 | Low | 56.8 | Low | 113 Ų | 113 | 100.6 Ų | 100.6 | 53% | 0.528 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -63.2 | -41.4 | 174.6 | -77.2 | -173.6 | 162.3 | 0 | 0 | 112.1 | L15 Q16 R22 S23 | L15-E19 PolarHBondContact O-N 3.26Å; Q16-E19 PolarHBondContact O-N 3.32Å; E19-R22 WeakPolarHBondContact O-CB 2.99Å; E19-R22 PolarHBondContact O-N 3.04Å; E19-S23 PolarHBondContact O-N 3.45Å |
| 20 | D | 66.4 | Low | 55.7 | Low | 103 Ų | 103 | 99.5 Ų | 99.5 | 55% | 0.551 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63.6 | -47.4 | 176.9 | -73.8 | -21.4 | 0 | 0 | 0 | 111.4 | Q16 E17 R22 S23 S24 | Q16-D20 PolarHBondContact O-N 2.98Å; E17-D20 PolarHBondContact O-N 3.21Å; D20-R22 VanDerWaalsContact C-N 3.26Å; D20-R22 PolarHBondContact O-N 3.22Å; D20-S23 PolarHBondContact O-N 2.97Å; D20-S23 PolarHBondContact O-OG 3.33Å; D20-S24 PolarHBondContact O-N 2.72Å |
| 21 | L | 57.3 | Low | 54 | Low | 91 Ų | 91 | 102 Ų | 102 | 48% | 0.476 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -58.8 | -37.8 | 173.8 | -75.4 | 166 | 0 | 0 | 0 | 111.9 | E17 F18 S24 Y150 | E17-L21 WeakPolarHBondContact O-CB 3.41Å; E17-L21 WeakPolarHBondContact O-CG 3.35Å; E17-L21 PolarHBondContact O-N 3.04Å; F18-L21 PolarHBondContact O-N 3.09Å; L21-S24 PolarHBondContact O-N 3.42Å; L21-S24 PolarHBondContact O-OG 3.19Å; L21-Y150 HydrophobicContact CD1-CE2 3.89Å |
| 22 | R | 53 | Low | 52.3 | Low | 148 Ų | 148 | 106.9 Ų | 106.9 | 56% | 0.558 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -65.7 | -40.9 | 177 | -174.9 | -176.4 | -178.3 | -161.4 | 0.7 | 112.1 | F18 E19 D20 S24 R25 | F18-R22 WeakPolarHBondContact O-CB 3.48Å; F18-R22 PolarHBondContact O-N 3.3Å; E19-R22 WeakPolarHBondContact O-CB 2.99Å; E19-R22 PolarHBondContact O-N 3.04Å; D20-R22 VanDerWaalsContact C-N 3.26Å; D20-R22 PolarHBondContact O-N 3.22Å; R22-S24 PolarHBondContact O-N 3.41Å; R22-R25 PolarHBondContact O-N 3.5Å |
| 23 | S | 60.5 | Low | 50.6 | Low | 99 Ų | 99 | 110.6 Ų | 110.6 | 69% | 0.692 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -63 | -27.6 | 179.5 | 77.7 | 0 | 0 | 0 | 0 | 113 | E19 D20 R25 | E19-S23 PolarHBondContact O-N 3.45Å; D20-S23 PolarHBondContact O-N 2.97Å; D20-S23 PolarHBondContact O-OG 3.33Å; S23-R25 VanDerWaalsContact C-N 3.34Å; S23-R25 PolarHBondContact O-N 2.99Å |
| 24 | S | 59.8 | Low | 49 | Very low | 90 Ų | 90 | 113.4 Ų | 113.4 | 63% | 0.629 | 60% | 0.597 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -79 | -3.6 | 179.9 | 70.6 | 0 | 0 | 0 | 0 | 115.8 | D20 L21 R22 | D20-S24 PolarHBondContact O-N 2.72Å; L21-S24 PolarHBondContact O-N 3.42Å; L21-S24 PolarHBondContact O-OG 3.19Å; R22-S24 PolarHBondContact O-N 3.41Å |
| 25 | R | 46.1 | Very low | 47.5 | Very low | 97 Ų | 97 | 114.4 Ų | 114.4 | 37% | 0.366 | 62% | 0.615 | S | S | . | * | P | Polyproline II helix | trans | -80.2 | 123.3 | -176.1 | -61.5 | -167.8 | -162.2 | -148.9 | 5.8 | 112.1 | R22 S23 E153 | R22-R25 PolarHBondContact O-N 3.5Å; S23-R25 VanDerWaalsContact C-N 3.34Å; S23-R25 PolarHBondContact O-N 2.99Å; R25-E153 IonicContact CZ-OE1 3.02Å; R25-E153 IonicContact CZ-OE2 3.6Å; R25-E153 IonicContact NH1-OE1 3.1Å; R25-E153 PolarHBondContact NH1-OE1 2.79Å; R25-E153 IonicContact NH1-OE2 3.75Å; R25-E153 PolarHBondContact NH1-OE2 2.85Å; R25-E153 IonicContact NH2-OE1 3.73Å; R25-E153 IonicContact NH2-OE2 2.71Å; R25-E153 PolarHBondContact NH2-OE2 3.06Å |
| 26 | L | 39 | Very low | 46.2 | Very low | 157 Ų | 157 | 117.8 Ų | 117.8 | 82% | 0.822 | 64% | 0.641 | S | S | * | * | P | Polyproline II helix | trans | -76.4 | 137.7 | 164.4 | -82.3 | 157.1 | 0 | 0 | 0 | 110.1 | L28 | L26-L28 PolarHBondContact O-N 2.99Š|
| 27 | P | 37.6 | Very low | 44.3 | Very low | 117 Ų | 117 | 117.3 Ų | 117.3 | 76% | 0.76 | 66% | 0.655 | S | S | * | * | P | Polyproline II helix | trans | -67.4 | 130.1 | 179.8 | 25.8 | -31.5 | 0 | 0 | 0 | 111.2 | ||
| 28 | L | 37 | Very low | 42.5 | Very low | 142 Ų | 142 | 121.8 Ų | 121.8 | 74% | 0.743 | 67% | 0.673 | S | S | * | * | P | Polyproline II helix | trans | -73.9 | 141.6 | 174.8 | -71.8 | 166.3 | 0 | 0 | 0 | 110.7 | L26 | L26-L28 PolarHBondContact O-N 2.99Š|
| 29 | P | 33.5 | Very low | 41.5 | Very low | 107 Ų | 107 | 126.7 Ų | 126.7 | 70% | 0.695 | 71% | 0.708 | S | S | * | * | P | Polyproline II helix | trans | -68.8 | 146.3 | -178.2 | 26 | -32.4 | 0 | 0 | 0 | 112.3 | ||
| 30 | P | 40.2 | Very low | 40 | Very low | 111 Ų | 111 | 126.5 Ų | 126.5 | 72% | 0.721 | 72% | 0.718 | S | S | * | * | S | Bend | trans | -73.3 | 137.4 | -179.5 | 31.1 | -31.5 | 0 | 0 | 0 | 109.2 | ||
| 31 | N | 33.9 | Very low | 38.2 | Very low | 141 Ų | 141 | 129.6 Ų | 129.6 | 75% | 0.754 | 74% | 0.735 | S | S | * | * | trans | 102.8 | 67.8 | 172.9 | -49.3 | -24.4 | 0 | 0 | 0 | 116.3 | ||||
| 32 | T | 31.4 | Very low | 36.8 | Very low | 134 Ų | 134 | 136.7 Ų | 136.7 | 82% | 0.822 | 76% | 0.756 | S | S | * | * | trans | -134.6 | 67.8 | 149.1 | 53 | 0 | 0 | 0 | 0 | 110 | V34 | T32-V34 PolarHBondContact O-N 3.3Š| ||
| 33 | W | 31.6 | Very low | 35.5 | Very low | 245 Ų | 245 | 139.3 Ų | 139.3 | 93% | 0.928 | 77% | 0.771 | S | S | * | * | trans | -80.1 | 92.1 | 162.8 | -68.6 | 100.8 | 0 | 0 | 0 | 108 | A35 | W33-A35 PolarHBondContact O-N 3.36Š| ||
| 34 | V | 31.6 | Very low | 33.8 | Very low | 134 Ų | 134 | 144.7 Ų | 144.7 | 81% | 0.812 | 78% | 0.782 | S | S | * | * | trans | -77.8 | 112.7 | 160.9 | 178.6 | 0 | 0 | 0 | 0 | 106.2 | T32 | T32-V34 PolarHBondContact O-N 3.3Š| ||
| 35 | A | 33.1 | Very low | 32.3 | Very low | 81 Ų | 81 | 145.5 Ų | 145.5 | 67% | 0.669 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 139.6 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111 | W33 A37 | W33-A35 PolarHBondContact O-N 3.36Å; A35-A37 PolarHBondContact O-N 3.18Å |
| 36 | P | 29.3 | Very low | 31.3 | Very low | 128 Ų | 128 | 146 Ų | 146 | 83% | 0.831 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -63 | 134.1 | -176.5 | 24 | -32 | 0 | 0 | 0 | 111.1 | K38 | P36-K38 PolarHBondContact O-N 2.72Š|
| 37 | A | 28.2 | Very low | 30.7 | Very low | 99 Ų | 99 | 147.1 Ų | 147.1 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 134.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111 | A35 | A35-A37 PolarHBondContact O-N 3.18Š|
| 38 | K | 29.1 | Very low | 30 | Very low | 197 Ų | 197 | 152.6 Ų | 152.6 | 86% | 0.857 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 138.7 | 174.7 | -80.3 | -179.5 | 175.8 | 178.5 | 0 | 110.6 | P36 S40 | P36-K38 PolarHBondContact O-N 2.72Å; K38-S40 PolarHBondContact O-N 3.33Å |
| 39 | P | 31.6 | Very low | 29.3 | Very low | 127 Ų | 127 | 153.3 Ų | 153.3 | 83% | 0.825 | 81% | 0.809 | S | S | * | * | P | Polyproline II helix | trans | -64 | 125.7 | -177.5 | 24.6 | -31.7 | 0 | 0 | 0 | 110.4 | ||
| 40 | S | 30.2 | Very low | 28.9 | Very low | 108 Ų | 108 | 153.7 Ų | 153.7 | 76% | 0.755 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -81.8 | 136.4 | 171.4 | 46.2 | 0 | 0 | 0 | 0 | 110 | K38 R42 | K38-S40 PolarHBondContact O-N 3.33Å; S40-R42 PolarHBondContact O-N 3.42Å |
| 41 | D | 27.6 | Very low | 28.2 | Very low | 169 Ų | 169 | 155.8 Ų | 155.8 | 90% | 0.904 | 82% | 0.815 | S | S | * | * | trans | -53.3 | 100.7 | -176.7 | -68.8 | -52.8 | 0 | 0 | 0 | 112.8 | K43 | D41-K43 PolarHBondContact O-N 3.28Š| ||
| 42 | R | 29 | Very low | 28.1 | Very low | 240 Ų | 240 | 154.5 Ų | 154.5 | 91% | 0.906 | 81% | 0.812 | S | S | * | * | trans | -82.9 | 115.2 | 166.1 | -87.1 | -172.6 | 179.4 | 179.4 | 0.7 | 109.6 | S40 K44 | S40-R42 PolarHBondContact O-N 3.42Å; R42-K44 PolarHBondContact O-N 2.7Å | ||
| 43 | K | 25.3 | Very low | 27.8 | Very low | 202 Ų | 202 | 153 Ų | 153 | 88% | 0.878 | 81% | 0.807 | S | S | * | * | trans | -48.8 | 126.5 | 174.1 | -73.9 | 178.6 | 175.5 | 177.7 | 0 | 111.2 | D41 S45 | D41-K43 PolarHBondContact O-N 3.28Å; K43-S45 PolarHBondContact O-N 3.32Å; K43-S45 VanDerWaalsContact O-N 3.11Å | ||
| 44 | K | 25 | Very low | 27.8 | Very low | 212 Ų | 212 | 149.4 Ų | 149.4 | 92% | 0.922 | 80% | 0.798 | S | S | * | * | trans | -54.7 | 109.2 | 169.3 | -66.3 | 176 | 178 | 179 | 0 | 109 | R42 | R42-K44 PolarHBondContact O-N 2.7Š| ||
| 45 | S | 27 | Very low | 27.5 | Very low | 108 Ų | 108 | 145.5 Ų | 145.5 | 76% | 0.755 | 79% | 0.785 | S | S | * | * | trans | -97.8 | 123.8 | 161.1 | 61 | 0 | 0 | 0 | 0 | 107.9 | K43 F47 | K43-S45 PolarHBondContact O-N 3.32Å; K43-S45 VanDerWaalsContact O-N 3.11Å; S45-F47 PolarHBondContact O-N 2.71Å | ||
| 46 | S | 25.1 | Very low | 27.4 | Very low | 107 Ų | 107 | 147.8 Ų | 147.8 | 75% | 0.748 | 79% | 0.786 | S | S | * | * | trans | -68.2 | 109.3 | 174.4 | 52.6 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 47 | F | 26.6 | Very low | 27.8 | Very low | 180 Ų | 180 | 145 Ų | 145 | 79% | 0.789 | 77% | 0.766 | S | S | * | * | trans | -124.3 | 60.6 | 167 | -145.4 | -94.1 | 0 | 0 | 0 | 108.7 | S45 H49 | S45-F47 PolarHBondContact O-N 2.71Å; F47-H49 PolarHBondContact O-N 2.91Å | ||
| 48 | W | 23.6 | Very low | 27.8 | Very low | 233 Ų | 233 | 146.1 Ų | 146.1 | 88% | 0.883 | 76% | 0.758 | S | S | * | * | trans | -80.7 | 99.6 | 157.7 | -69.5 | 100.9 | 0 | 0 | 0 | 105.8 | ||||
| 49 | H | 23 | Very low | 27.9 | Very low | 156 Ų | 156 | 141.4 Ų | 141.4 | 72% | 0.722 | 74% | 0.739 | S | S | * | * | trans | 176.7 | 81.1 | 150.5 | -89.7 | -61.3 | 0 | 0 | 0 | 107.3 | F47 | F47-H49 PolarHBondContact O-N 2.91Š| ||
| 50 | T | 25.2 | Very low | 28.1 | Very low | 115 Ų | 115 | 139.8 Ų | 139.8 | 71% | 0.706 | 72% | 0.723 | S | S | * | * | trans | -132.4 | 105.5 | 149.4 | 35.2 | 0 | 0 | 0 | 0 | 105.4 | V52 | T50-V52 PolarHBondContact O-N 3.32Š| ||
| 51 | D | 23.8 | Very low | 28.3 | Very low | 155 Ų | 155 | 140.8 Ų | 140.8 | 83% | 0.829 | 72% | 0.72 | S | S | * | * | trans | -56.5 | 90 | 167.4 | -68.4 | -47.6 | 0 | 0 | 0 | 107.8 | S53 | D51-S53 PolarHBondContact O-N 3.36Š| ||
| 52 | V | 31.9 | Very low | 28.3 | Very low | 114 Ų | 114 | 143.1 Ų | 143.1 | 69% | 0.691 | 72% | 0.716 | S | S | * | * | trans | -75.4 | 92.8 | 166.4 | -178.4 | 0 | 0 | 0 | 0 | 105.3 | T50 F54 | T50-V52 PolarHBondContact O-N 3.32Å; V52-F54 PolarHBondContact O-N 2.94Å | ||
| 53 | S | 26.5 | Very low | 28.3 | Very low | 104 Ų | 104 | 142.8 Ų | 142.8 | 73% | 0.727 | 72% | 0.715 | S | S | * | * | trans | -24.8 | 103.3 | 169 | 44.9 | 0 | 0 | 0 | 0 | 113.6 | D51 G55 | D51-S53 PolarHBondContact O-N 3.36Å; S53-G55 PolarHBondContact O-N 3.36Å | ||
| 54 | F | 31.5 | Very low | 28.6 | Very low | 169 Ų | 169 | 141.8 Ų | 141.8 | 74% | 0.741 | 71% | 0.713 | S | S | * | * | trans | -68.9 | 33.3 | 163.8 | -96.3 | -87.8 | 0 | 0 | 0 | 112.5 | V52 L56 V57 | V52-F54 PolarHBondContact O-N 2.94Å; F54-L56 PolarHBondContact O-N 3.49Å; F54-V57 HydrophobicContact CD1-CB 4.37Å; F54-V57 HydrophobicContact CD1-CG2 3.7Å; F54-V57 HydrophobicContact CE1-CG2 4.2Å; F54-V57 PolarHBondContact O-N 2.87Å | ||
| 55 | G | 25.8 | Very low | 28.8 | Very low | 52 Ų | 52 | 134.7 Ų | 134.7 | 54% | 0.536 | 70% | 0.7 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -68.5 | -12.5 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | S53 | S53-G55 PolarHBondContact O-N 3.36Š|
| 56 | L | 30.4 | Very low | 28.7 | Very low | 129 Ų | 129 | 137.5 Ų | 137.5 | 68% | 0.675 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.3 | -7.8 | 176.2 | -125.9 | 116.6 | 0 | 0 | 0 | 113.3 | F54 H59 | F54-L56 PolarHBondContact O-N 3.49Å; L56-H59 PolarHBondContact O-CE1 3.12Å; L56-H59 PolarHBondContact O-ND1 3.21Å |
| 57 | V | 36.4 | Very low | 28.8 | Very low | 68 Ų | 68 | 137.5 Ų | 137.5 | 41% | 0.412 | 70% | 0.704 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -92.2 | -29.3 | 176.3 | 175.1 | 0 | 0 | 0 | 0 | 111.6 | F54 H59 L60 | F54-V57 HydrophobicContact CD1-CB 4.37Å; F54-V57 HydrophobicContact CD1-CG2 3.7Å; F54-V57 HydrophobicContact CE1-CG2 4.2Å; F54-V57 PolarHBondContact O-N 2.87Å; V57-H59 VanDerWaalsContact C-N 3.3Å; V57-H59 PolarHBondContact O-N 2.86Å; V57-L60 PolarHBondContact O-N 3.03Å |
| 58 | D | 30 | Very low | 28.8 | Very low | 123 Ų | 123 | 137.3 Ų | 137.3 | 66% | 0.658 | 71% | 0.71 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70 | -22 | -176.3 | -75.3 | -21.1 | 0 | 0 | 0 | 114.4 | L60 | D58-L60 VanDerWaalsContact C-N 3.3Å; D58-L60 PolarHBondContact O-N 3.47Å |
| 59 | H | 29.7 | Very low | 29 | Very low | 98 Ų | 98 | 131.5 Ų | 131.5 | 45% | 0.454 | 70% | 0.7 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -77.7 | -15 | 177.4 | 75.3 | -87.3 | 0 | 0 | 0 | 113.5 | L56 V57 | L56-H59 PolarHBondContact O-CE1 3.12Å; L56-H59 PolarHBondContact O-ND1 3.21Å; V57-H59 VanDerWaalsContact C-N 3.3Å; V57-H59 PolarHBondContact O-N 2.86Å |
| 60 | L | 37.3 | Very low | 29.1 | Very low | 93 Ų | 93 | 129.6 Ų | 129.6 | 49% | 0.487 | 70% | 0.702 | S | S | . | * | G | 310 helix | trans | -76.1 | -24.3 | 177.5 | -67.9 | 167.4 | 0 | 0 | 0 | 112.4 | V57 D58 R62 F251 | V57-L60 PolarHBondContact O-N 3.03Å; D58-L60 VanDerWaalsContact C-N 3.3Å; D58-L60 PolarHBondContact O-N 3.47Å; L60-R62 PolarHBondContact O-N 3.36Å; L60-F251 HydrophobicContact CD2-CZ 3.99Å |
| 61 | N | 33.4 | Very low | 29.4 | Very low | 130 Ų | 130 | 132.1 Ų | 132.1 | 70% | 0.695 | 71% | 0.709 | S | S | * | * | G | 310 helix | trans | -87.5 | 2.4 | -172.1 | -70.5 | -23 | 0 | 0 | 0 | 115 | ||
| 62 | R | 27.9 | Very low | 29.4 | Very low | 218 Ų | 218 | 131.5 Ų | 131.5 | 82% | 0.823 | 71% | 0.706 | S | S | * | * | G | 310 helix | trans | -97 | -8 | -172 | -163.1 | 162.8 | -179.4 | 156.2 | 1.1 | 115.8 | L60 | L60-R62 PolarHBondContact O-N 3.36Š|
| 63 | W | 28.3 | Very low | 29.1 | Very low | 232 Ų | 232 | 129.4 Ų | 129.4 | 88% | 0.879 | 71% | 0.708 | S | S | * | * | S | Bend | trans | -107.9 | 3.8 | -173.1 | -74.3 | 101.9 | 0 | 0 | 0 | 116.5 | G65 | W63-G65 VanDerWaalsContact C-N 3.33Å; W63-G65 PolarHBondContact O-N 2.88Å; W63-G65 VanDerWaalsContact O-N 3.14Å |
| 64 | E | 32.5 | Very low | 29 | Very low | 182 Ų | 182 | 132 Ų | 132 | 85% | 0.85 | 71% | 0.713 | S | S | * | * | trans | -88.5 | 73.5 | 167.8 | -70.5 | -172.2 | 170.7 | 0 | 0 | 110.6 | ||||
| 65 | G | 28.3 | Very low | 28.9 | Very low | 63 Ų | 63 | 130.6 Ų | 130.6 | 65% | 0.649 | 72% | 0.718 | S | S | * | * | trans | -127.2 | 9.7 | -179.2 | 0 | 0 | 0 | 0 | 0 | 115 | W63 | W63-G65 VanDerWaalsContact C-N 3.33Å; W63-G65 PolarHBondContact O-N 2.88Å; W63-G65 VanDerWaalsContact O-N 3.14Å | ||
| 66 | L | 25.9 | Very low | 29 | Very low | 166 Ų | 166 | 133 Ų | 133 | 87% | 0.869 | 72% | 0.724 | S | S | * | * | S | Bend | trans | -108.7 | 115.5 | 173.6 | -127.6 | 82.8 | 0 | 0 | 0 | 111 | L68 | L66-L68 PolarHBondContact O-N 3.48Š|
| 67 | P | 25.9 | Very low | 28.8 | Very low | 108 Ų | 108 | 133.8 Ų | 133.8 | 70% | 0.701 | 73% | 0.729 | S | S | * | * | trans | -67.2 | 117.1 | 176.9 | 25.7 | -30.4 | 0 | 0 | 0 | 109.5 | T69 | P67-T69 PolarHBondContact O-N 3.41Š| ||
| 68 | L | 27.8 | Very low | 28.6 | Very low | 176 Ų | 176 | 136.9 Ų | 136.9 | 92% | 0.921 | 75% | 0.748 | S | S | * | * | trans | -64.7 | 98.9 | 164.9 | -67.6 | 167.4 | 0 | 0 | 0 | 107.4 | L66 | L66-L68 PolarHBondContact O-N 3.48Š| ||
| 69 | T | 27.1 | Very low | 28.7 | Very low | 111 Ų | 111 | 137.1 Ų | 137.1 | 68% | 0.681 | 75% | 0.749 | S | S | * | * | trans | -60 | 140.3 | 166.2 | 46.7 | 0 | 0 | 0 | 0 | 109 | P67 I71 | P67-T69 PolarHBondContact O-N 3.41Å; T69-I71 PolarHBondContact O-N 2.92Å | ||
| 70 | P | 25.9 | Very low | 28.8 | Very low | 115 Ų | 115 | 138.5 Ų | 138.5 | 75% | 0.747 | 76% | 0.76 | S | S | * | * | trans | -67 | 121 | -176.9 | 16.8 | -10.5 | 0 | 0 | 0 | 108.7 | D72 | P70-D72 VanDerWaalsContact C-N 3.29Å; P70-D72 PolarHBondContact O-N 3.35Å | ||
| 71 | I | 30.7 | Very low | 28.6 | Very low | 168 Ų | 168 | 141 Ų | 141 | 86% | 0.862 | 77% | 0.773 | S | S | * | * | trans | -75.3 | 93.6 | 170.5 | -64.1 | 174.9 | 0 | 0 | 0 | 106 | T69 | T69-I71 PolarHBondContact O-N 2.92Š| ||
| 72 | D | 24.7 | Very low | 28.7 | Very low | 142 Ų | 142 | 139.4 Ų | 139.4 | 76% | 0.759 | 77% | 0.77 | S | S | * | * | trans | -56 | 150.8 | 161 | -86.5 | -35.7 | 0 | 0 | 0 | 110.5 | P70 N74 | P70-D72 VanDerWaalsContact C-N 3.29Å; P70-D72 PolarHBondContact O-N 3.35Å; D72-N74 PolarHBondContact O-N 3.28Å | ||
| 73 | G | 26.1 | Very low | 28.9 | Very low | 71 Ų | 71 | 133.7 Ų | 133.7 | 73% | 0.732 | 76% | 0.759 | S | S | * | * | S | Bend | trans | -50.2 | 128.6 | -172.1 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||
| 74 | N | 24.1 | Very low | 29.2 | Very low | 159 Ų | 159 | 130.2 Ų | 130.2 | 85% | 0.85 | 76% | 0.757 | S | S | * | * | -167.7 | 97.4 | 129.7 | -108.8 | -1.7 | 0 | 0 | 0 | 106.9 | D72 P76 | D72-N74 PolarHBondContact O-N 3.28Å; N74-P76 VanDerWaalsContact O-CD 3.3Å; N74-P76 WeakPolarHBondContact O-CD 3.41Å | |||
| 75 | V | 29.3 | Very low | 29.3 | Very low | 139 Ų | 139 | 127.8 Ų | 127.8 | 84% | 0.842 | 75% | 0.754 | S | S | * | * | trans | -68.2 | 117.1 | 164.7 | 176.4 | 0 | 0 | 0 | 0 | 106 | ||||
| 76 | P | 26.8 | Very low | 29.7 | Very low | 102 Ų | 102 | 129.1 Ų | 129.1 | 66% | 0.662 | 76% | 0.76 | S | S | * | * | trans | -73.6 | 136.4 | 173.8 | -6 | 23.3 | 0 | 0 | 0 | 109.1 | N74 V78 | N74-P76 VanDerWaalsContact O-CD 3.3Å; N74-P76 WeakPolarHBondContact O-CD 3.41Å; P76-V78 PolarHBondContact O-N 2.89Å | ||
| 77 | D | 26.5 | Very low | 30 | Very low | 145 Ų | 145 | 130.1 Ų | 130.1 | 78% | 0.775 | 76% | 0.76 | S | S | * | * | trans | -43.9 | 117.3 | 173.2 | -61.9 | -51.6 | 0 | 0 | 0 | 111.7 | ||||
| 78 | V | 32.9 | Very low | 30.2 | Very low | 133 Ų | 133 | 128.5 Ų | 128.5 | 81% | 0.806 | 76% | 0.763 | S | S | * | * | trans | -108.2 | 67.6 | 159.3 | -176.4 | 0 | 0 | 0 | 0 | 106.4 | P76 D80 | P76-V78 PolarHBondContact O-N 2.89Å; V78-D80 VanDerWaalsContact C-N 3.31Å; V78-D80 PolarHBondContact O-N 3.38Å; V78-D80 VanDerWaalsContact O-N 3.15Å | ||
| 79 | D | 30.7 | Very low | 30.4 | Very low | 129 Ų | 129 | 127.8 Ų | 127.8 | 69% | 0.69 | 76% | 0.758 | S | S | * | * | trans | -62.4 | 96.4 | 150.5 | -77.5 | -36.7 | 0 | 0 | 0 | 107 | ||||
| 80 | D | 32.2 | Very low | 30.7 | Very low | 126 Ų | 126 | 130.2 Ų | 130.2 | 67% | 0.674 | 77% | 0.766 | S | S | * | * | trans | -169.4 | 30.2 | 157.3 | -96.6 | -21 | 0 | 0 | 0 | 113.1 | V78 | V78-D80 VanDerWaalsContact C-N 3.31Å; V78-D80 PolarHBondContact O-N 3.38Å; V78-D80 VanDerWaalsContact O-N 3.15Å | ||
| 81 | L | 33.9 | Very low | 31.1 | Very low | 145 Ų | 145 | 131.4 Ų | 131.4 | 76% | 0.759 | 77% | 0.766 | S | S | * | * | S | Bend | trans | -113 | -17.6 | 175.3 | -155.2 | 59.6 | 0 | 0 | 0 | 116.5 | ||
| 82 | P | 34.3 | Very low | 31.4 | Very low | 98 Ų | 98 | 129.8 Ų | 129.8 | 64% | 0.636 | 76% | 0.759 | S | S | * | * | S | Bend | trans | -82.2 | -15.8 | 170.1 | -5.7 | 23.3 | 0 | 0 | 0 | 113.5 | L84 V85 | P82-L84 PolarHBondContact O-N 3.29Å; P82-V85 PolarHBondContact O-N 2.85Å |
| 83 | T | 34 | Very low | 32.4 | Very low | 98 Ų | 98 | 126.5 Ų | 126.5 | 60% | 0.601 | 76% | 0.759 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.5 | -10.8 | -176.6 | 23.5 | 0 | 0 | 0 | 0 | 114.2 | ||
| 84 | L | 34.8 | Very low | 33.3 | Very low | 158 Ų | 158 | 131.1 Ų | 131.1 | 83% | 0.827 | 76% | 0.761 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.9 | -7.2 | 174.9 | -130.5 | 88.3 | 0 | 0 | 0 | 114.5 | P82 | P82-L84 PolarHBondContact O-N 3.29Š|
| 85 | V | 34.2 | Very low | 34.2 | Very low | 131 Ų | 131 | 130.3 Ų | 130.3 | 79% | 0.794 | 75% | 0.752 | S | S | * | * | S | Bend | trans | -95 | -11.2 | -175.9 | -177.8 | 0 | 0 | 0 | 0 | 112.3 | P82 | P82-V85 PolarHBondContact O-N 2.85Š|
| 86 | A | 35.6 | Very low | 35.4 | Very low | 92 Ų | 92 | 128.9 Ų | 128.9 | 76% | 0.76 | 74% | 0.74 | S | S | * | * | S | Bend | trans | -99.4 | -1.7 | -171.3 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||
| 87 | E | 32.2 | Very low | 37 | Very low | 187 Ų | 187 | 129.1 Ų | 129.1 | 87% | 0.874 | 74% | 0.739 | S | S | * | * | S | Bend | trans | -129.2 | 110 | -179.4 | -122.4 | 167.1 | -173 | 0 | 0 | 110.8 | ||
| 88 | G | 30.2 | Very low | 38.8 | Very low | 74 Ų | 74 | 127.1 Ų | 127.1 | 76% | 0.763 | 73% | 0.725 | S | S | * | * | trans | 117.3 | 46.9 | 165.4 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 89 | I | 32.3 | Very low | 40.6 | Very low | 160 Ų | 160 | 124 Ų | 124 | 82% | 0.821 | 71% | 0.706 | S | S | * | * | trans | -69.9 | 128.6 | 146.6 | -69.3 | 166.2 | 0 | 0 | 0 | 106.4 | ||||
| 90 | L | 33.2 | Very low | 42.7 | Very low | 162 Ų | 162 | 120.7 Ų | 120.7 | 85% | 0.848 | 69% | 0.694 | S | S | * | * | trans | 93.1 | 87.3 | 173.5 | -48.2 | 172.1 | 0 | 0 | 0 | 116.4 | ||||
| 91 | D | 35.3 | Very low | 44.7 | Very low | 141 Ų | 141 | 118.4 Ų | 118.4 | 75% | 0.754 | 68% | 0.684 | S | S | * | * | S | Bend | -177.9 | 126.9 | 116.5 | -135.7 | 11.1 | 0 | 0 | 0 | 111.6 | |||
| 92 | D | 36 | Very low | 46.7 | Very low | 134 Ų | 134 | 116.8 Ų | 116.8 | 72% | 0.717 | 67% | 0.671 | S | S | * | * | trans | 49.8 | 89.5 | 158.4 | -61.7 | -20.6 | 0 | 0 | 0 | 121.9 | E94 | D92-E94 PolarHBondContact O-N 3.44Š| ||
| 93 | G | 45.8 | Very low | 48.8 | Very low | 73 Ų | 73 | 117.5 Ų | 117.5 | 75% | 0.753 | 67% | 0.666 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.8 | 60.1 | -176.8 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||
| 94 | E | 44.3 | Very low | 50.9 | Low | 167 Ų | 167 | 118 Ų | 118 | 78% | 0.78 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -131.1 | -21.5 | 161.7 | -159.8 | 79.6 | -150.9 | 0 | 0 | 112.6 | D92 | D92-E94 PolarHBondContact O-N 3.44Š|
| 95 | H | 43.2 | Very low | 52.9 | Low | 143 Ų | 143 | 114 Ų | 114 | 66% | 0.662 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -85.9 | -17.5 | -177.6 | -91.6 | -53.5 | 0 | 0 | 0 | 115.3 | T99 | H95-T99 WeakPolarHBondContact O-CG2 3.39Å; H95-T99 PolarHBondContact O-N 2.98Å; H95-T99 PolarHBondContact O-OG1 3.07Å |
| 96 | D | 55.1 | Low | 55.1 | Low | 108 Ų | 108 | 112.4 Ų | 112.4 | 58% | 0.578 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -76.7 | -27.6 | -175.7 | -72.1 | -26.7 | 0 | 0 | 0 | 114.4 | T99 S100 | D96-T99 PolarHBondContact O-OG1 2.89Å; D96-S100 WeakPolarHBondContact O-CB 3.41Å; D96-S100 PolarHBondContact O-N 3.31Å; D96-S100 VanDerWaalsContact O-N 3.11Å |
| 97 | V | 59.8 | Low | 57 | Low | 107 Ų | 107 | 114.3 Ų | 114.3 | 65% | 0.648 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -69.6 | -43 | 177.8 | -177.6 | 0 | 0 | 0 | 0 | 110 | S100 V101 | V97-S100 PolarHBondContact O-N 3.5Å; V97-V101 HydrophobicContact CG1-CG2 4.44Å; V97-V101 VanDerWaalsContact O-CG2 3.28Å; V97-V101 WeakPolarHBondContact O-CG2 3.45Å; V97-V101 PolarHBondContact O-N 3.41Å |
| 98 | E | 65.8 | Low | 58.9 | Low | 104 Ų | 104 | 108.1 Ų | 108.1 | 49% | 0.486 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -63.7 | -42.5 | 177.6 | -82.8 | -159.5 | 179.4 | 0 | 0 | 112.7 | V101 K102 | E98-V101 PolarHBondContact O-N 3Å; E98-K102 WeakPolarHBondContact O-CB 3.37Å; E98-K102 WeakPolarHBondContact O-CD 3.35Å; E98-K102 WeakPolarHBondContact O-CG 3.45Å; E98-K102 PolarHBondContact O-N 3.01Å; E98-K102 IonicContact OE2-NZ 2.75Å; E98-K102 PolarHBondContact OE2-NZ 3.23Å |
| 99 | T | 69.2 | Low | 61.2 | Low | 67 Ų | 67 | 108.8 Ų | 108.8 | 41% | 0.411 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -67.2 | -39.2 | -179.7 | 56.6 | 0 | 0 | 0 | 0 | 111 | H95 D96 K102 Q103 | H95-T99 WeakPolarHBondContact O-CG2 3.39Å; H95-T99 PolarHBondContact O-N 2.98Å; H95-T99 PolarHBondContact O-OG1 3.07Å; D96-T99 PolarHBondContact O-OG1 2.89Å; T99-K102 PolarHBondContact O-N 3.31Å; T99-Q103 WeakPolarHBondContact O-CG 3.22Å; T99-Q103 PolarHBondContact O-N 2.84Å |
| 100 | S | 74.4 | Confident | 63.4 | Low | 60 Ų | 60 | 108.6 Ų | 108.6 | 42% | 0.42 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -65.7 | -44.3 | 175.9 | -163.8 | 0 | 0 | 0 | 0 | 112.2 | D96 V97 K102 Q103 I104 | D96-S100 WeakPolarHBondContact O-CB 3.41Å; D96-S100 PolarHBondContact O-N 3.31Å; D96-S100 VanDerWaalsContact O-N 3.11Å; V97-S100 PolarHBondContact O-N 3.5Å; S100-K102 PolarHBondContact O-N 2.98Å; S100-Q103 PolarHBondContact O-N 3.43Å; S100-I104 WeakPolarHBondContact O-CG1 3.38Å; S100-I104 PolarHBondContact O-N 2.99Å |
| 101 | V | 75.6 | Confident | 65.7 | Low | 78 Ų | 78 | 105.3 Ų | 105.3 | 47% | 0.473 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -61.8 | -44.8 | 173.9 | 174.1 | 0 | 0 | 0 | 0 | 110.8 | V97 E98 Q103 I104 V105 | V97-V101 HydrophobicContact CG1-CG2 4.44Å; V97-V101 VanDerWaalsContact O-CG2 3.28Å; V97-V101 WeakPolarHBondContact O-CG2 3.45Å; V97-V101 PolarHBondContact O-N 3.41Å; E98-V101 PolarHBondContact O-N 3Å; V101-Q103 VanDerWaalsContact C-N 3.31Å; V101-Q103 PolarHBondContact O-N 2.98Å; V101-I104 PolarHBondContact O-N 3.02Å; V101-V105 HydrophobicContact CG1-CG2 4.17Å; V101-V105 WeakPolarHBondContact O-CB 3.25Å; V101-V105 VanDerWaalsContact O-CG2 3.24Å; V101-V105 WeakPolarHBondContact O-CG2 3.46Å; V101-V105 PolarHBondContact O-N 3.45Å |
| 102 | K | 76 | Confident | 67.8 | Low | 110 Ų | 110 | 100.5 Ų | 100.5 | 48% | 0.478 | 54% | 0.542 | S | S | . | . | H | α-helix | trans | -58.1 | -42.4 | 175.6 | -74.4 | 165.8 | -169.2 | 162.4 | 0 | 111.2 | E98 T99 S100 V105 L106 | E98-K102 WeakPolarHBondContact O-CB 3.37Å; E98-K102 WeakPolarHBondContact O-CD 3.35Å; E98-K102 WeakPolarHBondContact O-CG 3.45Å; E98-K102 PolarHBondContact O-N 3.01Å; E98-K102 IonicContact OE2-NZ 2.75Å; E98-K102 PolarHBondContact OE2-NZ 3.23Å; T99-K102 PolarHBondContact O-N 3.31Å; S100-K102 PolarHBondContact O-N 2.98Å; K102-V105 PolarHBondContact O-N 3.33Å; K102-L106 VanDerWaalsContact O-CB 3.23Å; K102-L106 WeakPolarHBondContact O-CB 3.29Å; K102-L106 WeakPolarHBondContact O-CD1 3.46Å; K102-L106 WeakPolarHBondContact O-CG 3.49Å; K102-L106 PolarHBondContact O-N 3.36Å |
| 103 | Q | 77.4 | Confident | 70.1 | Confident | 114 Ų | 114 | 98.9 Ų | 98.9 | 53% | 0.533 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -66.7 | -41.5 | 177 | -74.5 | -176.4 | 6.4 | 0 | 0 | 113 | T99 S100 V101 L106 K107 | T99-Q103 WeakPolarHBondContact O-CG 3.22Å; T99-Q103 PolarHBondContact O-N 2.84Å; S100-Q103 PolarHBondContact O-N 3.43Å; V101-Q103 VanDerWaalsContact C-N 3.31Å; V101-Q103 PolarHBondContact O-N 2.98Å; Q103-L106 PolarHBondContact O-N 3.38Å; Q103-K107 WeakPolarHBondContact O-CB 2.99Å; Q103-K107 VanDerWaalsContact O-CG 3.28Å; Q103-K107 WeakPolarHBondContact O-CG 3.3Å; Q103-K107 PolarHBondContact O-N 3.32Å |
| 104 | I | 78.1 | Confident | 71.9 | Confident | 109 Ų | 109 | 98.8 Ų | 98.8 | 56% | 0.559 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -62.4 | -46.3 | 175.7 | -67.1 | 165.2 | 0 | 0 | 0 | 110 | S100 V101 K107 A108 | S100-I104 WeakPolarHBondContact O-CG1 3.38Å; S100-I104 PolarHBondContact O-N 2.99Å; V101-I104 PolarHBondContact O-N 3.02Å; I104-K107 PolarHBondContact O-N 3.43Å; I104-A108 WeakPolarHBondContact O-CB 3.42Å; I104-A108 PolarHBondContact O-N 3.41Å |
| 105 | V | 77.3 | Confident | 73.9 | Confident | 73 Ų | 73 | 92.6 Ų | 92.6 | 44% | 0.442 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -64.6 | -42.8 | 177.8 | 172.8 | 0 | 0 | 0 | 0 | 111.1 | V101 K102 K107 A108 L109 | V101-V105 HydrophobicContact CG1-CG2 4.17Å; V101-V105 WeakPolarHBondContact O-CB 3.25Å; V101-V105 VanDerWaalsContact O-CG2 3.24Å; V101-V105 WeakPolarHBondContact O-CG2 3.46Å; V101-V105 PolarHBondContact O-N 3.45Å; K102-V105 PolarHBondContact O-N 3.33Å; V105-K107 PolarHBondContact O-N 2.97Å; V105-A108 PolarHBondContact O-N 3.34Å; V105-L109 HydrophobicContact CG1-CD1 3.83Å; V105-L109 HydrophobicContact CG1-CG 4.33Å; V105-L109 VanDerWaalsContact O-CB 3.31Å; V105-L109 WeakPolarHBondContact O-CB 3.31Å; V105-L109 WeakPolarHBondContact O-CG 3.32Å; V105-L109 PolarHBondContact O-N 3.06Å |
| 106 | L | 79.8 | Confident | 76 | Confident | 97 Ų | 97 | 89.6 Ų | 89.6 | 51% | 0.508 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -64 | -38.6 | 176.6 | -79.5 | 162.2 | 0 | 0 | 0 | 112.2 | K102 Q103 K110 | K102-L106 VanDerWaalsContact O-CB 3.23Å; K102-L106 WeakPolarHBondContact O-CB 3.29Å; K102-L106 WeakPolarHBondContact O-CD1 3.46Å; K102-L106 WeakPolarHBondContact O-CG 3.49Å; K102-L106 PolarHBondContact O-N 3.36Å; Q103-L106 PolarHBondContact O-N 3.38Å; L106-K110 WeakPolarHBondContact O-CB 3.34Å; L106-K110 VanDerWaalsContact O-CG 3.28Å; L106-K110 WeakPolarHBondContact O-CG 3.46Å; L106-K110 PolarHBondContact O-N 2.86Å |
| 107 | K | 75.9 | Confident | 77.7 | Confident | 133 Ų | 133 | 89.8 Ų | 89.8 | 58% | 0.578 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -65.9 | -45.2 | 174 | -73.8 | 173.8 | -176.8 | 177.2 | 0 | 111.1 | Q103 I104 V105 K110 I111 | Q103-K107 WeakPolarHBondContact O-CB 2.99Å; Q103-K107 VanDerWaalsContact O-CG 3.28Å; Q103-K107 WeakPolarHBondContact O-CG 3.3Å; Q103-K107 PolarHBondContact O-N 3.32Å; I104-K107 PolarHBondContact O-N 3.43Å; V105-K107 PolarHBondContact O-N 2.97Å; K107-K110 PolarHBondContact O-N 2.92Å; K107-I111 WeakPolarHBondContact O-CG1 3.41Å; K107-I111 PolarHBondContact O-N 3.13Å |
| 108 | A | 72.7 | Confident | 79.2 | Confident | 56 Ų | 56 | 86.7 Ų | 86.7 | 46% | 0.463 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -62.9 | -41.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | I104 V105 I111 C112 | I104-A108 WeakPolarHBondContact O-CB 3.42Å; I104-A108 PolarHBondContact O-N 3.41Å; V105-A108 PolarHBondContact O-N 3.34Å; A108-I111 PolarHBondContact O-N 2.95Å; A108-C112 WeakPolarHBondContact O-CB 3.39Å; A108-C112 PolarHBondContact O-N 3.39Å |
| 109 | L | 78.2 | Confident | 80.4 | Confident | 89 Ų | 89 | 83.5 Ų | 83.5 | 47% | 0.466 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -61.1 | -46.2 | 174.3 | -81.3 | 167.5 | 0 | 0 | 0 | 111.3 | V105 I111 C112 I113 | V105-L109 HydrophobicContact CG1-CD1 3.83Å; V105-L109 HydrophobicContact CG1-CG 4.33Å; V105-L109 VanDerWaalsContact O-CB 3.31Å; V105-L109 WeakPolarHBondContact O-CB 3.31Å; V105-L109 WeakPolarHBondContact O-CG 3.32Å; V105-L109 PolarHBondContact O-N 3.06Å; L109-I111 PolarHBondContact O-N 2.87Å; L109-C112 PolarHBondContact O-N 3.04Å; L109-C112 VanDerWaalsContact O-N 3.09Å; L109-I113 WeakPolarHBondContact O-CB 3.42Å; L109-I113 WeakPolarHBondContact O-CD1 3.26Å; L109-I113 WeakPolarHBondContact O-CG1 3.21Å; L109-I113 PolarHBondContact O-N 3.37Å |
| 110 | K | 79.3 | Confident | 81.5 | Confident | 156 Ų | 156 | 82.7 Ų | 82.7 | 68% | 0.678 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -57.6 | -35.6 | 177.6 | -78.7 | 175.9 | 179.1 | -176.5 | 0 | 113.2 | L106 K107 P114 | L106-K110 WeakPolarHBondContact O-CB 3.34Å; L106-K110 VanDerWaalsContact O-CG 3.28Å; L106-K110 WeakPolarHBondContact O-CG 3.46Å; L106-K110 PolarHBondContact O-N 2.86Å; K107-K110 PolarHBondContact O-N 2.92Å; K110-P114 VanDerWaalsContact O-CD 3.28Å; K110-P114 WeakPolarHBondContact O-CD 3.28Å |
| 111 | I | 79.7 | Confident | 82.5 | Confident | 92 Ų | 92 | 83.1 Ų | 83.1 | 47% | 0.472 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -74.9 | -39 | 176.3 | -62.5 | 165.5 | 0 | 0 | 0 | 110.9 | K107 A108 L109 P114 H115 | K107-I111 WeakPolarHBondContact O-CG1 3.41Å; K107-I111 PolarHBondContact O-N 3.13Å; A108-I111 PolarHBondContact O-N 2.95Å; L109-I111 PolarHBondContact O-N 2.87Å; I111-P114 VanDerWaalsContact O-CD 3.3Å; I111-P114 WeakPolarHBondContact O-CD 3.4Å; I111-P114 VanDerWaalsContact O-CG 3.32Å; I111-P114 WeakPolarHBondContact O-CG 3.32Å; I111-H115 PolarHBondContact O-CD2 3.3Å; I111-H115 PolarHBondContact O-NE2 2.97Å |
| 112 | C | 79.4 | Confident | 83.4 | Confident | 41 Ų | 41 | 79.4 Ų | 79.4 | 28% | 0.277 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -76.2 | -31.6 | -177.4 | -165.2 | 0 | 0 | 0 | 0 | 113.6 | A108 L109 H115 V116 | A108-C112 WeakPolarHBondContact O-CB 3.39Å; A108-C112 PolarHBondContact O-N 3.39Å; L109-C112 PolarHBondContact O-N 3.04Å; L109-C112 VanDerWaalsContact O-N 3.09Å; C112-H115 WeakPolarHBondContact O-CB 3.4Å; C112-H115 PolarHBondContact O-N 3.49Å; C112-H115 VanDerWaalsContact O-N 3.16Å; C112-V116 WeakPolarHBondContact O-CG2 3.48Å; C112-V116 PolarHBondContact O-N 2.9Å |
| 113 | I | 84.3 | Confident | 84.2 | Confident | 100 Ų | 100 | 76.8 Ų | 76.8 | 51% | 0.513 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -51 | -51 | -178.2 | -77.1 | 161.6 | 0 | 0 | 0 | 113.9 | L109 H115 V116 L117 | L109-I113 WeakPolarHBondContact O-CB 3.42Å; L109-I113 WeakPolarHBondContact O-CD1 3.26Å; L109-I113 WeakPolarHBondContact O-CG1 3.21Å; L109-I113 PolarHBondContact O-N 3.37Å; I113-H115 VanDerWaalsContact C-N 3.32Å; I113-H115 PolarHBondContact O-N 3.21Å; I113-V116 PolarHBondContact O-N 2.98Å; I113-L117 VanDerWaalsContact O-CB 3.3Å; I113-L117 WeakPolarHBondContact O-CB 3.37Å; I113-L117 PolarHBondContact O-N 3.11Å |
| 114 | P | 85.3 | Confident | 85 | Confident | 70 Ų | 70 | 74.8 Ų | 74.8 | 46% | 0.455 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -61.4 | -39.4 | 179.8 | 22.7 | -34.3 | 0 | 0 | 0 | 112.6 | K110 I111 L117 L118 | K110-P114 VanDerWaalsContact O-CD 3.28Å; K110-P114 WeakPolarHBondContact O-CD 3.28Å; I111-P114 VanDerWaalsContact O-CD 3.3Å; I111-P114 WeakPolarHBondContact O-CD 3.4Å; I111-P114 VanDerWaalsContact O-CG 3.32Å; I111-P114 WeakPolarHBondContact O-CG 3.32Å; P114-L117 PolarHBondContact O-N 3.03Å; P114-L118 WeakPolarHBondContact O-CB 3.49Å; P114-L118 PolarHBondContact O-N 3.15Å |
| 115 | H | 86 | Confident | 85.8 | Confident | 37 Ų | 37 | 71.6 Ų | 71.6 | 17% | 0.171 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -65 | -44.3 | 177.9 | -56.1 | -51.8 | 0 | 0 | 0 | 111.6 | I111 C112 I113 L118 L119 D256 F260 | I111-H115 PolarHBondContact O-CD2 3.3Å; I111-H115 PolarHBondContact O-NE2 2.97Å; C112-H115 WeakPolarHBondContact O-CB 3.4Å; C112-H115 PolarHBondContact O-N 3.49Å; C112-H115 VanDerWaalsContact O-N 3.16Å; I113-H115 VanDerWaalsContact C-N 3.32Å; I113-H115 PolarHBondContact O-N 3.21Å; H115-L118 PolarHBondContact O-N 2.89Å; H115-L119 PolarHBondContact O-N 3.12Å; H115-D256 IonicContact CE1-OD1 3.87Å; H115-D256 PolarHBondContact CE1-OD1 2.99Å; H115-D256 IonicContact CE1-OD2 3.16Å; H115-D256 IonicContact CG-OD2 2.8Å; H115-D256 IonicContact ND1-OD1 2.93Å; H115-D256 PolarHBondContact ND1-OD1 3.48Å; H115-D256 IonicContact ND1-OD2 3.02Å; H115-D256 PolarHBondContact ND1-OD2 3.21Å; H115-F260 AromaticContact CD2-CD2 3.65Å; H115-F260 AromaticContact NE2-CD2 3.84Å |
| 116 | V | 87.3 | Confident | 86.6 | Confident | 80 Ų | 80 | 68.2 Ų | 68.2 | 49% | 0.485 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -67.8 | -37.3 | 177.3 | 175.5 | 0 | 0 | 0 | 0 | 111.4 | C112 I113 L119 A120 | C112-V116 WeakPolarHBondContact O-CG2 3.48Å; C112-V116 PolarHBondContact O-N 2.9Å; I113-V116 PolarHBondContact O-N 2.98Å; V116-L119 PolarHBondContact O-N 3.1Å; V116-A120 WeakPolarHBondContact O-CB 3.47Å; V116-A120 PolarHBondContact O-N 2.73Å |
| 117 | L | 89.8 | Confident | 87.3 | Confident | 113 Ų | 113 | 65.2 Ų | 65.2 | 59% | 0.592 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -63.4 | -44.2 | 176.2 | -179.6 | 63.6 | 0 | 0 | 0 | 111.1 | I113 P114 L119 A120 V121 | I113-L117 VanDerWaalsContact O-CB 3.3Å; I113-L117 WeakPolarHBondContact O-CB 3.37Å; I113-L117 PolarHBondContact O-N 3.11Å; P114-L117 PolarHBondContact O-N 3.03Å; L117-L119 VanDerWaalsContact C-N 3.33Å; L117-L119 PolarHBondContact O-N 3.49Å; L117-A120 PolarHBondContact O-N 3.15Å; L117-V121 WeakPolarHBondContact O-CG2 3.37Å; L117-V121 PolarHBondContact O-N 3Å |
| 118 | L | 92.1 | Very high | 88.3 | Confident | 42 Ų | 42 | 64.5 Ų | 64.5 | 22% | 0.22 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -62 | -41.6 | 176.4 | -175.8 | 65.8 | 0 | 0 | 0 | 111.5 | P114 H115 V121 L122 I252 T253 D256 | P114-L118 WeakPolarHBondContact O-CB 3.49Å; P114-L118 PolarHBondContact O-N 3.15Å; H115-L118 PolarHBondContact O-N 2.89Å; L118-V121 PolarHBondContact O-N 3.38Å; L118-L122 PolarHBondContact O-N 3.49Å; L118-L122 VanDerWaalsContact O-N 3.08Å; L118-I252 HydrophobicContact CD2-CG2 4.29Å; L118-T253 HydrophobicContact CD1-CG2 3.99Å; L118-T253 HydrophobicContact CD2-CG2 4.02Å; L118-T253 HydrophobicContact CG-CG2 3.6Å; L118-D256 HydrophobicContact CD2-CB 3.8Å; L118-D256 WeakPolarHBondContact CD2-OD2 3.32Å |
| 119 | L | 91.5 | Very high | 89.3 | Confident | 36 Ų | 36 | 61.9 Ų | 61.9 | 19% | 0.188 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -61.6 | -42.9 | 173.2 | 178.4 | 62.3 | 0 | 0 | 0 | 112.1 | H115 V116 L117 V121 L122 L123 I257 V388 | H115-L119 PolarHBondContact O-N 3.12Å; V116-L119 PolarHBondContact O-N 3.1Å; L117-L119 VanDerWaalsContact C-N 3.33Å; L117-L119 PolarHBondContact O-N 3.49Å; L119-V121 VanDerWaalsContact C-N 3.32Å; L119-V121 PolarHBondContact O-N 3.46Å; L119-L122 WeakPolarHBondContact O-CB 3.32Å; L119-L122 PolarHBondContact O-N 3.27Å; L119-L123 HydrophobicContact CD1-CD1 4.45Å; L119-L123 HydrophobicContact CD1-CG 4.35Å; L119-L123 HydrophobicContact CG-CD1 4.19Å; L119-L123 WeakPolarHBondContact O-CG 3Å; L119-L123 PolarHBondContact O-N 3.45Å; L119-I257 HydrophobicContact CD1-CD1 4.28Å; L119-V388 HydrophobicContact CD1-CB 4.4Å; L119-V388 HydrophobicContact CD1-CG1 3.5Å; L119-V388 VanDerWaalsContact CD1-CG1 3.5Å |
| 120 | A | 92.2 | Very high | 90.1 | Very high | 50 Ų | 50 | 57.6 Ų | 57.6 | 41% | 0.413 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -62.9 | -38.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | V116 L117 L123 S124 | V116-A120 WeakPolarHBondContact O-CB 3.47Å; V116-A120 PolarHBondContact O-N 2.73Å; L117-A120 PolarHBondContact O-N 3.15Å; A120-L123 PolarHBondContact O-N 3.26Å; A120-S124 WeakPolarHBondContact O-CB 3.11Å; A120-S124 PolarHBondContact O-N 2.99Å; A120-S124 PolarHBondContact O-OG 3.3Å |
| 121 | V | 94.2 | Very high | 90.8 | Very high | 69 Ų | 69 | 53.9 Ų | 53.9 | 42% | 0.418 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -60.6 | -47.1 | 173.5 | 171.6 | 0 | 0 | 0 | 0 | 110.5 | L117 L118 L119 S124 Y125 | L117-V121 WeakPolarHBondContact O-CG2 3.37Å; L117-V121 PolarHBondContact O-N 3Å; L118-V121 PolarHBondContact O-N 3.38Å; L119-V121 VanDerWaalsContact C-N 3.32Å; L119-V121 PolarHBondContact O-N 3.46Å; V121-S124 PolarHBondContact O-N 3.46Å; V121-S124 PolarHBondContact O-OG 3.32Å; V121-Y125 WeakPolarHBondContact O-CB 2.99Å; V121-Y125 PolarHBondContact O-N 2.84Å |
| 122 | L | 94.2 | Very high | 91.6 | Very high | 0 Ų | 0 | 51.2 Ų | 51.2 | 0% | 0 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -59.8 | -48.4 | 176.7 | -179.9 | 74.7 | 0 | 0 | 0 | 112.1 | L118 L119 S124 Y125 I126 L220 L249 M250 T253 V388 | L118-L122 PolarHBondContact O-N 3.49Å; L118-L122 VanDerWaalsContact O-N 3.08Å; L119-L122 WeakPolarHBondContact O-CB 3.32Å; L119-L122 PolarHBondContact O-N 3.27Å; L122-S124 VanDerWaalsContact C-N 3.3Å; L122-S124 PolarHBondContact O-N 3.26Å; L122-Y125 WeakPolarHBondContact O-CB 3.42Å; L122-Y125 PolarHBondContact O-N 3.47Å; L122-Y125 VanDerWaalsContact O-N 3.11Å; L122-I126 HydrophobicContact CG-CD1 4.19Å; L122-I126 WeakPolarHBondContact O-CG1 3.4Å; L122-I126 PolarHBondContact O-N 2.94Å; L122-L220 HydrophobicContact CD1-CD2 3.87Å; L122-L249 HydrophobicContact CD1-CD2 4.18Å; L122-L249 HydrophobicContact CD1-CG 4.07Å; L122-M250 HydrophobicContact CD1-CB 4.35Å; L122-M250 HydrophobicContact CD1-SD 4.19Å; L122-M250 HydrophobicContact CD2-CE 4.31Å; L122-M250 HydrophobicContact CD2-SD 3.79Å; L122-T253 HydrophobicContact CB-CG2 3.94Å; L122-T253 HydrophobicContact CD1-CG2 4.36Å; L122-T253 HydrophobicContact CD2-CG2 4.24Å; L122-T253 HydrophobicContact CG-CG2 4.41Å; L122-V388 HydrophobicContact CD2-CB 4.49Å; L122-V388 HydrophobicContact CD2-CG1 3.74Å; L122-V388 HydrophobicContact CD2-CG2 3.83Å |
| 123 | L | 93.2 | Very high | 92.2 | Very high | 55 Ų | 55 | 49.2 Ų | 49.2 | 29% | 0.288 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -61.2 | -40.4 | 179.1 | -69.1 | 174.4 | 0 | 0 | 0 | 111.7 | L119 A120 Y125 I126 A127 V384 | L119-L123 HydrophobicContact CD1-CD1 4.45Å; L119-L123 HydrophobicContact CD1-CG 4.35Å; L119-L123 HydrophobicContact CG-CD1 4.19Å; L119-L123 WeakPolarHBondContact O-CG 3Å; L119-L123 PolarHBondContact O-N 3.45Å; A120-L123 PolarHBondContact O-N 3.26Å; L123-Y125 VanDerWaalsContact C-N 3.31Å; L123-Y125 PolarHBondContact O-N 3.3Å; L123-I126 PolarHBondContact O-N 2.88Å; L123-A127 PolarHBondContact O-N 3.36Å; L123-V384 HydrophobicContact CD2-CG1 3.48Å; L123-V384 VanDerWaalsContact CD2-CG1 3.48Å |
| 124 | S | 94 | Very high | 92.6 | Very high | 73 Ų | 73 | 46.9 Ų | 46.9 | 51% | 0.51 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -64.9 | -35.9 | 175.4 | 77.2 | 0 | 0 | 0 | 0 | 112.3 | A120 V121 L122 A127 F128 | A120-S124 WeakPolarHBondContact O-CB 3.11Å; A120-S124 PolarHBondContact O-N 2.99Å; A120-S124 PolarHBondContact O-OG 3.3Å; V121-S124 PolarHBondContact O-N 3.46Å; V121-S124 PolarHBondContact O-OG 3.32Å; L122-S124 VanDerWaalsContact C-N 3.3Å; L122-S124 PolarHBondContact O-N 3.26Å; S124-A127 PolarHBondContact O-N 2.63Å; S124-F128 WeakPolarHBondContact O-CB 3.38Å; S124-F128 PolarHBondContact O-N 3.48Å |
| 125 | Y | 95.7 | Very high | 92.9 | Very high | 41 Ų | 41 | 53.8 Ų | 53.8 | 16% | 0.161 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -69.4 | -41 | 177.4 | -175.5 | -99.7 | 0 | 0 | 0 | 112.1 | V121 L122 L123 F128 G129 L220 F242 V245 G246 L249 | V121-Y125 WeakPolarHBondContact O-CB 2.99Å; V121-Y125 PolarHBondContact O-N 2.84Å; L122-Y125 WeakPolarHBondContact O-CB 3.42Å; L122-Y125 PolarHBondContact O-N 3.47Å; L122-Y125 VanDerWaalsContact O-N 3.11Å; L123-Y125 VanDerWaalsContact C-N 3.31Å; L123-Y125 PolarHBondContact O-N 3.3Å; Y125-F128 PolarHBondContact O-N 3.11Å; Y125-G129 PolarHBondContact O-N 2.97Å; Y125-L220 HydrophobicContact CD1-CD2 3.84Å; Y125-L220 HydrophobicContact CE1-CD1 4.28Å; Y125-L220 HydrophobicContact CE1-CD2 4.05Å; Y125-F242 HydrophobicContact CD1-CD2 4.43Å; Y125-F242 AromaticContact CD1-CE2 3.54Å; Y125-F242 HydrophobicContact CD1-CE2 3.54Å; Y125-F242 AromaticContact CD1-CZ 3.78Å; Y125-F242 HydrophobicContact CD1-CZ 3.78Å; Y125-F242 HydrophobicContact CD2-CE2 4.37Å; Y125-F242 AromaticContact CE1-CD2 3.56Å; Y125-F242 HydrophobicContact CE1-CD2 3.56Å; Y125-F242 HydrophobicContact CE1-CE1 4.27Å; Y125-F242 AromaticContact CE1-CE2 3.05Å; Y125-F242 HydrophobicContact CE1-CE2 3.05Å; Y125-F242 HydrophobicContact CE1-CG 4.32Å; Y125-F242 AromaticContact CE1-CZ 3.47Å; Y125-F242 HydrophobicContact CE1-CZ 3.47Å; Y125-F242 VanDerWaalsContact CE1-CZ 3.47Å; Y125-F242 HydrophobicContact CE2-CD2 4.14Å; Y125-F242 AromaticContact CE2-CE2 3.97Å; Y125-F242 HydrophobicContact CE2-CE2 3.97Å; Y125-F242 HydrophobicContact CG-CE2 4.18Å; Y125-F242 AromaticContact CZ-CD2 3.37Å; Y125-F242 AromaticContact CZ-CE2 3.3Å; Y125-F242 WeakPolarHBondContact O-CE2 3.44Å; Y125-F242 WeakPolarHBondContact OH-CD2 3.36Å; Y125-F242 PolarHBondContact OH-O 3.47Å; Y125-V245 HydrophobicContact CE2-CG1 4.48Å; Y125-G246 VanDerWaalsContact CE1-CA 3.49Å; Y125-L249 HydrophobicContact CD1-CD2 4.09Å; Y125-L249 HydrophobicContact CG-CD2 3.97Å |
| 126 | I | 94.9 | Very high | 93.2 | Very high | 2 Ų | 2 | 55.1 Ų | 55.1 | 1% | 0.01 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -60.4 | -46.9 | 172.7 | -66.8 | 168.6 | 0 | 0 | 0 | 110.3 | L122 L123 F128 G129 A130 V213 A216 L217 L220 V384 | L122-I126 HydrophobicContact CG-CD1 4.19Å; L122-I126 WeakPolarHBondContact O-CG1 3.4Å; L122-I126 PolarHBondContact O-N 2.94Å; L123-I126 PolarHBondContact O-N 2.88Å; I126-F128 VanDerWaalsContact C-N 3.33Å; I126-F128 PolarHBondContact O-N 3.43Å; I126-G129 PolarHBondContact O-N 3.49Å; I126-A130 WeakPolarHBondContact O-CB 3.47Å; I126-A130 PolarHBondContact O-N 2.94Å; I126-V213 HydrophobicContact CG2-CG1 3.9Å; I126-A216 HydrophobicContact CG2-CB 3.98Å; I126-L217 HydrophobicContact CD1-CD1 4.01Å; I126-L220 HydrophobicContact CG1-CD2 4.06Å; I126-V384 HydrophobicContact CD1-CG1 4.3Å |
| 127 | A | 94.1 | Very high | 93.4 | Very high | 35 Ų | 35 | 51.3 Ų | 51.3 | 29% | 0.289 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -61.9 | -40.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112 | L123 S124 A130 V131 | L123-A127 PolarHBondContact O-N 3.36Å; S124-A127 PolarHBondContact O-N 2.63Å; A127-A130 PolarHBondContact O-N 2.97Å; A127-V131 WeakPolarHBondContact O-CG2 3.42Å; A127-V131 PolarHBondContact O-N 2.81Å |
| 128 | F | 95.4 | Very high | 93.2 | Very high | 118 Ų | 118 | 48.8 Ų | 48.8 | 52% | 0.518 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -60.3 | -49.5 | 174.9 | 172.2 | -101.9 | 0 | 0 | 0 | 111.9 | S124 Y125 I126 A130 V131 V132 F238 | S124-F128 WeakPolarHBondContact O-CB 3.38Å; S124-F128 PolarHBondContact O-N 3.48Å; Y125-F128 PolarHBondContact O-N 3.11Å; I126-F128 VanDerWaalsContact C-N 3.33Å; I126-F128 PolarHBondContact O-N 3.43Å; F128-A130 VanDerWaalsContact C-N 3.3Å; F128-A130 PolarHBondContact O-N 2.84Å; F128-V131 PolarHBondContact O-N 2.75Å; F128-V132 HydrophobicContact CD2-CG2 4.36Å; F128-V132 HydrophobicContact CE1-CG2 4.31Å; F128-V132 HydrophobicContact CE2-CG2 3.93Å; F128-V132 HydrophobicContact CZ-CG2 3.91Å; F128-V132 WeakPolarHBondContact O-CG2 3.44Å; F128-V132 PolarHBondContact O-N 2.79Å; F128-V132 VanDerWaalsContact O-N 3.1Å; F128-F238 HydrophobicContact CE1-CZ 4.45Å |
| 129 | G | 95.3 | Very high | 92.8 | Very high | 0 Ų | 0 | 49.5 Ų | 49.5 | 0% | 0 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -58.6 | -42.2 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y125 I126 V132 L133 | Y125-G129 PolarHBondContact O-N 2.97Å; I126-G129 PolarHBondContact O-N 3.49Å; G129-V132 PolarHBondContact O-N 3.28Å; G129-L133 WeakPolarHBondContact O-CB 3.46Å; G129-L133 WeakPolarHBondContact O-CG 3.44Å; G129-L133 PolarHBondContact O-N 2.71Å |
| 130 | A | 94.1 | Very high | 92.4 | Very high | 0 Ų | 0 | 50.4 Ų | 50.4 | 0% | 0 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -61.7 | -46.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | I126 A127 F128 V132 Q134 F209 A212 V213 | I126-A130 WeakPolarHBondContact O-CB 3.47Å; I126-A130 PolarHBondContact O-N 2.94Å; A127-A130 PolarHBondContact O-N 2.97Å; F128-A130 VanDerWaalsContact C-N 3.3Å; F128-A130 PolarHBondContact O-N 2.84Å; A130-V132 PolarHBondContact O-N 2.92Å; A130-Q134 WeakPolarHBondContact O-CB 3.34Å; A130-Q134 PolarHBondContact O-N 3.02Å; A130-F209 HydrophobicContact CB-CE2 4.41Å; A130-A212 HydrophobicContact CB-CB 3.87Å; A130-V213 HydrophobicContact CB-CB 4.28Å; A130-V213 HydrophobicContact CB-CG2 3.52Å |
| 131 | V | 95.1 | Very high | 91.9 | Very high | 78 Ų | 78 | 48.5 Ų | 48.5 | 47% | 0.473 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -62.7 | -43.7 | 178.6 | 171.1 | 0 | 0 | 0 | 0 | 111.4 | A127 F128 R135 F209 | A127-V131 WeakPolarHBondContact O-CG2 3.42Å; A127-V131 PolarHBondContact O-N 2.81Å; F128-V131 PolarHBondContact O-N 2.75Å; V131-R135 WeakPolarHBondContact O-CB 3.19Å; V131-R135 PolarHBondContact O-N 3.44Å; V131-F209 HydrophobicContact CG2-CD2 4.36Å; V131-F209 HydrophobicContact CG2-CE2 3.95Å |
| 132 | V | 95.4 | Very high | 91.2 | Very high | 35 Ų | 35 | 46.7 Ų | 46.7 | 21% | 0.212 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -66.9 | -48.2 | -179.2 | 175.9 | 0 | 0 | 0 | 0 | 111.2 | F128 G129 A130 R135 I136 F238 | F128-V132 HydrophobicContact CD2-CG2 4.36Å; F128-V132 HydrophobicContact CE1-CG2 4.31Å; F128-V132 HydrophobicContact CE2-CG2 3.93Å; F128-V132 HydrophobicContact CZ-CG2 3.91Å; F128-V132 WeakPolarHBondContact O-CG2 3.44Å; F128-V132 PolarHBondContact O-N 2.79Å; F128-V132 VanDerWaalsContact O-N 3.1Å; G129-V132 PolarHBondContact O-N 3.28Å; A130-V132 PolarHBondContact O-N 2.92Å; V132-R135 PolarHBondContact O-N 2.87Å; V132-R135 VanDerWaalsContact O-N 3.15Å; V132-I136 HydrophobicContact CG1-CD1 3.79Å; V132-I136 WeakPolarHBondContact O-CG1 3.19Å; V132-I136 PolarHBondContact O-N 3.44Å; V132-F238 HydrophobicContact CB-CE1 3.91Å; V132-F238 HydrophobicContact CB-CE2 4.12Å; V132-F238 HydrophobicContact CB-CZ 3.59Å; V132-F238 HydrophobicContact CG1-CD1 4.11Å; V132-F238 HydrophobicContact CG1-CD2 3.87Å; V132-F238 HydrophobicContact CG1-CE1 3.79Å; V132-F238 HydrophobicContact CG1-CE2 3.53Å; V132-F238 HydrophobicContact CG1-CG 4.15Å; V132-F238 HydrophobicContact CG1-CZ 3.48Å; V132-F238 VanDerWaalsContact CG1-CZ 3.48Å; V132-F238 HydrophobicContact CG2-CE2 4.46Å; V132-F238 HydrophobicContact CG2-CZ 4.12Å |
| 133 | L | 93.2 | Very high | 90.6 | Very high | 0 Ų | 0 | 49.1 Ų | 49.1 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -63 | -44.8 | 178.2 | -78.4 | 168.3 | 0 | 0 | 0 | 111.8 | G129 R135 I136 E137 W207 Y215 F238 | G129-L133 WeakPolarHBondContact O-CB 3.46Å; G129-L133 WeakPolarHBondContact O-CG 3.44Å; G129-L133 PolarHBondContact O-N 2.71Å; L133-R135 PolarHBondContact O-N 3.04Å; L133-I136 PolarHBondContact O-N 3.25Å; L133-E137 WeakPolarHBondContact O-CB 3.42Å; L133-E137 PolarHBondContact O-N 3.42Å; L133-W207 HydrophobicContact CB-CE3 4.23Å; L133-W207 HydrophobicContact CB-CH2 4.27Å; L133-W207 HydrophobicContact CB-CZ3 3.72Å; L133-W207 HydrophobicContact CD1-CH2 4.34Å; L133-W207 HydrophobicContact CD1-CZ3 4.22Å; L133-W207 HydrophobicContact CG-CZ3 4.49Å; L133-Y215 HydrophobicContact CD1-CD1 3.48Å; L133-Y215 VanDerWaalsContact CD1-CD1 3.48Å; L133-Y215 HydrophobicContact CD1-CE1 3.48Å; L133-Y215 VanDerWaalsContact CD1-CE1 3.48Å; L133-F238 HydrophobicContact CD1-CD1 4.47Å; L133-F238 HydrophobicContact CD1-CE1 4.4Å; L133-F238 HydrophobicContact CD2-CD1 3.71Å; L133-F238 HydrophobicContact CD2-CE1 4.34Å; L133-F238 HydrophobicContact CG-CD1 3.73Å; L133-F238 HydrophobicContact CG-CE1 3.84Å |
| 134 | Q | 92.4 | Very high | 90 | Very high | 50 Ų | 50 | 49.6 Ų | 49.6 | 23% | 0.234 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -56.2 | -42.6 | 174.3 | -177.9 | 176.6 | 26.6 | 0 | 0 | 110.7 | A130 I136 N138 W207 A212 | A130-Q134 WeakPolarHBondContact O-CB 3.34Å; A130-Q134 PolarHBondContact O-N 3.02Å; Q134-I136 PolarHBondContact O-N 2.89Å; Q134-N138 WeakPolarHBondContact O-CB 3.38Å; Q134-N138 PolarHBondContact O-N 3.45Å; Q134-N138 VanDerWaalsContact O-N 3.11Å; Q134-W207 WeakPolarHBondContact CG-O 3.47Å; Q134-W207 PolarHBondContact NE2-O 3.37Å; Q134-W207 VanDerWaalsContact NE2-O 3.16Å; Q134-A212 HydrophobicContact CB-CB 4.26Å |
| 135 | R | 91.9 | Very high | 89 | Confident | 216 Ų | 216 | 47.7 Ų | 47.7 | 82% | 0.815 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -67.4 | -37.1 | -179.1 | -171.1 | 58.4 | 176.4 | 163.3 | 1.4 | 113 | V131 V132 L133 | V131-R135 WeakPolarHBondContact O-CB 3.19Å; V131-R135 PolarHBondContact O-N 3.44Å; V132-R135 PolarHBondContact O-N 2.87Å; V132-R135 VanDerWaalsContact O-N 3.15Å; L133-R135 PolarHBondContact O-N 3.04Å |
| 136 | I | 92.1 | Very high | 88.3 | Confident | 65 Ų | 65 | 46.6 Ų | 46.6 | 33% | 0.333 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -75.4 | -46.2 | -179.7 | -66.4 | 169.5 | 0 | 0 | 0 | 111.2 | V132 L133 Q134 | V132-I136 HydrophobicContact CG1-CD1 3.79Å; V132-I136 WeakPolarHBondContact O-CG1 3.19Å; V132-I136 PolarHBondContact O-N 3.44Å; L133-I136 PolarHBondContact O-N 3.25Å; Q134-I136 PolarHBondContact O-N 2.89Å |
| 137 | E | 90.4 | Very high | 87.7 | Confident | 0 Ų | 0 | 49.9 Ų | 49.9 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -91.1 | -23.4 | -166.6 | -73.8 | -61.7 | 153.5 | 0 | 0 | 114.3 | L133 G139 T140 N141 W207 P230 V231 T232 G235 | L133-E137 WeakPolarHBondContact O-CB 3.42Å; L133-E137 PolarHBondContact O-N 3.42Å; E137-G139 VanDerWaalsContact C-N 3.34Å; E137-G139 PolarHBondContact O-N 3.22Å; E137-T140 PolarHBondContact O-N 3.38Å; E137-N141 WeakPolarHBondContact CB-ND2 3.5Å; E137-N141 WeakPolarHBondContact O-CB 3.34Å; E137-N141 PolarHBondContact O-N 2.94Å; E137-N141 PolarHBondContact O-ND2 2.83Å; E137-N141 PolarHBondContact OE2-ND2 3.49Å; E137-W207 HydrophobicContact CB-CD2 3.94Å; E137-W207 HydrophobicContact CB-CG 3.91Å; E137-W207 HydrophobicContact CB-CZ2 4.41Å; E137-W207 HydrophobicContact CG-CZ2 4.18Å; E137-P230 HydrophobicContact CG-CB 4.18Å; E137-V231 PolarHBondContact OE2-N 3.31Å; E137-T232 WeakPolarHBondContact OE1-CA 3.39Å; E137-T232 WeakPolarHBondContact OE1-CB 3.35Å; E137-T232 PolarHBondContact OE1-N 2.7Å; E137-T232 PolarHBondContact OE1-OG1 3.27Å; E137-T232 VanDerWaalsContact OE1-OG1 3.09Å; E137-T232 PolarHBondContact OE2-N 3.29Å; E137-T232 PolarHBondContact OE2-OG1 3.01Å; E137-T232 VanDerWaalsContact OE2-OG1 3.04Å; E137-G235 WeakPolarHBondContact OE1-CA 3.26Å |
| 138 | N | 86.3 | Confident | 87 | Confident | 60 Ų | 60 | 51.1 Ų | 51.1 | 32% | 0.321 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -58.1 | -43 | -172.5 | -175.2 | 27.2 | 0 | 0 | 0 | 112.8 | Q134 V142 A205 | Q134-N138 WeakPolarHBondContact O-CB 3.38Å; Q134-N138 PolarHBondContact O-N 3.45Å; Q134-N138 VanDerWaalsContact O-N 3.11Å; N138-V142 VanDerWaalsContact O-CG2 3.32Å; N138-V142 WeakPolarHBondContact O-CG2 2.89Å; N138-V142 PolarHBondContact O-N 2.8Å; N138-A205 WeakPolarHBondContact OD1-CB 3.36Å |
| 139 | G | 82.8 | Confident | 86.2 | Confident | 57 Ų | 57 | 46.1 Ų | 46.1 | 59% | 0.588 | 24% | 0.244 | S | C | * | . | H | α-helix | trans | -67.1 | -47.8 | 179 | 0 | 0 | 0 | 0 | 0 | 113.6 | E137 L143 | E137-G139 VanDerWaalsContact C-N 3.34Å; E137-G139 PolarHBondContact O-N 3.22Å; G139-L143 PolarHBondContact O-N 3.37Å |
| 140 | T | 83.9 | Confident | 85.6 | Confident | 55 Ų | 55 | 47.5 Ų | 47.5 | 34% | 0.337 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -68.7 | -36.7 | -177.5 | -55.4 | 0 | 0 | 0 | 0 | 112.3 | E137 L143 T144 T232 | E137-T140 PolarHBondContact O-N 3.38Å; T140-L143 PolarHBondContact O-N 2.69Å; T140-T144 WeakPolarHBondContact O-CB 3.39Å; T140-T144 PolarHBondContact O-N 3.11Å; T140-T144 PolarHBondContact O-OG1 2.99Å; T140-T232 PolarHBondContact OG1-OG1 3.41Å |
| 141 | N | 81.1 | Confident | 85.1 | Confident | 9 Ų | 9 | 50.2 Ų | 50.2 | 5% | 0.048 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -66.1 | -43.7 | 179.6 | -86.9 | -82.1 | 0 | 0 | 0 | 112.1 | E137 L143 T144 R145 W207 | E137-N141 WeakPolarHBondContact CB-ND2 3.5Å; E137-N141 WeakPolarHBondContact O-CB 3.34Å; E137-N141 PolarHBondContact O-N 2.94Å; E137-N141 PolarHBondContact O-ND2 2.83Å; E137-N141 PolarHBondContact OE2-ND2 3.49Å; N141-L143 VanDerWaalsContact C-N 3.3Å; N141-L143 PolarHBondContact O-N 2.77Å; N141-T144 PolarHBondContact O-N 2.92Å; N141-R145 WeakPolarHBondContact O-CB 3.27Å; N141-R145 WeakPolarHBondContact O-CG 3.15Å; N141-R145 PolarHBondContact O-N 3.16Å; N141-W207 PolarHBondContact ND2-NE1 3.43Å; N141-W207 VanDerWaalsContact ND2-NE1 3.13Å |
| 142 | V | 79.8 | Confident | 84.4 | Confident | 32 Ų | 32 | 48.2 Ų | 48.2 | 19% | 0.194 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -58.5 | -45.3 | 177.7 | 172.5 | 0 | 0 | 0 | 0 | 110.6 | N138 R145 L146 A205 | N138-V142 VanDerWaalsContact O-CG2 3.32Å; N138-V142 WeakPolarHBondContact O-CG2 2.89Å; N138-V142 PolarHBondContact O-N 2.8Å; V142-R145 PolarHBondContact O-N 2.82Å; V142-L146 HydrophobicContact CG1-CD1 3.7Å; V142-L146 WeakPolarHBondContact O-CD1 3.39Å; V142-L146 VanDerWaalsContact O-CG 3.28Å; V142-L146 WeakPolarHBondContact O-CG 3.18Å; V142-L146 PolarHBondContact O-N 2.95Å; V142-A205 HydrophobicContact CG2-CB 4.44Å |
| 143 | L | 81.5 | Confident | 83.8 | Confident | 50 Ų | 50 | 48.9 Ų | 48.9 | 26% | 0.262 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -64.4 | -47.5 | 178.6 | 178.3 | 63.1 | 0 | 0 | 0 | 112.8 | D11 G139 T140 N141 R145 L146 N147 | D11-L143 HydrophobicContact CB-CD1 3.83Å; D11-L143 HydrophobicContact CB-CD2 4.31Å; D11-L143 VanDerWaalsContact OD2-CD2 3.3Å; D11-L143 WeakPolarHBondContact OD2-CD2 3.48Å; G139-L143 PolarHBondContact O-N 3.37Å; T140-L143 PolarHBondContact O-N 2.69Å; N141-L143 VanDerWaalsContact C-N 3.3Å; N141-L143 PolarHBondContact O-N 2.77Å; L143-R145 PolarHBondContact O-N 2.9Å; L143-L146 PolarHBondContact O-N 3.34Å; L143-N147 PolarHBondContact O-N 2.91Å |
| 144 | T | 79.8 | Confident | 83.4 | Confident | 65 Ų | 65 | 54.6 Ų | 54.6 | 40% | 0.399 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -59.8 | -38.9 | -179.6 | -55.3 | 0 | 0 | 0 | 0 | 111.1 | T140 N141 R148 | T140-T144 WeakPolarHBondContact O-CB 3.39Å; T140-T144 PolarHBondContact O-N 3.11Å; T140-T144 PolarHBondContact O-OG1 2.99Å; N141-T144 PolarHBondContact O-N 2.92Å; T144-R148 WeakPolarHBondContact O-CB 3.18Å; T144-R148 PolarHBondContact O-N 3.33Å |
| 145 | R | 74.8 | Confident | 83 | Confident | 34 Ų | 34 | 54 Ų | 54 | 13% | 0.128 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -70.8 | -39.7 | 177.1 | -68.8 | 176.4 | 81.5 | -139.7 | 11.2 | 112.8 | N141 V142 L143 R148 N149 R204 E206 | N141-R145 WeakPolarHBondContact O-CB 3.27Å; N141-R145 WeakPolarHBondContact O-CG 3.15Å; N141-R145 PolarHBondContact O-N 3.16Å; V142-R145 PolarHBondContact O-N 2.82Å; L143-R145 PolarHBondContact O-N 2.9Å; R145-R148 PolarHBondContact O-N 3.31Å; R145-N149 VanDerWaalsContact O-CB 3.32Å; R145-N149 WeakPolarHBondContact O-CB 3.48Å; R145-N149 PolarHBondContact O-N 3.29Å; R145-R204 PolarHBondContact NH1-O 2.92Å; R145-E206 VanDerWaalsContact CD-CD 3.49Å; R145-E206 WeakPolarHBondContact CD-OE1 3.29Å; R145-E206 IonicContact CZ-OE1 3.13Å; R145-E206 IonicContact NE-OE1 2.62Å; R145-E206 PolarHBondContact NE-OE1 3.37Å; R145-E206 IonicContact NE-OE2 3.85Å; R145-E206 IonicContact NH2-OE1 3.84Å; R145-E206 PolarHBondContact NH2-OE1 3.19Å |
| 146 | L | 80.5 | Confident | 82.7 | Confident | 17 Ų | 17 | 49 Ų | 49 | 9% | 0.089 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -59.7 | -48.9 | 175.8 | -77.1 | 160.5 | 0 | 0 | 0 | 110.8 | L15 V142 L143 R148 N149 Y150 V202 Y203 | L15-L146 HydrophobicContact CD2-CB 4.34Å; L15-L146 HydrophobicContact CD2-CD1 3.74Å; L15-L146 HydrophobicContact CD2-CD2 4.37Å; L15-L146 HydrophobicContact CD2-CG 4.37Å; V142-L146 HydrophobicContact CG1-CD1 3.7Å; V142-L146 WeakPolarHBondContact O-CD1 3.39Å; V142-L146 VanDerWaalsContact O-CG 3.28Å; V142-L146 WeakPolarHBondContact O-CG 3.18Å; V142-L146 PolarHBondContact O-N 2.95Å; L143-L146 PolarHBondContact O-N 3.34Å; L146-R148 PolarHBondContact O-N 2.9Å; L146-N149 PolarHBondContact O-N 3.01Å; L146-Y150 WeakPolarHBondContact O-CB 3.27Å; L146-Y150 PolarHBondContact O-N 2.96Å; L146-V202 HydrophobicContact CD2-CB 4.49Å; L146-V202 HydrophobicContact CD2-CG1 3.53Å; L146-V202 HydrophobicContact CG-CG1 4.2Å; L146-Y203 HydrophobicContact CD1-CD1 4.41Å; L146-Y203 HydrophobicContact CD1-CE1 4.34Å; L146-Y203 HydrophobicContact CD2-CD1 4.22Å; L146-Y203 HydrophobicContact CD2-CE1 3.83Å |
| 147 | N | 82.9 | Confident | 82.4 | Confident | 72 Ų | 72 | 49.7 Ų | 49.7 | 39% | 0.385 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -61.1 | -45.7 | 176.5 | -175.3 | 25.4 | 0 | 0 | 0 | 111.7 | L143 N149 Y150 V151 | L143-N147 PolarHBondContact O-N 2.91Å; N147-N149 VanDerWaalsContact C-N 3.34Å; N147-N149 PolarHBondContact O-N 3.39Å; N147-Y150 PolarHBondContact O-N 2.62Å; N147-V151 WeakPolarHBondContact O-CG2 3.43Å; N147-V151 PolarHBondContact O-N 3.41Å |
| 148 | R | 78.6 | Confident | 82.3 | Confident | 60 Ų | 60 | 52.6 Ų | 52.6 | 23% | 0.226 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -60 | -42.9 | 177.1 | -173.7 | 175 | 66.2 | -172.8 | 0.9 | 112.4 | T144 R145 L146 V151 L152 E192 | T144-R148 WeakPolarHBondContact O-CB 3.18Å; T144-R148 PolarHBondContact O-N 3.33Å; R145-R148 PolarHBondContact O-N 3.31Å; L146-R148 PolarHBondContact O-N 2.9Å; R148-V151 PolarHBondContact O-N 3.18Å; R148-L152 WeakPolarHBondContact O-CB 3.47Å; R148-L152 PolarHBondContact O-N 3.32Å; R148-E192 IonicContact CZ-OE1 2.87Å; R148-E192 IonicContact CZ-OE2 3.97Å; R148-E192 IonicContact NH1-OE1 3.44Å; R148-E192 PolarHBondContact NH1-OE1 3.24Å; R148-E192 IonicContact NH1-OE2 2.81Å; R148-E192 PolarHBondContact NH1-OE2 3.44Å |
| 149 | N | 77.7 | Confident | 82.2 | Confident | 13 Ų | 13 | 51 Ų | 51 | 7% | 0.07 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -69 | -37.9 | 179.3 | -73.1 | -5.6 | 0 | 0 | 0 | 112.1 | R145 L146 N147 L152 E153 F196 V202 | R145-N149 VanDerWaalsContact O-CB 3.32Å; R145-N149 WeakPolarHBondContact O-CB 3.48Å; R145-N149 PolarHBondContact O-N 3.29Å; L146-N149 PolarHBondContact O-N 3.01Å; N147-N149 VanDerWaalsContact C-N 3.34Å; N147-N149 PolarHBondContact O-N 3.39Å; N149-L152 PolarHBondContact O-N 3.3Å; N149-E153 VanDerWaalsContact O-CB 3.31Å; N149-E153 WeakPolarHBondContact O-CB 3.35Å; N149-E153 PolarHBondContact O-N 3.38Å; N149-F196 VanDerWaalsContact ND2-CE1 3.34Å; N149-F196 WeakPolarHBondContact ND2-CE1 3.37Å; N149-F196 WeakPolarHBondContact OD1-CE1 3.31Å; N149-F196 WeakPolarHBondContact OD1-CZ 3.33Å; N149-V202 HydrophobicContact CB-CG1 4.33Å; N149-V202 WeakPolarHBondContact ND2-CG1 3.42Å |
| 150 | Y | 82.7 | Confident | 82.4 | Confident | 29 Ų | 29 | 51.3 Ų | 51.3 | 11% | 0.114 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -60 | -47.2 | 171.8 | 173.8 | -90.9 | 0 | 0 | 0 | 111 | E17 F18 L21 L146 N147 L152 E153 K154 | E17-Y150 PolarHBondContact OE2-OH 3.05Å; F18-Y150 HydrophobicContact CB-CD2 4.15Å; F18-Y150 HydrophobicContact CD2-CD2 4.06Å; L21-Y150 HydrophobicContact CD1-CE2 3.89Å; L146-Y150 WeakPolarHBondContact O-CB 3.27Å; L146-Y150 PolarHBondContact O-N 2.96Å; N147-Y150 PolarHBondContact O-N 2.62Å; Y150-L152 PolarHBondContact O-N 3.49Å; Y150-E153 PolarHBondContact O-N 3.34Å; Y150-K154 HydrophobicContact CE1-CD 3.99Å; Y150-K154 WeakPolarHBondContact O-CB 3.35Å; Y150-K154 PolarHBondContact O-N 3.26Å |
| 151 | V | 83.6 | Confident | 82.6 | Confident | 58 Ų | 58 | 53.1 Ų | 53.1 | 35% | 0.352 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -62.6 | -43 | 177.2 | 172.8 | 0 | 0 | 0 | 0 | 111.6 | N147 R148 K154 T155 | N147-V151 WeakPolarHBondContact O-CG2 3.43Å; N147-V151 PolarHBondContact O-N 3.41Å; R148-V151 PolarHBondContact O-N 3.18Å; V151-K154 PolarHBondContact O-N 3.41Å; V151-T155 VanDerWaalsContact O-CB 3.32Å; V151-T155 WeakPolarHBondContact O-CB 3.31Å; V151-T155 PolarHBondContact O-N 3.08Å; V151-T155 PolarHBondContact O-OG1 3.13Å |
| 152 | L | 81.9 | Confident | 82.8 | Confident | 36 Ų | 36 | 56.4 Ų | 56.4 | 19% | 0.188 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -63.3 | -48.5 | 178.2 | -175.5 | 68.4 | 0 | 0 | 0 | 111.4 | R148 N149 Y150 T155 F156 I187 Y191 F196 | R148-L152 WeakPolarHBondContact O-CB 3.47Å; R148-L152 PolarHBondContact O-N 3.32Å; N149-L152 PolarHBondContact O-N 3.3Å; Y150-L152 PolarHBondContact O-N 3.49Å; L152-T155 PolarHBondContact O-N 3.1Å; L152-F156 WeakPolarHBondContact O-CB 3.41Å; L152-F156 PolarHBondContact O-N 3.49Å; L152-I187 HydrophobicContact CD1-CG2 4.18Å; L152-Y191 HydrophobicContact CD2-CD2 4.25Å; L152-F196 HydrophobicContact CD2-CD2 4.42Å; L152-F196 HydrophobicContact CD2-CE2 4.48Å |
| 153 | E | 81.1 | Confident | 83 | Confident | 49 Ų | 49 | 56.1 Ų | 56.1 | 23% | 0.229 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -60.9 | -47.4 | 177 | 178.4 | 72.1 | -138 | 0 | 0 | 110.8 | R25 N149 Y150 T155 F156 Q157 | R25-E153 IonicContact CZ-OE1 3.02Å; R25-E153 IonicContact CZ-OE2 3.6Å; R25-E153 IonicContact NH1-OE1 3.1Å; R25-E153 PolarHBondContact NH1-OE1 2.79Å; R25-E153 IonicContact NH1-OE2 3.75Å; R25-E153 PolarHBondContact NH1-OE2 2.85Å; R25-E153 IonicContact NH2-OE1 3.73Å; R25-E153 IonicContact NH2-OE2 2.71Å; R25-E153 PolarHBondContact NH2-OE2 3.06Å; N149-E153 VanDerWaalsContact O-CB 3.31Å; N149-E153 WeakPolarHBondContact O-CB 3.35Å; N149-E153 PolarHBondContact O-N 3.38Å; Y150-E153 PolarHBondContact O-N 3.34Å; E153-T155 VanDerWaalsContact C-N 3.3Å; E153-T155 PolarHBondContact O-N 2.95Å; E153-F156 WeakPolarHBondContact O-CB 3.42Å; E153-F156 PolarHBondContact O-N 3.13Å; E153-Q157 HydrophobicContact CG-CG 4.42Å; E153-Q157 VanDerWaalsContact O-CG 3.29Å; E153-Q157 WeakPolarHBondContact O-CG 3.44Å; E153-Q157 PolarHBondContact O-N 3.41Å; E153-Q157 WeakPolarHBondContact OE1-CG 3.34Å; E153-Q157 PolarHBondContact OE1-NE2 3.19Å |
| 154 | K | 86.4 | Confident | 83.1 | Confident | 120 Ų | 120 | 62.1 Ų | 62.1 | 52% | 0.522 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -59.5 | -42.1 | 178 | -175 | 173.3 | -174.2 | 166.6 | 0 | 111.8 | Y150 V151 T158 | Y150-K154 HydrophobicContact CE1-CD 3.99Å; Y150-K154 WeakPolarHBondContact O-CB 3.35Å; Y150-K154 PolarHBondContact O-N 3.26Å; V151-K154 PolarHBondContact O-N 3.41Å; K154-T158 WeakPolarHBondContact O-CB 3.49Å; K154-T158 PolarHBondContact O-N 3.34Å; K154-T158 PolarHBondContact O-OG1 2.98Å |
| 155 | T | 84.3 | Confident | 83.4 | Confident | 37 Ų | 37 | 64.2 Ų | 64.2 | 23% | 0.227 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -67.8 | -41.8 | 177.5 | -54.7 | 0 | 0 | 0 | 0 | 111.2 | V151 L152 E153 T158 I159 I187 L190 | V151-T155 VanDerWaalsContact O-CB 3.32Å; V151-T155 WeakPolarHBondContact O-CB 3.31Å; V151-T155 PolarHBondContact O-N 3.08Å; V151-T155 PolarHBondContact O-OG1 3.13Å; L152-T155 PolarHBondContact O-N 3.1Å; E153-T155 VanDerWaalsContact C-N 3.3Å; E153-T155 PolarHBondContact O-N 2.95Å; T155-T158 WeakPolarHBondContact O-CB 3.48Å; T155-T158 PolarHBondContact O-N 3.44Å; T155-I159 HydrophobicContact CG2-CD1 4.09Å; T155-I159 PolarHBondContact O-N 3.29Å; T155-I187 HydrophobicContact CG2-CG1 4.15Å; T155-L190 HydrophobicContact CG2-CD1 3.85Å |
| 156 | F | 84.2 | Confident | 83.6 | Confident | 110 Ų | 110 | 63.4 Ų | 63.4 | 48% | 0.482 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -59.3 | -51.1 | 174.8 | 176.4 | -99.5 | 0 | 0 | 0 | 111.3 | L152 E153 T158 I159 V160 | L152-F156 WeakPolarHBondContact O-CB 3.41Å; L152-F156 PolarHBondContact O-N 3.49Å; E153-F156 WeakPolarHBondContact O-CB 3.42Å; E153-F156 PolarHBondContact O-N 3.13Å; F156-T158 VanDerWaalsContact C-N 3.29Å; F156-T158 PolarHBondContact O-N 2.63Å; F156-I159 PolarHBondContact O-N 2.99Å; F156-I159 VanDerWaalsContact O-N 3.11Å; F156-V160 HydrophobicContact CD1-CG2 4.21Å; F156-V160 HydrophobicContact CE1-CG2 3.78Å; F156-V160 HydrophobicContact CE2-CG2 4.15Å; F156-V160 HydrophobicContact CZ-CG2 3.76Å; F156-V160 WeakPolarHBondContact O-CG2 3.46Å; F156-V160 PolarHBondContact O-N 3.13Å |
| 157 | Q | 86.4 | Confident | 83.7 | Confident | 80 Ų | 80 | 68 Ų | 68 | 37% | 0.374 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -60.1 | -40.3 | 177 | -66.9 | -63.7 | -13.3 | 0 | 0 | 111.8 | E153 I159 V160 N161 | E153-Q157 HydrophobicContact CG-CG 4.42Å; E153-Q157 VanDerWaalsContact O-CG 3.29Å; E153-Q157 WeakPolarHBondContact O-CG 3.44Å; E153-Q157 PolarHBondContact O-N 3.41Å; E153-Q157 WeakPolarHBondContact OE1-CG 3.34Å; E153-Q157 PolarHBondContact OE1-NE2 3.19Å; Q157-I159 VanDerWaalsContact C-N 3.32Å; Q157-I159 PolarHBondContact O-N 3.1Å; Q157-V160 PolarHBondContact O-N 3.21Å; Q157-N161 WeakPolarHBondContact O-CB 3.26Å; Q157-N161 VanDerWaalsContact O-CG 3.29Å; Q157-N161 PolarHBondContact O-N 2.9Å; Q157-N161 PolarHBondContact O-ND2 3.28Å |
| 158 | T | 87.2 | Confident | 83.7 | Confident | 62 Ų | 62 | 70.2 Ų | 70.2 | 38% | 0.38 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -59.5 | -44.1 | 175.2 | -58.8 | 0 | 0 | 0 | 0 | 111.2 | K154 T155 F156 N161 Q162 | K154-T158 WeakPolarHBondContact O-CB 3.49Å; K154-T158 PolarHBondContact O-N 3.34Å; K154-T158 PolarHBondContact O-OG1 2.98Å; T155-T158 WeakPolarHBondContact O-CB 3.48Å; T155-T158 PolarHBondContact O-N 3.44Å; F156-T158 VanDerWaalsContact C-N 3.29Å; F156-T158 PolarHBondContact O-N 2.63Å; T158-N161 PolarHBondContact O-N 2.86Å; T158-Q162 HydrophobicContact CG2-CG 4.48Å; T158-Q162 WeakPolarHBondContact O-CB 3.34Å; T158-Q162 VanDerWaalsContact O-CG 3.25Å; T158-Q162 WeakPolarHBondContact O-CG 3.24Å; T158-Q162 PolarHBondContact O-N 2.88Å |
| 159 | I | 85.6 | Confident | 83.8 | Confident | 27 Ų | 27 | 76.2 Ų | 76.2 | 14% | 0.138 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -70.8 | -39.1 | 179.8 | -77.3 | 167.5 | 0 | 0 | 0 | 111.7 | T155 F156 Q157 Q162 T163 R183 I187 | T155-I159 HydrophobicContact CG2-CD1 4.09Å; T155-I159 PolarHBondContact O-N 3.29Å; F156-I159 PolarHBondContact O-N 2.99Å; F156-I159 VanDerWaalsContact O-N 3.11Å; Q157-I159 VanDerWaalsContact C-N 3.32Å; Q157-I159 PolarHBondContact O-N 3.1Å; I159-Q162 PolarHBondContact O-N 3.03Å; I159-T163 WeakPolarHBondContact O-CB 3.19Å; I159-T163 PolarHBondContact O-N 3.22Å; I159-T163 PolarHBondContact O-OG1 2.96Å; I159-R183 HydrophobicContact CD1-CB 4.24Å; I159-R183 HydrophobicContact CG1-CB 4.42Å; I159-I187 HydrophobicContact CB-CD1 4.3Å; I159-I187 HydrophobicContact CD1-CD1 3.18Å; I159-I187 HydrophobicContact CD1-CG1 3.26Å; I159-I187 HydrophobicContact CG1-CD1 4.29Å; I159-I187 HydrophobicContact CG2-CD1 4.24Å |
| 160 | V | 87 | Confident | 84 | Confident | 62 Ų | 62 | 78.8 Ų | 78.8 | 38% | 0.376 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -58.8 | -49.8 | 174 | 171.1 | 0 | 0 | 0 | 0 | 110.5 | F156 Q157 T163 W164 | F156-V160 HydrophobicContact CD1-CG2 4.21Å; F156-V160 HydrophobicContact CE1-CG2 3.78Å; F156-V160 HydrophobicContact CE2-CG2 4.15Å; F156-V160 HydrophobicContact CZ-CG2 3.76Å; F156-V160 WeakPolarHBondContact O-CG2 3.46Å; F156-V160 PolarHBondContact O-N 3.13Å; Q157-V160 PolarHBondContact O-N 3.21Å; V160-T163 PolarHBondContact O-N 3.37Å; V160-W164 WeakPolarHBondContact O-CB 3.38Å; V160-W164 PolarHBondContact O-N 3.02Å |
| 161 | N | 88.1 | Confident | 83.9 | Confident | 93 Ų | 93 | 80.1 Ų | 80.1 | 50% | 0.497 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -63.2 | -45.8 | -179.9 | -70 | -22.5 | 0 | 0 | 0 | 112.2 | Q157 T158 T163 W164 E165 | Q157-N161 WeakPolarHBondContact O-CB 3.26Å; Q157-N161 VanDerWaalsContact O-CG 3.29Å; Q157-N161 PolarHBondContact O-N 2.9Å; Q157-N161 PolarHBondContact O-ND2 3.28Å; T158-N161 PolarHBondContact O-N 2.86Å; N161-T163 VanDerWaalsContact C-N 3.34Å; N161-T163 PolarHBondContact O-N 3.06Å; N161-W164 WeakPolarHBondContact O-CB 3.4Å; N161-W164 PolarHBondContact O-N 3.34Å; N161-E165 WeakPolarHBondContact O-CG 3.48Å; N161-E165 PolarHBondContact O-N 3.29Å |
| 162 | Q | 84.3 | Confident | 84 | Confident | 78 Ų | 78 | 81.4 Ų | 81.4 | 36% | 0.364 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -64.7 | -38.4 | 177 | -73.3 | 178.8 | -0.8 | 0 | 0 | 112.5 | T158 I159 W164 E165 L166 | T158-Q162 HydrophobicContact CG2-CG 4.48Å; T158-Q162 WeakPolarHBondContact O-CB 3.34Å; T158-Q162 VanDerWaalsContact O-CG 3.25Å; T158-Q162 WeakPolarHBondContact O-CG 3.24Å; T158-Q162 PolarHBondContact O-N 2.88Å; I159-Q162 PolarHBondContact O-N 3.03Å; Q162-W164 VanDerWaalsContact C-N 3.3Å; Q162-W164 PolarHBondContact O-N 3.28Å; Q162-E165 PolarHBondContact O-N 2.85Å; Q162-L166 WeakPolarHBondContact O-CG 3.36Å; Q162-L166 PolarHBondContact O-N 3.46Å |
| 163 | T | 84.3 | Confident | 84.2 | Confident | 27 Ų | 27 | 86 Ų | 86 | 17% | 0.166 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -66 | -37.7 | 177.4 | -56.4 | 0 | 0 | 0 | 0 | 110.9 | I159 V160 N161 L166 Q167 W176 I180 | I159-T163 WeakPolarHBondContact O-CB 3.19Å; I159-T163 PolarHBondContact O-N 3.22Å; I159-T163 PolarHBondContact O-OG1 2.96Å; V160-T163 PolarHBondContact O-N 3.37Å; N161-T163 VanDerWaalsContact C-N 3.34Å; N161-T163 PolarHBondContact O-N 3.06Å; T163-L166 PolarHBondContact O-N 3.31Å; T163-Q167 PolarHBondContact O-N 3Å; T163-W176 HydrophobicContact CG2-CZ2 4.23Å; T163-I180 HydrophobicContact CG2-CD1 3.51Å; T163-I180 HydrophobicContact CG2-CG1 3.94Å |
| 164 | W | 84.5 | Confident | 84.5 | Confident | 175 Ų | 175 | 88.9 Ų | 88.9 | 66% | 0.663 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -63.5 | -42.2 | 172.7 | -175.4 | -105.7 | 0 | 0 | 0 | 112.2 | V160 N161 Q162 L166 Q167 N168 | V160-W164 WeakPolarHBondContact O-CB 3.38Å; V160-W164 PolarHBondContact O-N 3.02Å; N161-W164 WeakPolarHBondContact O-CB 3.4Å; N161-W164 PolarHBondContact O-N 3.34Å; Q162-W164 VanDerWaalsContact C-N 3.3Å; Q162-W164 PolarHBondContact O-N 3.28Å; W164-L166 PolarHBondContact O-N 2.89Å; W164-Q167 WeakPolarHBondContact O-CB 3.43Å; W164-Q167 PolarHBondContact O-N 2.81Å; W164-N168 PolarHBondContact O-N 3.38Å |
| 165 | E | 84.4 | Confident | 84.4 | Confident | 110 Ų | 110 | 88 Ų | 88 | 51% | 0.514 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -63.1 | -37.9 | 174.9 | -72.2 | 175.7 | -169.1 | 0 | 0 | 113 | N161 Q162 Q167 N168 | N161-E165 WeakPolarHBondContact O-CG 3.48Å; N161-E165 PolarHBondContact O-N 3.29Å; Q162-E165 PolarHBondContact O-N 2.85Å; E165-Q167 VanDerWaalsContact C-N 3.31Å; E165-Q167 PolarHBondContact O-N 2.84Å; E165-N168 PolarHBondContact O-N 2.9Å |
| 166 | L | 80.8 | Confident | 84.5 | Confident | 16 Ų | 16 | 89.7 Ų | 89.7 | 8% | 0.084 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -63.7 | -35.9 | 176.7 | -72.5 | 171.6 | 0 | 0 | 0 | 112.2 | Q162 T163 W164 N168 R169 E179 | Q162-L166 WeakPolarHBondContact O-CG 3.36Å; Q162-L166 PolarHBondContact O-N 3.46Å; T163-L166 PolarHBondContact O-N 3.31Å; W164-L166 PolarHBondContact O-N 2.89Å; L166-N168 VanDerWaalsContact C-N 3.28Å; L166-N168 PolarHBondContact O-N 3.45Å; L166-R169 PolarHBondContact O-N 3.26Å; L166-R169 VanDerWaalsContact O-N 3.15Å; L166-E179 HydrophobicContact CD1-CB 4.43Å; L166-E179 HydrophobicContact CD1-CG 3.66Å |
| 167 | Q | 80.5 | Confident | 84.7 | Confident | 115 Ų | 115 | 91.2 Ų | 91.2 | 54% | 0.537 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -61.8 | -38.5 | 176.4 | -176.9 | 63.5 | 12.4 | 0 | 0 | 111.6 | T163 W164 E165 R169 G170 | T163-Q167 PolarHBondContact O-N 3Å; W164-Q167 WeakPolarHBondContact O-CB 3.43Å; W164-Q167 PolarHBondContact O-N 2.81Å; E165-Q167 VanDerWaalsContact C-N 3.31Å; E165-Q167 PolarHBondContact O-N 2.84Å; Q167-R169 PolarHBondContact O-N 2.96Å; Q167-G170 PolarHBondContact O-N 3.26Å |
| 168 | N | 83.5 | Confident | 84.7 | Confident | 118 Ų | 118 | 90.6 Ų | 90.6 | 63% | 0.631 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -70.7 | -13.7 | 178.9 | -68.3 | -23.8 | 0 | 0 | 0 | 113.5 | W164 E165 L166 | W164-N168 PolarHBondContact O-N 3.38Å; E165-N168 PolarHBondContact O-N 2.9Å; L166-N168 VanDerWaalsContact C-N 3.28Å; L166-N168 PolarHBondContact O-N 3.45Å |
| 169 | R | 81.9 | Confident | 84.5 | Confident | 185 Ų | 185 | 90.6 Ų | 90.6 | 70% | 0.698 | 45% | 0.446 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85.1 | -4.7 | 177.4 | -68.3 | -178.2 | -179.1 | -173.6 | 1.1 | 114 | L166 Q167 L171 | L166-R169 PolarHBondContact O-N 3.26Å; L166-R169 VanDerWaalsContact O-N 3.15Å; Q167-R169 PolarHBondContact O-N 2.96Å; R169-L171 HydrophobicContact CB-CD1 3.51Å |
| 170 | G | 82 | Confident | 84.6 | Confident | 68 Ų | 68 | 91.3 Ų | 91.3 | 70% | 0.701 | 45% | 0.449 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 69.1 | 33.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | Q167 | Q167-G170 PolarHBondContact O-N 3.26Š|
| 171 | L | 78.9 | Confident | 84.5 | Confident | 56 Ų | 56 | 95.2 Ų | 95.2 | 29% | 0.293 | 46% | 0.458 | S | S | . | . | trans | -63.8 | 147.4 | 175.7 | -85.4 | 78.1 | 0 | 0 | 0 | 111.7 | R169 M175 W176 | R169-L171 HydrophobicContact CB-CD1 3.51Å; L171-M175 HydrophobicContact CD2-CB 4.11Å; L171-M175 HydrophobicContact CG-CE 4.42Å; L171-W176 HydrophobicContact CB-CB 4.4Å | ||
| 172 | T | 85.8 | Confident | 84.4 | Confident | 86 Ų | 86 | 96 Ų | 96 | 53% | 0.528 | 46% | 0.459 | S | S | . | . | trans | -63.7 | 146.4 | 166.5 | -46.5 | 0 | 0 | 0 | 0 | 110.4 | D174 M175 W176 | T172-D174 PolarHBondContact O-N 2.97Å; T172-D174 VanDerWaalsContact O-N 3.13Å; T172-M175 PolarHBondContact O-N 3.4Å; T172-M175 VanDerWaalsContact O-N 3.14Å; T172-W176 PolarHBondContact O-N 3.45Å | ||
| 173 | Y | 86.1 | Confident | 84.3 | Confident | 133 Ų | 133 | 94.6 Ų | 94.6 | 52% | 0.522 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -49.1 | -41.1 | -179.3 | 178.6 | -99.7 | 0 | 0 | 0 | 113.5 | W176 R177 | Y173-W176 HydrophobicContact CD2-CE3 4.38Å; Y173-W176 HydrophobicContact CE2-CE3 4.39Å; Y173-W176 HydrophobicContact CE2-CZ3 4.27Å; Y173-W176 PolarHBondContact O-N 2.95Å; Y173-R177 WeakPolarHBondContact O-CB 3.31Å; Y173-R177 PolarHBondContact O-N 3.49Å; Y173-R177 PolarHBondContact OH-NH2 3.35Å |
| 174 | D | 87.3 | Confident | 84.3 | Confident | 109 Ų | 109 | 98.1 Ų | 98.1 | 58% | 0.583 | 47% | 0.468 | S | S | * | . | H | α-helix | trans | -68.8 | -41.3 | -177.3 | -63.4 | -41.4 | 0 | 0 | 0 | 113 | T172 R177 S178 | T172-D174 PolarHBondContact O-N 2.97Å; T172-D174 VanDerWaalsContact O-N 3.13Å; D174-R177 PolarHBondContact O-N 2.78Å; D174-S178 PolarHBondContact O-N 3.43Å; D174-S178 VanDerWaalsContact O-N 3.15Å; D174-S178 PolarHBondContact O-OG 3.08Å |
| 175 | M | 86.1 | Confident | 84.2 | Confident | 100 Ų | 100 | 94 Ų | 94 | 49% | 0.493 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -68.1 | -39 | 175.5 | -64.7 | -168.8 | -64.9 | 0 | 0 | 111.4 | L171 T172 S178 E179 | L171-M175 HydrophobicContact CD2-CB 4.11Å; L171-M175 HydrophobicContact CG-CE 4.42Å; T172-M175 PolarHBondContact O-N 3.4Å; T172-M175 VanDerWaalsContact O-N 3.14Å; M175-S178 PolarHBondContact O-N 3.11Å; M175-S178 PolarHBondContact O-OG 3.24Å; M175-E179 WeakPolarHBondContact O-CB 3.45Å; M175-E179 PolarHBondContact O-N 2.96Å |
| 176 | W | 85.7 | Confident | 83.9 | Confident | 73 Ų | 73 | 93.2 Ų | 93.2 | 28% | 0.277 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -63.6 | -42.5 | 175.7 | 178.3 | 83.1 | 0 | 0 | 0 | 111.6 | T163 L171 T172 Y173 E179 I180 | T163-W176 HydrophobicContact CG2-CZ2 4.23Å; L171-W176 HydrophobicContact CB-CB 4.4Å; T172-W176 PolarHBondContact O-N 3.45Å; Y173-W176 HydrophobicContact CD2-CE3 4.38Å; Y173-W176 HydrophobicContact CE2-CE3 4.39Å; Y173-W176 HydrophobicContact CE2-CZ3 4.27Å; Y173-W176 PolarHBondContact O-N 2.95Å; W176-E179 PolarHBondContact O-N 2.72Å; W176-I180 HydrophobicContact CD2-CD1 3.62Å; W176-I180 HydrophobicContact CD2-CG1 4.49Å; W176-I180 HydrophobicContact CE3-CD1 3.97Å; W176-I180 HydrophobicContact CG-CD1 4.35Å; W176-I180 HydrophobicContact CH2-CD1 3.5Å; W176-I180 VanDerWaalsContact CH2-CD1 3.5Å; W176-I180 HydrophobicContact CZ2-CD1 3.11Å; W176-I180 HydrophobicContact CZ3-CD1 3.91Å; W176-I180 WeakPolarHBondContact O-CG1 3.24Å; W176-I180 PolarHBondContact O-N 3.32Å |
| 177 | R | 87.6 | Confident | 83.8 | Confident | 142 Ų | 142 | 93.5 Ų | 93.5 | 54% | 0.536 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -61.2 | -45.1 | 177.4 | 175.5 | -176.2 | -96.6 | -174.1 | -5.4 | 112.2 | Y173 D174 Y181 | Y173-R177 WeakPolarHBondContact O-CB 3.31Å; Y173-R177 PolarHBondContact O-N 3.49Å; Y173-R177 PolarHBondContact OH-NH2 3.35Å; D174-R177 PolarHBondContact O-N 2.78Å; R177-Y181 VanDerWaalsContact O-CB 3.31Å; R177-Y181 WeakPolarHBondContact O-CB 3.45Å; R177-Y181 PolarHBondContact O-N 3.47Å |
| 178 | S | 87.1 | Confident | 83.7 | Confident | 68 Ų | 68 | 91.4 Ų | 91.4 | 48% | 0.476 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -63.5 | -42.3 | 178.8 | 50.3 | 0 | 0 | 0 | 0 | 112.2 | D174 M175 I180 Y181 E182 | D174-S178 PolarHBondContact O-N 3.43Å; D174-S178 VanDerWaalsContact O-N 3.15Å; D174-S178 PolarHBondContact O-OG 3.08Å; M175-S178 PolarHBondContact O-N 3.11Å; M175-S178 PolarHBondContact O-OG 3.24Å; S178-I180 PolarHBondContact O-N 3.39Å; S178-Y181 PolarHBondContact O-N 3.04Å; S178-E182 PolarHBondContact O-N 3.43Å |
| 179 | E | 84 | Confident | 83 | Confident | 62 Ų | 62 | 92.8 Ų | 92.8 | 29% | 0.29 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -67.3 | -37.5 | -176.6 | -161.7 | 57.8 | -154.9 | 0 | 0 | 112 | L166 M175 W176 R183 | L166-E179 HydrophobicContact CD1-CB 4.43Å; L166-E179 HydrophobicContact CD1-CG 3.66Å; M175-E179 WeakPolarHBondContact O-CB 3.45Å; M175-E179 PolarHBondContact O-N 2.96Å; W176-E179 PolarHBondContact O-N 2.72Å; E179-R183 PolarHBondContact O-N 3.49Å; E179-R183 PolarHBondContact O-NH1 3.39Å; E179-R183 IonicContact OE1-CZ 3.8Å; E179-R183 IonicContact OE1-NH1 2.99Å; E179-R183 PolarHBondContact OE1-NH1 3.32Å; E179-R183 IonicContact OE1-NH2 2.73Å; E179-R183 PolarHBondContact OE1-NH2 2.89Å |
| 180 | I | 86.8 | Confident | 82.4 | Confident | 41 Ų | 41 | 87.6 Ų | 87.6 | 21% | 0.21 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -69.9 | -44.1 | 171.4 | -71.6 | 179.9 | 0 | 0 | 0 | 111.3 | T163 W176 S178 E182 R183 L184 | T163-I180 HydrophobicContact CG2-CD1 3.51Å; T163-I180 HydrophobicContact CG2-CG1 3.94Å; W176-I180 HydrophobicContact CD2-CD1 3.62Å; W176-I180 HydrophobicContact CD2-CG1 4.49Å; W176-I180 HydrophobicContact CE3-CD1 3.97Å; W176-I180 HydrophobicContact CG-CD1 4.35Å; W176-I180 HydrophobicContact CH2-CD1 3.5Å; W176-I180 VanDerWaalsContact CH2-CD1 3.5Å; W176-I180 HydrophobicContact CZ2-CD1 3.11Å; W176-I180 HydrophobicContact CZ3-CD1 3.91Å; W176-I180 WeakPolarHBondContact O-CG1 3.24Å; W176-I180 PolarHBondContact O-N 3.32Å; S178-I180 PolarHBondContact O-N 3.39Å; I180-E182 VanDerWaalsContact C-N 3.3Å; I180-E182 PolarHBondContact O-N 2.97Å; I180-R183 PolarHBondContact O-N 3.21Å; I180-L184 WeakPolarHBondContact O-CB 3.3Å; I180-L184 PolarHBondContact O-N 3.45Å |
| 181 | Y | 86 | Confident | 81.8 | Confident | 144 Ų | 144 | 88.5 Ų | 88.5 | 57% | 0.565 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -61 | -42.4 | -176.8 | -173.6 | -102.4 | 0 | 0 | 0 | 111.3 | R177 S178 L184 Q185 | R177-Y181 VanDerWaalsContact O-CB 3.31Å; R177-Y181 WeakPolarHBondContact O-CB 3.45Å; R177-Y181 PolarHBondContact O-N 3.47Å; S178-Y181 PolarHBondContact O-N 3.04Å; Y181-L184 PolarHBondContact O-N 3.42Å; Y181-Q185 HydrophobicContact CD1-CG 4.45Å; Y181-Q185 HydrophobicContact CE1-CG 4.2Å; Y181-Q185 WeakPolarHBondContact O-CG 3.39Å; Y181-Q185 PolarHBondContact O-N 2.92Å |
| 182 | E | 85 | Confident | 81.1 | Confident | 109 Ų | 109 | 91.1 Ų | 91.1 | 51% | 0.509 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -61.8 | -43.8 | 174 | -171.8 | 178.7 | 173.7 | 0 | 0 | 112.2 | S178 I180 L184 Q185 N186 | S178-E182 PolarHBondContact O-N 3.43Å; I180-E182 VanDerWaalsContact C-N 3.3Å; I180-E182 PolarHBondContact O-N 2.97Å; E182-L184 PolarHBondContact O-N 3.42Å; E182-Q185 WeakPolarHBondContact O-CB 3.43Å; E182-Q185 PolarHBondContact O-N 3.02Å; E182-N186 PolarHBondContact O-N 3.23Å; E182-N186 VanDerWaalsContact O-N 3.13Å |
| 183 | R | 81.8 | Confident | 79.8 | Confident | 49 Ų | 49 | 89.9 Ų | 89.9 | 19% | 0.185 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -64.9 | -39.4 | 175.4 | -80.3 | 170.6 | -176.1 | 67.4 | -5.2 | 113 | I159 E179 I180 Q185 N186 I187 | I159-R183 HydrophobicContact CD1-CB 4.24Å; I159-R183 HydrophobicContact CG1-CB 4.42Å; E179-R183 PolarHBondContact O-N 3.49Å; E179-R183 PolarHBondContact O-NH1 3.39Å; E179-R183 IonicContact OE1-CZ 3.8Å; E179-R183 IonicContact OE1-NH1 2.99Å; E179-R183 PolarHBondContact OE1-NH1 3.32Å; E179-R183 IonicContact OE1-NH2 2.73Å; E179-R183 PolarHBondContact OE1-NH2 2.89Å; I180-R183 PolarHBondContact O-N 3.21Å; R183-Q185 VanDerWaalsContact C-N 3.3Å; R183-N186 WeakPolarHBondContact O-CB 3.1Å; R183-N186 PolarHBondContact O-N 3.5Å; R183-I187 PolarHBondContact O-N 3.42Å; R183-I187 VanDerWaalsContact O-N 3.13Å |
| 184 | L | 85.2 | Confident | 78.5 | Confident | 101 Ų | 101 | 87.6 Ų | 87.6 | 53% | 0.529 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -66.9 | -36 | 177.6 | -172.1 | 65.8 | 0 | 0 | 0 | 110.9 | I180 Y181 E182 N186 I187 S188 | I180-L184 WeakPolarHBondContact O-CB 3.3Å; I180-L184 PolarHBondContact O-N 3.45Å; Y181-L184 PolarHBondContact O-N 3.42Å; E182-L184 PolarHBondContact O-N 3.42Å; L184-N186 VanDerWaalsContact C-N 3.32Å; L184-N186 PolarHBondContact O-N 3.15Å; L184-I187 HydrophobicContact CD1-CD1 4.45Å; L184-I187 PolarHBondContact O-N 3.42Å; L184-S188 PolarHBondContact O-N 3.14Å |
| 185 | Q | 82 | Confident | 76.7 | Confident | 88 Ų | 88 | 90.5 Ų | 90.5 | 41% | 0.411 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -60.6 | -41.5 | 170.9 | -75.9 | -176.3 | -22.1 | 0 | 0 | 111.5 | Y181 E182 R183 I187 S188 L189 | Y181-Q185 HydrophobicContact CD1-CG 4.45Å; Y181-Q185 HydrophobicContact CE1-CG 4.2Å; Y181-Q185 WeakPolarHBondContact O-CG 3.39Å; Y181-Q185 PolarHBondContact O-N 2.92Å; E182-Q185 WeakPolarHBondContact O-CB 3.43Å; E182-Q185 PolarHBondContact O-N 3.02Å; R183-Q185 VanDerWaalsContact C-N 3.3Å; Q185-I187 PolarHBondContact O-N 3.05Å; Q185-S188 WeakPolarHBondContact O-CB 3.43Å; Q185-S188 PolarHBondContact O-N 2.89Å; Q185-S188 VanDerWaalsContact O-N 3.1Å; Q185-S188 PolarHBondContact O-OG 3.39Å; Q185-L189 PolarHBondContact O-N 3.13Å |
| 186 | N | 78.7 | Confident | 75 | Confident | 94 Ų | 94 | 89.5 Ų | 89.5 | 50% | 0.503 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -62.6 | -39.1 | 175.6 | -68.2 | -22.5 | 0 | 0 | 0 | 112.8 | E182 R183 L184 S188 L189 | E182-N186 PolarHBondContact O-N 3.23Å; E182-N186 VanDerWaalsContact O-N 3.13Å; R183-N186 WeakPolarHBondContact O-CB 3.1Å; R183-N186 PolarHBondContact O-N 3.5Å; L184-N186 VanDerWaalsContact C-N 3.32Å; L184-N186 PolarHBondContact O-N 3.15Å; N186-S188 VanDerWaalsContact C-N 3.33Å; N186-L189 PolarHBondContact O-N 2.94Å |
| 187 | I | 79.1 | Confident | 73.2 | Confident | 23 Ų | 23 | 89.2 Ų | 89.2 | 12% | 0.118 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -63.8 | -41.2 | 172 | -67.2 | 165.9 | 0 | 0 | 0 | 110.8 | L152 T155 I159 R183 L184 Q185 L189 L190 Y191 | L152-I187 HydrophobicContact CD1-CG2 4.18Å; T155-I187 HydrophobicContact CG2-CG1 4.15Å; I159-I187 HydrophobicContact CB-CD1 4.3Å; I159-I187 HydrophobicContact CD1-CD1 3.18Å; I159-I187 HydrophobicContact CD1-CG1 3.26Å; I159-I187 HydrophobicContact CG1-CD1 4.29Å; I159-I187 HydrophobicContact CG2-CD1 4.24Å; R183-I187 PolarHBondContact O-N 3.42Å; R183-I187 VanDerWaalsContact O-N 3.13Å; L184-I187 HydrophobicContact CD1-CD1 4.45Å; L184-I187 PolarHBondContact O-N 3.42Å; Q185-I187 PolarHBondContact O-N 3.05Å; I187-L189 PolarHBondContact O-N 3.35Å; I187-L189 VanDerWaalsContact O-N 3.08Å; I187-L190 WeakPolarHBondContact O-CA 3.4Å; I187-L190 WeakPolarHBondContact O-CB 3.37Å; I187-L190 PolarHBondContact O-N 3.01Å; I187-Y191 PolarHBondContact O-N 2.87Å |
| 188 | S | 77.5 | Confident | 71.4 | Confident | 70 Ų | 70 | 90.8 Ų | 90.8 | 49% | 0.49 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -60.3 | -23 | -176.8 | 76.5 | 0 | 0 | 0 | 0 | 113 | L184 Q185 N186 Y191 | L184-S188 PolarHBondContact O-N 3.14Å; Q185-S188 WeakPolarHBondContact O-CB 3.43Å; Q185-S188 PolarHBondContact O-N 2.89Å; Q185-S188 VanDerWaalsContact O-N 3.1Å; Q185-S188 PolarHBondContact O-OG 3.39Å; N186-S188 VanDerWaalsContact C-N 3.33Å; S188-Y191 VanDerWaalsContact O-O 3.09Å |
| 189 | L | 69 | Low | 69.6 | Low | 147 Ų | 147 | 94.5 Ų | 94.5 | 77% | 0.77 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -74.7 | -31.3 | 172.5 | -63 | 174.7 | 0 | 0 | 0 | 113.3 | Q185 N186 I187 Y191 | Q185-L189 PolarHBondContact O-N 3.13Å; N186-L189 PolarHBondContact O-N 2.94Å; I187-L189 PolarHBondContact O-N 3.35Å; I187-L189 VanDerWaalsContact O-N 3.08Å; L189-Y191 VanDerWaalsContact C-N 3.35Å |
| 190 | L | 68.8 | Low | 68.1 | Low | 77 Ų | 77 | 95.8 Ų | 95.8 | 40% | 0.403 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -78.6 | -24.7 | 173.6 | -64.5 | 170.1 | 0 | 0 | 0 | 111.8 | T155 I187 | T155-L190 HydrophobicContact CG2-CD1 3.85Å; I187-L190 WeakPolarHBondContact O-CA 3.4Å; I187-L190 WeakPolarHBondContact O-CB 3.37Å; I187-L190 PolarHBondContact O-N 3.01Å |
| 191 | Y | 68.9 | Low | 66.7 | Low | 86 Ų | 86 | 97.3 Ų | 97.3 | 34% | 0.337 | 49% | 0.49 | S | S | . | . | trans | -90.5 | 105.2 | -176.7 | -170.9 | -100.3 | 0 | 0 | 0 | 111.2 | L152 I187 S188 L189 G193 R194 M195 F196 | L152-Y191 HydrophobicContact CD2-CD2 4.25Å; I187-Y191 PolarHBondContact O-N 2.87Å; S188-Y191 VanDerWaalsContact O-O 3.09Å; L189-Y191 VanDerWaalsContact C-N 3.35Å; Y191-G193 VanDerWaalsContact CD1-N 3.35Å; Y191-G193 VanDerWaalsContact CE1-CA 3.48Å; Y191-G193 PolarHBondContact O-N 2.98Å; Y191-R194 VanDerWaalsContact CZ-O 3.24Å; Y191-R194 VanDerWaalsContact OH-C 3.31Å; Y191-R194 PolarHBondContact OH-O 2.98Å; Y191-M195 WeakPolarHBondContact OH-CA 3.34Å; Y191-F196 HydrophobicContact CE2-CD2 4.28Å | ||
| 192 | E | 64.2 | Low | 65.5 | Low | 112 Ų | 112 | 92.1 Ų | 92.1 | 52% | 0.523 | 47% | 0.473 | S | S | . | . | trans | -70.4 | 22.7 | 178.3 | -74.1 | 175.1 | -152.8 | 0 | 0 | 114.9 | R148 R194 | R148-E192 IonicContact CZ-OE1 2.87Å; R148-E192 IonicContact CZ-OE2 3.97Å; R148-E192 IonicContact NH1-OE1 3.44Å; R148-E192 PolarHBondContact NH1-OE1 3.24Å; R148-E192 IonicContact NH1-OE2 2.81Å; R148-E192 PolarHBondContact NH1-OE2 3.44Å; E192-R194 PolarHBondContact O-N 3.05Å; E192-R194 VanDerWaalsContact O-N 3.1Å; E192-R194 IonicContact OE2-CZ 2.72Å; E192-R194 IonicContact OE2-NE 3.64Å; E192-R194 IonicContact OE2-NH2 3.7Å; E192-R194 PolarHBondContact OE2-NH2 3.28Å | ||
| 193 | G | 59.4 | Low | 64.2 | Low | 60 Ų | 60 | 91.5 Ų | 91.5 | 62% | 0.619 | 47% | 0.467 | S | S | * | . | S | Bend | trans | 71.7 | 3 | 175.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | Y191 | Y191-G193 VanDerWaalsContact CD1-N 3.35Å; Y191-G193 VanDerWaalsContact CE1-CA 3.48Å; Y191-G193 PolarHBondContact O-N 2.98Å |
| 194 | R | 59.1 | Low | 63.5 | Low | 85 Ų | 85 | 95.5 Ų | 95.5 | 32% | 0.321 | 48% | 0.482 | S | S | . | . | trans | -86.8 | 118.2 | 176.9 | -70.2 | -172.7 | -112.5 | -142.3 | -0 | 110.8 | Y191 E192 F196 F227 | Y191-R194 VanDerWaalsContact CZ-O 3.24Å; Y191-R194 VanDerWaalsContact OH-C 3.31Å; Y191-R194 PolarHBondContact OH-O 2.98Å; E192-R194 PolarHBondContact O-N 3.05Å; E192-R194 VanDerWaalsContact O-N 3.1Å; E192-R194 IonicContact OE2-CZ 2.72Å; E192-R194 IonicContact OE2-NE 3.64Å; E192-R194 IonicContact OE2-NH2 3.7Å; E192-R194 PolarHBondContact OE2-NH2 3.28Å; R194-F196 PolarHBondContact O-N 3.35Å; R194-F227 PolarHBondContact NH1-O 3.46Å | ||
| 195 | M | 49 | Very low | 62.8 | Low | 170 Ų | 170 | 91.9 Ų | 91.9 | 84% | 0.837 | 47% | 0.466 | S | S | * | . | trans | -61.6 | 102.4 | 179 | -155.9 | 161.9 | 177.1 | 0 | 0 | 110 | Y191 S197 | Y191-M195 WeakPolarHBondContact OH-CA 3.34Å; M195-S197 PolarHBondContact O-N 3.35Å; M195-S197 VanDerWaalsContact O-N 3.13Å | ||
| 196 | F | 49.4 | Very low | 62.6 | Low | 78 Ų | 78 | 89 Ų | 89 | 34% | 0.342 | 45% | 0.453 | S | S | . | . | trans | -71 | 102.3 | 165.6 | -84.2 | -81.6 | 0 | 0 | 0 | 107.4 | N149 L152 Y191 R194 Y198 | N149-F196 VanDerWaalsContact ND2-CE1 3.34Å; N149-F196 WeakPolarHBondContact ND2-CE1 3.37Å; N149-F196 WeakPolarHBondContact OD1-CE1 3.31Å; N149-F196 WeakPolarHBondContact OD1-CZ 3.33Å; L152-F196 HydrophobicContact CD2-CD2 4.42Å; L152-F196 HydrophobicContact CD2-CE2 4.48Å; Y191-F196 HydrophobicContact CE2-CD2 4.28Å; R194-F196 PolarHBondContact O-N 3.35Å; F196-Y198 PolarHBondContact O-N 2.93Å | ||
| 197 | S | 48.9 | Very low | 62.9 | Low | 67 Ų | 67 | 84.6 Ų | 84.6 | 47% | 0.469 | 43% | 0.429 | S | S | . | . | trans | -61.7 | 119.8 | 159 | -54.5 | 0 | 0 | 0 | 0 | 106.9 | M195 D199 Q200 | M195-S197 PolarHBondContact O-N 3.35Å; M195-S197 VanDerWaalsContact O-N 3.13Å; S197-D199 PolarHBondContact O-N 3.31Å; S197-Q200 PolarHBondContact O-N 2.89Å | ||
| 198 | Y | 49.3 | Very low | 63.2 | Low | 175 Ų | 175 | 85.8 Ų | 85.8 | 69% | 0.686 | 44% | 0.438 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -49.6 | -28.7 | 175.2 | -178.3 | -98.4 | 0 | 0 | 0 | 112.4 | F196 | F196-Y198 PolarHBondContact O-N 2.93Š|
| 199 | D | 48.9 | Very low | 63.7 | Low | 147 Ų | 147 | 86.4 Ų | 86.4 | 79% | 0.786 | 43% | 0.432 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.3 | -10.6 | -178.6 | -66.6 | -26.5 | 0 | 0 | 0 | 115.4 | S197 | S197-D199 PolarHBondContact O-N 3.31Š|
| 200 | Q | 54.4 | Low | 64.7 | Low | 88 Ų | 88 | 80.3 Ų | 80.3 | 41% | 0.411 | 40% | 0.401 | S | S | . | . | S | Bend | trans | -80.3 | 124.2 | -179.9 | -72.3 | -85.3 | -16.6 | 0 | 0 | 109.7 | S197 V202 | S197-Q200 PolarHBondContact O-N 2.89Å; Q200-V202 PolarHBondContact O-N 3.41Å; Q200-V202 VanDerWaalsContact O-N 3.11Å |
| 201 | P | 55.5 | Low | 65.5 | Low | 73 Ų | 73 | 77 Ų | 77 | 47% | 0.474 | 38% | 0.384 | S | S | . | . | trans | -62.4 | 121.9 | 176 | 25.2 | -31.7 | 0 | 0 | 0 | 108.8 | Y203 R204 | P201-Y203 PolarHBondContact O-N 2.9Å; P201-R204 PolarHBondContact O-N 3.42Å | ||
| 202 | V | 60.7 | Low | 66.6 | Low | 35 Ų | 35 | 72.9 Ų | 72.9 | 21% | 0.212 | 37% | 0.368 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -49.3 | -25.5 | 178.4 | 172.8 | 0 | 0 | 0 | 0 | 112.7 | L146 N149 Q200 R204 | L146-V202 HydrophobicContact CD2-CB 4.49Å; L146-V202 HydrophobicContact CD2-CG1 3.53Å; L146-V202 HydrophobicContact CG-CG1 4.2Å; N149-V202 HydrophobicContact CB-CG1 4.33Å; N149-V202 WeakPolarHBondContact ND2-CG1 3.42Å; Q200-V202 PolarHBondContact O-N 3.41Å; Q200-V202 VanDerWaalsContact O-N 3.11Å; V202-R204 VanDerWaalsContact C-N 3.3Å; V202-R204 PolarHBondContact O-N 3.32Å |
| 203 | Y | 58.7 | Low | 68 | Low | 97 Ų | 97 | 68 Ų | 68 | 38% | 0.38 | 35% | 0.346 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.3 | -7.5 | 178.6 | -53.9 | -70.4 | 0 | 0 | 0 | 115.7 | L146 P201 A205 | L146-Y203 HydrophobicContact CD1-CD1 4.41Å; L146-Y203 HydrophobicContact CD1-CE1 4.34Å; L146-Y203 HydrophobicContact CD2-CD1 4.22Å; L146-Y203 HydrophobicContact CD2-CE1 3.83Å; P201-Y203 PolarHBondContact O-N 2.9Å; Y203-A205 PolarHBondContact O-N 2.83Å; Y203-A205 VanDerWaalsContact O-N 3.12Å |
| 204 | R | 67.1 | Low | 69.4 | Low | 133 Ų | 133 | 65.8 Ų | 65.8 | 50% | 0.502 | 32% | 0.32 | S | S | . | . | trans | -68.5 | 114.8 | -179.3 | -170.8 | -179 | -66.4 | -173.1 | 1 | 109.8 | R145 P201 V202 E206 | R145-R204 PolarHBondContact NH1-O 2.92Å; P201-R204 PolarHBondContact O-N 3.42Å; V202-R204 VanDerWaalsContact C-N 3.3Å; V202-R204 PolarHBondContact O-N 3.32Å; R204-E206 PolarHBondContact O-N 3.46Å | ||
| 205 | A | 71.4 | Confident | 71 | Confident | 24 Ų | 24 | 63.4 Ų | 63.4 | 20% | 0.198 | 31% | 0.311 | C | S | . | . | trans | -54.9 | 128.8 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | N138 V142 Y203 T208 | N138-A205 WeakPolarHBondContact OD1-CB 3.36Å; V142-A205 HydrophobicContact CG2-CB 4.44Å; Y203-A205 PolarHBondContact O-N 2.83Å; Y203-A205 VanDerWaalsContact O-N 3.12Å; A205-T208 VanDerWaalsContact O-CG2 3.31Å; A205-T208 WeakPolarHBondContact O-CG2 3.22Å | ||
| 206 | E | 76.2 | Confident | 73.1 | Confident | 29 Ų | 29 | 55.3 Ų | 55.3 | 14% | 0.136 | 27% | 0.271 | C | S | . | . | S | Bend | trans | -70.6 | -35.3 | 171.1 | -79.8 | 175.3 | 179.3 | 0 | 0 | 111 | R145 R204 T208 T211 I228 | R145-E206 VanDerWaalsContact CD-CD 3.49Å; R145-E206 WeakPolarHBondContact CD-OE1 3.29Å; R145-E206 IonicContact CZ-OE1 3.13Å; R145-E206 IonicContact NE-OE1 2.62Å; R145-E206 PolarHBondContact NE-OE1 3.37Å; R145-E206 IonicContact NE-OE2 3.85Å; R145-E206 IonicContact NH2-OE1 3.84Å; R145-E206 PolarHBondContact NH2-OE1 3.19Å; R204-E206 PolarHBondContact O-N 3.46Å; E206-T208 PolarHBondContact O-N 2.87Å; E206-T211 PolarHBondContact O-OG1 2.95Å; E206-I228 HydrophobicContact CB-CG2 4.06Å |
| 207 | W | 85 | Confident | 75.1 | Confident | 1 Ų | 1 | 51.6 Ų | 51.6 | 0% | 0.004 | 26% | 0.255 | C | S | . | . | trans | -77.1 | 68.7 | 170.9 | -71.9 | 88.8 | 0 | 0 | 0 | 111.2 | L133 Q134 E137 N141 A212 Y215 I228 P230 | L133-W207 HydrophobicContact CB-CE3 4.23Å; L133-W207 HydrophobicContact CB-CH2 4.27Å; L133-W207 HydrophobicContact CB-CZ3 3.72Å; L133-W207 HydrophobicContact CD1-CH2 4.34Å; L133-W207 HydrophobicContact CD1-CZ3 4.22Å; L133-W207 HydrophobicContact CG-CZ3 4.49Å; Q134-W207 WeakPolarHBondContact CG-O 3.47Å; Q134-W207 PolarHBondContact NE2-O 3.37Å; Q134-W207 VanDerWaalsContact NE2-O 3.16Å; E137-W207 HydrophobicContact CB-CD2 3.94Å; E137-W207 HydrophobicContact CB-CG 3.91Å; E137-W207 HydrophobicContact CB-CZ2 4.41Å; E137-W207 HydrophobicContact CG-CZ2 4.18Å; N141-W207 PolarHBondContact ND2-NE1 3.43Å; N141-W207 VanDerWaalsContact ND2-NE1 3.13Å; W207-A212 HydrophobicContact CE3-CB 3.76Å; W207-A212 HydrophobicContact CZ3-CB 4.07Å; W207-Y215 AromaticContact CH2-CD1 3.66Å; W207-Y215 HydrophobicContact CH2-CD1 3.66Å; W207-Y215 HydrophobicContact CH2-CD2 4.16Å; W207-Y215 HydrophobicContact CH2-CE1 4.06Å; W207-Y215 AromaticContact CH2-CG 3.71Å; W207-Y215 HydrophobicContact CH2-CG 3.71Å; W207-Y215 HydrophobicContact CZ3-CD1 4.02Å; W207-Y215 HydrophobicContact CZ3-CG 4.11Å; W207-I228 HydrophobicContact CD2-CD1 3.8Å; W207-I228 HydrophobicContact CE3-CD1 3.61Å; W207-I228 HydrophobicContact CH2-CD1 3.77Å; W207-I228 HydrophobicContact CH2-CG1 4.36Å; W207-I228 HydrophobicContact CZ2-CB 4.36Å; W207-I228 HydrophobicContact CZ2-CD1 3.95Å; W207-I228 HydrophobicContact CZ2-CG1 4.36Å; W207-I228 HydrophobicContact CZ3-CD1 3.59Å; W207-P230 HydrophobicContact CZ2-CB 4.43Å | ||
| 208 | T | 86.2 | Confident | 77.1 | Confident | 48 Ų | 48 | 49 Ų | 49 | 29% | 0.294 | 24% | 0.236 | S | C | . | . | trans | -75.3 | 160 | 162.8 | 65.4 | 0 | 0 | 0 | 0 | 109.7 | A205 E206 T211 A212 | A205-T208 VanDerWaalsContact O-CG2 3.31Å; A205-T208 WeakPolarHBondContact O-CG2 3.22Å; E206-T208 PolarHBondContact O-N 2.87Å; T208-T211 PolarHBondContact N-OG1 3.07Å; T208-T211 PolarHBondContact O-N 3.49Å; T208-T211 PolarHBondContact O-OG1 3.21Å; T208-T211 VanDerWaalsContact OG1-CG2 3.24Å; T208-T211 WeakPolarHBondContact OG1-CG2 3.29Å; T208-T211 PolarHBondContact OG1-N 3.06Å; T208-T211 PolarHBondContact OG1-OG1 3.35Å; T208-A212 VanDerWaalsContact O-CB 3.27Å; T208-A212 WeakPolarHBondContact O-CB 3.44Å; T208-A212 PolarHBondContact O-N 2.89Å | ||
| 209 | F | 88.6 | Confident | 79.2 | Confident | 83 Ų | 83 | 42.1 Ų | 42.1 | 36% | 0.364 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -57.8 | -45 | 177.2 | 176.1 | -98.8 | 0 | 0 | 0 | 112.5 | A130 V131 T211 A212 V213 | A130-F209 HydrophobicContact CB-CE2 4.41Å; V131-F209 HydrophobicContact CG2-CD2 4.36Å; V131-F209 HydrophobicContact CG2-CE2 3.95Å; F209-T211 PolarHBondContact O-N 3.48Å; F209-A212 PolarHBondContact O-N 2.94Å; F209-V213 HydrophobicContact CD1-CG2 4.41Å; F209-V213 HydrophobicContact CE1-CG2 3.98Å; F209-V213 HydrophobicContact CE2-CG2 4.07Å; F209-V213 HydrophobicContact CZ-CG2 3.79Å; F209-V213 WeakPolarHBondContact O-CG2 3.43Å; F209-V213 PolarHBondContact O-N 3.19Å |
| 210 | P | 88.5 | Confident | 81.3 | Confident | 19 Ų | 19 | 35.4 Ų | 35.4 | 12% | 0.123 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -60.2 | -44.6 | 176.3 | -25.8 | 36 | 0 | 0 | 0 | 113.8 | A212 V213 L214 L380 | P210-A212 VanDerWaalsContact C-N 3.35Å; P210-A212 PolarHBondContact O-N 3.4Å; P210-V213 PolarHBondContact O-N 3.41Å; P210-L214 WeakPolarHBondContact O-CG 3.48Å; P210-L214 PolarHBondContact O-N 3Å; P210-L380 HydrophobicContact CB-CB 4.45Å; P210-L380 HydrophobicContact CB-CD1 3.83Å; P210-L380 HydrophobicContact CB-CD2 3.95Å; P210-L380 HydrophobicContact CB-CG 4.27Å; P210-L380 HydrophobicContact CG-CD2 4.49Å; P210-L380 WeakPolarHBondContact O-CD1 3.44Å |
| 211 | T | 87 | Confident | 83 | Confident | 7 Ų | 7 | 31.6 Ų | 31.6 | 4% | 0.043 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -69.3 | -35.5 | -179.7 | 54.8 | 0 | 0 | 0 | 0 | 111.7 | E206 T208 F209 V213 L214 Y215 F227 I228 | E206-T211 PolarHBondContact O-OG1 2.95Å; T208-T211 PolarHBondContact N-OG1 3.07Å; T208-T211 PolarHBondContact O-N 3.49Å; T208-T211 PolarHBondContact O-OG1 3.21Å; T208-T211 VanDerWaalsContact OG1-CG2 3.24Å; T208-T211 WeakPolarHBondContact OG1-CG2 3.29Å; T208-T211 PolarHBondContact OG1-N 3.06Å; T208-T211 PolarHBondContact OG1-OG1 3.35Å; F209-T211 PolarHBondContact O-N 3.48Å; T211-V213 VanDerWaalsContact C-N 3.35Å; T211-L214 PolarHBondContact O-N 3.39Å; T211-Y215 PolarHBondContact O-N 3.42Å; T211-F227 HydrophobicContact CG2-CD1 3.86Å; T211-F227 HydrophobicContact CG2-CE1 3.5Å; T211-F227 HydrophobicContact CG2-CZ 4.49Å; T211-I228 WeakPolarHBondContact O-CD1 3.18Å |
| 212 | A | 91.5 | Very high | 84.6 | Confident | 0 Ų | 0 | 31.7 Ų | 31.7 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -63.8 | -39 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | A130 Q134 W207 T208 F209 P210 Y215 A216 | A130-A212 HydrophobicContact CB-CB 3.87Å; Q134-A212 HydrophobicContact CB-CB 4.26Å; W207-A212 HydrophobicContact CE3-CB 3.76Å; W207-A212 HydrophobicContact CZ3-CB 4.07Å; T208-A212 VanDerWaalsContact O-CB 3.27Å; T208-A212 WeakPolarHBondContact O-CB 3.44Å; T208-A212 PolarHBondContact O-N 2.89Å; F209-A212 PolarHBondContact O-N 2.94Å; P210-A212 VanDerWaalsContact C-N 3.35Å; P210-A212 PolarHBondContact O-N 3.4Å; A212-Y215 PolarHBondContact O-N 3.13Å; A212-A216 WeakPolarHBondContact O-CB 3.49Å; A212-A216 PolarHBondContact O-N 3.06Å |
| 213 | V | 92.5 | Very high | 85.9 | Confident | 9 Ų | 9 | 30.1 Ų | 30.1 | 6% | 0.055 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -64.5 | -42.8 | 172.7 | 166.6 | 0 | 0 | 0 | 0 | 111.1 | I126 A130 F209 P210 T211 Y215 A216 L217 L380 V384 | I126-V213 HydrophobicContact CG2-CG1 3.9Å; A130-V213 HydrophobicContact CB-CB 4.28Å; A130-V213 HydrophobicContact CB-CG2 3.52Å; F209-V213 HydrophobicContact CD1-CG2 4.41Å; F209-V213 HydrophobicContact CE1-CG2 3.98Å; F209-V213 HydrophobicContact CE2-CG2 4.07Å; F209-V213 HydrophobicContact CZ-CG2 3.79Å; F209-V213 WeakPolarHBondContact O-CG2 3.43Å; F209-V213 PolarHBondContact O-N 3.19Å; P210-V213 PolarHBondContact O-N 3.41Å; T211-V213 VanDerWaalsContact C-N 3.35Å; V213-Y215 VanDerWaalsContact C-N 3.31Å; V213-Y215 PolarHBondContact O-N 3.4Å; V213-A216 PolarHBondContact O-N 3.42Å; V213-L217 VanDerWaalsContact O-CB 3.3Å; V213-L217 WeakPolarHBondContact O-CB 3.31Å; V213-L217 PolarHBondContact O-N 3.48Å; V213-L380 HydrophobicContact CB-CD1 4.22Å; V213-L380 HydrophobicContact CB-CD2 3.94Å; V213-L380 HydrophobicContact CB-CG 4.47Å; V213-L380 HydrophobicContact CG1-CD1 4.1Å; V213-L380 HydrophobicContact CG1-CD2 3.88Å; V213-L380 HydrophobicContact CG1-CG 4.11Å; V213-L380 HydrophobicContact CG2-CD2 4.23Å; V213-V384 HydrophobicContact CG1-CG2 3.61Å |
| 214 | L | 90.5 | Very high | 86.8 | Confident | 14 Ų | 14 | 27.2 Ų | 27.2 | 7% | 0.073 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -62.2 | -39.4 | 175 | -70.6 | 175.4 | 0 | 0 | 0 | 112 | P210 T211 L217 T218 V374 L380 I383 | P210-L214 WeakPolarHBondContact O-CG 3.48Å; P210-L214 PolarHBondContact O-N 3Å; T211-L214 PolarHBondContact O-N 3.39Å; L214-L217 PolarHBondContact O-N 3.23Å; L214-T218 VanDerWaalsContact O-CG2 3.22Å; L214-T218 WeakPolarHBondContact O-CG2 3.45Å; L214-T218 PolarHBondContact O-N 2.83Å; L214-T218 PolarHBondContact O-OG1 3.28Å; L214-V374 HydrophobicContact CD1-CB 4.2Å; L214-V374 HydrophobicContact CD1-CG2 3.97Å; L214-L380 HydrophobicContact CD1-CD1 4.22Å; L214-L380 HydrophobicContact CD2-CD1 3.85Å; L214-L380 HydrophobicContact CG-CD1 3.59Å; L214-I383 HydrophobicContact CD2-CG2 4.22Å |
| 215 | Y | 90.8 | Very high | 87.3 | Confident | 35 Ų | 35 | 22 Ų | 22 | 14% | 0.137 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -65.5 | -46.4 | 174.1 | 177.4 | -90.9 | 0 | 0 | 0 | 112.1 | L133 W207 T211 A212 V213 L217 T218 V219 I228 P230 A239 | L133-Y215 HydrophobicContact CD1-CD1 3.48Å; L133-Y215 VanDerWaalsContact CD1-CD1 3.48Å; L133-Y215 HydrophobicContact CD1-CE1 3.48Å; L133-Y215 VanDerWaalsContact CD1-CE1 3.48Å; W207-Y215 AromaticContact CH2-CD1 3.66Å; W207-Y215 HydrophobicContact CH2-CD1 3.66Å; W207-Y215 HydrophobicContact CH2-CD2 4.16Å; W207-Y215 HydrophobicContact CH2-CE1 4.06Å; W207-Y215 AromaticContact CH2-CG 3.71Å; W207-Y215 HydrophobicContact CH2-CG 3.71Å; W207-Y215 HydrophobicContact CZ3-CD1 4.02Å; W207-Y215 HydrophobicContact CZ3-CG 4.11Å; T211-Y215 PolarHBondContact O-N 3.42Å; A212-Y215 PolarHBondContact O-N 3.13Å; V213-Y215 VanDerWaalsContact C-N 3.31Å; V213-Y215 PolarHBondContact O-N 3.4Å; Y215-L217 VanDerWaalsContact C-N 3.26Å; Y215-L217 PolarHBondContact O-N 2.85Å; Y215-T218 WeakPolarHBondContact CA-OG1 3.49Å; Y215-T218 PolarHBondContact O-N 2.98Å; Y215-T218 PolarHBondContact O-OG1 2.99Å; Y215-V219 HydrophobicContact CD1-CG2 4.16Å; Y215-V219 HydrophobicContact CE1-CG2 3.65Å; Y215-V219 HydrophobicContact CE2-CG2 4.14Å; Y215-V219 WeakPolarHBondContact O-CG2 3.49Å; Y215-V219 PolarHBondContact O-N 2.91Å; Y215-I228 HydrophobicContact CD2-CG1 4.3Å; Y215-I228 VanDerWaalsContact CD2-O 3.24Å; Y215-I228 WeakPolarHBondContact CD2-O 3.08Å; Y215-I228 HydrophobicContact CG-CG1 4.47Å; Y215-P230 WeakPolarHBondContact OH-CD 3.43Å; Y215-P230 WeakPolarHBondContact OH-CG 3.46Å; Y215-A239 HydrophobicContact CE1-CB 4.46Å |
| 216 | A | 93.3 | Very high | 86.9 | Confident | 0 Ų | 0 | 27.2 Ų | 27.2 | 0% | 0 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -60.3 | -40.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | I126 A212 V213 L220 F242 | I126-A216 HydrophobicContact CG2-CB 3.98Å; A212-A216 WeakPolarHBondContact O-CB 3.49Å; A212-A216 PolarHBondContact O-N 3.06Å; V213-A216 PolarHBondContact O-N 3.42Å; A216-L220 VanDerWaalsContact O-CD1 3.31Å; A216-L220 WeakPolarHBondContact O-CD1 3.35Å; A216-L220 PolarHBondContact O-N 3.5Å; A216-F242 HydrophobicContact CB-CE1 4.01Å; A216-F242 HydrophobicContact CB-CZ 4.13Å |
| 217 | L | 92.8 | Very high | 86.7 | Confident | 0 Ų | 0 | 29 Ų | 29 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -59.1 | -51.8 | 173.2 | -179.2 | 69.1 | 0 | 0 | 0 | 111 | I126 V213 L214 Y215 V219 L220 T221 V384 V387 V388 | I126-L217 HydrophobicContact CD1-CD1 4.01Å; V213-L217 VanDerWaalsContact O-CB 3.3Å; V213-L217 WeakPolarHBondContact O-CB 3.31Å; V213-L217 PolarHBondContact O-N 3.48Å; L214-L217 PolarHBondContact O-N 3.23Å; Y215-L217 VanDerWaalsContact C-N 3.26Å; Y215-L217 PolarHBondContact O-N 2.85Å; L217-V219 VanDerWaalsContact C-N 3.28Å; L217-V219 PolarHBondContact O-N 2.79Å; L217-L220 PolarHBondContact O-N 3.35Å; L217-T221 HydrophobicContact CD1-CG2 3.53Å; L217-T221 HydrophobicContact CG-CG2 4.03Å; L217-T221 WeakPolarHBondContact O-CB 3.26Å; L217-T221 VanDerWaalsContact O-CG2 3.31Å; L217-T221 WeakPolarHBondContact O-CG2 3.47Å; L217-T221 PolarHBondContact O-N 3.45Å; L217-T221 PolarHBondContact O-OG1 3.25Å; L217-V384 HydrophobicContact CD1-CG1 4.37Å; L217-V384 HydrophobicContact CD2-CG2 4.12Å; L217-V387 HydrophobicContact CD1-CB 4.42Å; L217-V387 HydrophobicContact CD1-CG1 4.14Å; L217-V387 HydrophobicContact CD2-CB 3.98Å; L217-V387 HydrophobicContact CD2-CG1 4.11Å; L217-V387 HydrophobicContact CD2-CG2 4.05Å; L217-V387 HydrophobicContact CG-CG1 4.26Å; L217-V388 HydrophobicContact CD1-CG2 4.28Å |
| 218 | T | 90.8 | Very high | 86.5 | Confident | 11 Ų | 11 | 29.6 Ų | 29.6 | 7% | 0.067 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -63.6 | -32.3 | -176.5 | 55.3 | 0 | 0 | 0 | 0 | 113.9 | L214 Y215 A222 Y225 | L214-T218 VanDerWaalsContact O-CG2 3.22Å; L214-T218 WeakPolarHBondContact O-CG2 3.45Å; L214-T218 PolarHBondContact O-N 2.83Å; L214-T218 PolarHBondContact O-OG1 3.28Å; Y215-T218 WeakPolarHBondContact CA-OG1 3.49Å; Y215-T218 PolarHBondContact O-N 2.98Å; Y215-T218 PolarHBondContact O-OG1 2.99Å; T218-A222 VanDerWaalsContact O-CA 3.29Å; T218-A222 WeakPolarHBondContact O-CA 3.3Å; T218-A222 PolarHBondContact O-N 3.41Å; T218-Y225 HydrophobicContact CG2-CD1 4.49Å; T218-Y225 HydrophobicContact CG2-CD2 2.99Å; T218-Y225 HydrophobicContact CG2-CE2 3.67Å; T218-Y225 HydrophobicContact CG2-CG 3.48Å; T218-Y225 VanDerWaalsContact CG2-CG 3.48Å; T218-Y225 VanDerWaalsContact CG2-N 3.31Å |
| 219 | V | 92.4 | Very high | 86.5 | Confident | 32 Ų | 32 | 31.9 Ų | 31.9 | 19% | 0.194 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -66.5 | -40.4 | 174.3 | 171.7 | 0 | 0 | 0 | 0 | 110.8 | Y215 L217 F242 A243 | Y215-V219 HydrophobicContact CD1-CG2 4.16Å; Y215-V219 HydrophobicContact CE1-CG2 3.65Å; Y215-V219 HydrophobicContact CE2-CG2 4.14Å; Y215-V219 WeakPolarHBondContact O-CG2 3.49Å; Y215-V219 PolarHBondContact O-N 2.91Å; L217-V219 VanDerWaalsContact C-N 3.28Å; L217-V219 PolarHBondContact O-N 2.79Å; V219-F242 HydrophobicContact CG1-CD1 4.38Å; V219-A243 HydrophobicContact CG1-CB 3.62Å |
| 220 | L | 93.5 | Very high | 86.5 | Confident | 6 Ų | 6 | 28.3 Ų | 28.3 | 3% | 0.031 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -76.8 | -38.9 | -180 | -94 | 69.2 | 0 | 0 | 0 | 112.7 | L122 Y125 I126 A216 L217 F242 M250 | L122-L220 HydrophobicContact CD1-CD2 3.87Å; Y125-L220 HydrophobicContact CD1-CD2 3.84Å; Y125-L220 HydrophobicContact CE1-CD1 4.28Å; Y125-L220 HydrophobicContact CE1-CD2 4.05Å; I126-L220 HydrophobicContact CG1-CD2 4.06Å; A216-L220 VanDerWaalsContact O-CD1 3.31Å; A216-L220 WeakPolarHBondContact O-CD1 3.35Å; A216-L220 PolarHBondContact O-N 3.5Å; L217-L220 PolarHBondContact O-N 3.35Å; L220-F242 HydrophobicContact CD1-CD1 3.79Å; L220-F242 HydrophobicContact CD1-CE1 3.11Å; L220-F242 HydrophobicContact CD1-CZ 3.6Å; L220-M250 HydrophobicContact CB-CB 4.28Å; L220-M250 HydrophobicContact CB-CG 4.46Å |
| 221 | T | 90.2 | Very high | 86.4 | Confident | 7 Ų | 7 | 30 Ų | 30 | 4% | 0.043 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -91.6 | -7.7 | -173.8 | 63.4 | 0 | 0 | 0 | 0 | 113.8 | L217 C223 M250 T366 V387 L391 | L217-T221 HydrophobicContact CD1-CG2 3.53Å; L217-T221 HydrophobicContact CG-CG2 4.03Å; L217-T221 WeakPolarHBondContact O-CB 3.26Å; L217-T221 VanDerWaalsContact O-CG2 3.31Å; L217-T221 WeakPolarHBondContact O-CG2 3.47Å; L217-T221 PolarHBondContact O-N 3.45Å; L217-T221 PolarHBondContact O-OG1 3.25Å; T221-C223 PolarHBondContact O-N 3.09Å; T221-C223 VanDerWaalsContact O-N 3.09Å; T221-C223 PolarHBondContact OG1-N 3.48Å; T221-C223 PolarHBondContact OG1-SG 3.42Å; T221-M250 HydrophobicContact CG2-CG 4.48Å; T221-M250 HydrophobicContact CG2-SD 3.94Å; T221-T366 WeakPolarHBondContact O-CG2 3.39Å; T221-V387 HydrophobicContact CG2-CG1 3.88Å; T221-L391 HydrophobicContact CG2-CD1 3.31Å |
| 222 | A | 89.6 | Confident | 86.6 | Confident | 75 Ų | 75 | 31.6 Ų | 31.6 | 62% | 0.62 | 19% | 0.186 | S | C | * | . | trans | 55.9 | 18.6 | -173.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | T218 G224 | T218-A222 VanDerWaalsContact O-CA 3.29Å; T218-A222 WeakPolarHBondContact O-CA 3.3Å; T218-A222 PolarHBondContact O-N 3.41Å; A222-G224 PolarHBondContact O-N 3.14Å | ||
| 223 | C | 86.2 | Confident | 86.7 | Confident | 3 Ų | 3 | 37.1 Ų | 37.1 | 2% | 0.02 | 22% | 0.216 | C | C | . | . | trans | -67.6 | -34.8 | 177.9 | -63.5 | 0 | 0 | 0 | 0 | 112.2 | T221 T363 G368 | T221-C223 PolarHBondContact O-N 3.09Å; T221-C223 VanDerWaalsContact O-N 3.09Å; T221-C223 PolarHBondContact OG1-N 3.48Å; T221-C223 PolarHBondContact OG1-SG 3.42Å; C223-T363 PolarHBondContact SG-O 3.13Å; C223-T363 VanDerWaalsContact SG-O 3.42Å; C223-G368 WeakPolarHBondContact O-CA 3.48Å | ||
| 224 | G | 79.2 | Confident | 86.8 | Confident | 35 Ų | 35 | 38.5 Ų | 38.5 | 36% | 0.361 | 23% | 0.232 | S | C | . | . | trans | 64.4 | 86.2 | -179.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | A222 | A222-G224 PolarHBondContact O-N 3.14Š| ||
| 225 | Y | 76.3 | Confident | 86.9 | Confident | 25 Ų | 25 | 37.8 Ų | 37.8 | 10% | 0.098 | 23% | 0.228 | C | C | . | . | trans | -93.5 | 129 | 167.7 | -59.7 | -48.6 | 0 | 0 | 0 | 110.9 | T218 F227 F359 T363 G370 | T218-Y225 HydrophobicContact CG2-CD1 4.49Å; T218-Y225 HydrophobicContact CG2-CD2 2.99Å; T218-Y225 HydrophobicContact CG2-CE2 3.67Å; T218-Y225 HydrophobicContact CG2-CG 3.48Å; T218-Y225 VanDerWaalsContact CG2-CG 3.48Å; T218-Y225 VanDerWaalsContact CG2-N 3.31Å; Y225-F227 PolarHBondContact O-N 2.95Å; Y225-F359 HydrophobicContact CE1-CZ 4.22Å; Y225-T363 WeakPolarHBondContact OH-CG2 3.47Å; Y225-T363 PolarHBondContact OH-OG1 2.95Å; Y225-G370 VanDerWaalsContact CD1-CA 3.49Å | ||
| 226 | N | 64.1 | Low | 87.1 | Confident | 132 Ų | 132 | 40.6 Ų | 40.6 | 71% | 0.706 | 24% | 0.241 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -79.7 | 32.9 | -174.8 | -71 | -29.4 | 0 | 0 | 0 | 114.3 | ||
| 227 | F | 71.7 | Confident | 87.3 | Confident | 67 Ų | 67 | 46.2 Ų | 46.2 | 29% | 0.294 | 27% | 0.27 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.7 | -49.3 | -172.7 | -167.4 | -106.3 | 0 | 0 | 0 | 113.3 | R194 T211 Y225 V373 | R194-F227 PolarHBondContact NH1-O 3.46Å; T211-F227 HydrophobicContact CG2-CD1 3.86Å; T211-F227 HydrophobicContact CG2-CE1 3.5Å; T211-F227 HydrophobicContact CG2-CZ 4.49Å; Y225-F227 PolarHBondContact O-N 2.95Å; F227-V373 HydrophobicContact CD2-CG2 4.11Å; F227-V373 HydrophobicContact CE2-CG2 3.49Å; F227-V373 VanDerWaalsContact CE2-CG2 3.49Å; F227-V373 HydrophobicContact CZ-CG1 4.31Å; F227-V373 HydrophobicContact CZ-CG2 4.08Å |
| 228 | I | 80.5 | Confident | 87.4 | Confident | 14 Ų | 14 | 48.3 Ų | 48.3 | 7% | 0.072 | 28% | 0.279 | C | S | . | . | trans | -143.6 | 149 | -176.7 | 55.2 | 169.8 | 0 | 0 | 0 | 111.5 | E206 W207 T211 Y215 | E206-I228 HydrophobicContact CB-CG2 4.06Å; W207-I228 HydrophobicContact CD2-CD1 3.8Å; W207-I228 HydrophobicContact CE3-CD1 3.61Å; W207-I228 HydrophobicContact CH2-CD1 3.77Å; W207-I228 HydrophobicContact CH2-CG1 4.36Å; W207-I228 HydrophobicContact CZ2-CB 4.36Å; W207-I228 HydrophobicContact CZ2-CD1 3.95Å; W207-I228 HydrophobicContact CZ2-CG1 4.36Å; W207-I228 HydrophobicContact CZ3-CD1 3.59Å; T211-I228 WeakPolarHBondContact O-CD1 3.18Å; Y215-I228 HydrophobicContact CD2-CG1 4.3Å; Y215-I228 VanDerWaalsContact CD2-O 3.24Å; Y215-I228 WeakPolarHBondContact CD2-O 3.08Å; Y215-I228 HydrophobicContact CG-CG1 4.47Å | ||
| 229 | D | 85.7 | Confident | 87.6 | Confident | 95 Ų | 95 | 48.2 Ų | 48.2 | 51% | 0.508 | 28% | 0.28 | S | S | . | . | trans | -140.6 | 145.6 | 176.2 | 57.7 | -66.9 | 0 | 0 | 0 | 110.3 | V231 | D229-V231 PolarHBondContact O-N 2.87Š| ||
| 230 | P | 89.8 | Confident | 87.8 | Confident | 9 Ų | 9 | 51.9 Ų | 51.9 | 6% | 0.058 | 30% | 0.297 | C | S | . | . | trans | -70.9 | 122 | -180 | 27.1 | -33.3 | 0 | 0 | 0 | 110.1 | E137 W207 Y215 K236 A239 | E137-P230 HydrophobicContact CG-CB 4.18Å; W207-P230 HydrophobicContact CZ2-CB 4.43Å; Y215-P230 WeakPolarHBondContact OH-CD 3.43Å; Y215-P230 WeakPolarHBondContact OH-CG 3.46Å; P230-K236 HydrophobicContact CB-CG 4.32Å; P230-K236 HydrophobicContact CG-CG 4.1Å; P230-K236 WeakPolarHBondContact O-CE 3.19Å; P230-K236 WeakPolarHBondContact O-CG 3.44Å; P230-A239 HydrophobicContact CG-CB 4.49Å | ||
| 231 | V | 86.5 | Confident | 87.9 | Confident | 55 Ų | 55 | 54.1 Ų | 54.1 | 33% | 0.333 | 32% | 0.316 | S | S | . | . | trans | -85.8 | -34.9 | -179.3 | -178.3 | 0 | 0 | 0 | 0 | 110.4 | E137 D229 K236 | E137-V231 PolarHBondContact OE2-N 3.31Å; D229-V231 PolarHBondContact O-N 2.87Å; V231-K236 VanDerWaalsContact O-CE 3.3Å; V231-K236 WeakPolarHBondContact O-CE 3.31Å; V231-K236 PolarHBondContact O-NZ 2.8Å; V231-K236 VanDerWaalsContact O-NZ 3.12Å | ||
| 232 | T | 91.4 | Very high | 88.2 | Confident | 39 Ų | 39 | 54.1 Ų | 54.1 | 24% | 0.239 | 32% | 0.315 | C | S | . | . | S | Bend | trans | -75.9 | 138.9 | -175.5 | -45.1 | 0 | 0 | 0 | 0 | 110.8 | E137 T140 G234 G235 K236 | E137-T232 WeakPolarHBondContact OE1-CA 3.39Å; E137-T232 WeakPolarHBondContact OE1-CB 3.35Å; E137-T232 PolarHBondContact OE1-N 2.7Å; E137-T232 PolarHBondContact OE1-OG1 3.27Å; E137-T232 VanDerWaalsContact OE1-OG1 3.09Å; E137-T232 PolarHBondContact OE2-N 3.29Å; E137-T232 PolarHBondContact OE2-OG1 3.01Å; E137-T232 VanDerWaalsContact OE2-OG1 3.04Å; T140-T232 PolarHBondContact OG1-OG1 3.41Å; T232-G234 PolarHBondContact O-N 3.49Å; T232-G235 PolarHBondContact O-N 2.93Å; T232-K236 WeakPolarHBondContact O-CG 3.42Å; T232-K236 PolarHBondContact O-N 3.29Å |
| 233 | D | 93.5 | Very high | 88.5 | Confident | 117 Ų | 117 | 51.3 Ų | 51.3 | 63% | 0.626 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -56.5 | -37.3 | 176.8 | -59.7 | -30 | 0 | 0 | 0 | 112.2 | K236 I237 | D233-K236 PolarHBondContact O-N 3.43Å; D233-I237 VanDerWaalsContact O-CG1 3.26Å; D233-I237 WeakPolarHBondContact O-CG1 3.46Å; D233-I237 PolarHBondContact O-N 3.46Å |
| 234 | G | 93.2 | Very high | 89 | Confident | 37 Ų | 37 | 57.2 Ų | 57.2 | 38% | 0.381 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -64 | -40.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | T232 F238 | T232-G234 PolarHBondContact O-N 3.49Å; G234-F238 WeakPolarHBondContact O-CB 3.3Å; G234-F238 PolarHBondContact O-N 2.96Å |
| 235 | G | 93.9 | Very high | 89.8 | Confident | 0 Ų | 0 | 60 Ų | 60 | 0% | 0 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -67 | -39.4 | 176 | 0 | 0 | 0 | 0 | 0 | 112 | E137 T232 F238 A239 | E137-G235 WeakPolarHBondContact OE1-CA 3.26Å; T232-G235 PolarHBondContact O-N 2.93Å; G235-F238 PolarHBondContact O-N 3.5Å; G235-A239 WeakPolarHBondContact O-CB 3.03Å; G235-A239 PolarHBondContact O-N 3.02Å |
| 236 | K | 94.9 | Very high | 90.7 | Very high | 93 Ų | 93 | 58.8 Ų | 58.8 | 40% | 0.404 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -62.6 | -47 | 174.4 | -66.2 | 170.6 | -173.4 | 166.3 | 0 | 112.1 | P230 V231 T232 D233 F238 A239 I240 | P230-K236 HydrophobicContact CB-CG 4.32Å; P230-K236 HydrophobicContact CG-CG 4.1Å; P230-K236 WeakPolarHBondContact O-CE 3.19Å; P230-K236 WeakPolarHBondContact O-CG 3.44Å; V231-K236 VanDerWaalsContact O-CE 3.3Å; V231-K236 WeakPolarHBondContact O-CE 3.31Å; V231-K236 PolarHBondContact O-NZ 2.8Å; V231-K236 VanDerWaalsContact O-NZ 3.12Å; T232-K236 WeakPolarHBondContact O-CG 3.42Å; T232-K236 PolarHBondContact O-N 3.29Å; D233-K236 PolarHBondContact O-N 3.43Å; K236-F238 VanDerWaalsContact C-N 3.35Å; K236-F238 PolarHBondContact O-N 3.42Å; K236-A239 PolarHBondContact O-N 3.02Å; K236-I240 WeakPolarHBondContact O-CG1 3.37Å; K236-I240 PolarHBondContact O-N 3.35Å; K236-I240 VanDerWaalsContact O-N 3.07Å |
| 237 | I | 96.6 | Very high | 92.1 | Very high | 118 Ų | 118 | 56.7 Ų | 56.7 | 61% | 0.605 | 32% | 0.316 | S | S | * | . | H | α-helix | trans | -62.4 | -43.9 | 177.2 | -67.5 | 164.5 | 0 | 0 | 0 | 110.6 | D233 I240 A241 | D233-I237 VanDerWaalsContact O-CG1 3.26Å; D233-I237 WeakPolarHBondContact O-CG1 3.46Å; D233-I237 PolarHBondContact O-N 3.46Å; I237-I240 PolarHBondContact O-N 3.28Å; I237-A241 PolarHBondContact O-N 2.82Å |
| 238 | F | 96.3 | Very high | 93.3 | Very high | 44 Ų | 44 | 56.6 Ų | 56.6 | 19% | 0.193 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -61.1 | -45 | 176.1 | 177.2 | -96.5 | 0 | 0 | 0 | 111.7 | F128 V132 L133 G234 G235 K236 I240 A241 F242 | F128-F238 HydrophobicContact CE1-CZ 4.45Å; V132-F238 HydrophobicContact CB-CE1 3.91Å; V132-F238 HydrophobicContact CB-CE2 4.12Å; V132-F238 HydrophobicContact CB-CZ 3.59Å; V132-F238 HydrophobicContact CG1-CD1 4.11Å; V132-F238 HydrophobicContact CG1-CD2 3.87Å; V132-F238 HydrophobicContact CG1-CE1 3.79Å; V132-F238 HydrophobicContact CG1-CE2 3.53Å; V132-F238 HydrophobicContact CG1-CG 4.15Å; V132-F238 HydrophobicContact CG1-CZ 3.48Å; V132-F238 VanDerWaalsContact CG1-CZ 3.48Å; V132-F238 HydrophobicContact CG2-CE2 4.46Å; V132-F238 HydrophobicContact CG2-CZ 4.12Å; L133-F238 HydrophobicContact CD1-CD1 4.47Å; L133-F238 HydrophobicContact CD1-CE1 4.4Å; L133-F238 HydrophobicContact CD2-CD1 3.71Å; L133-F238 HydrophobicContact CD2-CE1 4.34Å; L133-F238 HydrophobicContact CG-CD1 3.73Å; L133-F238 HydrophobicContact CG-CE1 3.84Å; G234-F238 WeakPolarHBondContact O-CB 3.3Å; G234-F238 PolarHBondContact O-N 2.96Å; G235-F238 PolarHBondContact O-N 3.5Å; K236-F238 VanDerWaalsContact C-N 3.35Å; K236-F238 PolarHBondContact O-N 3.42Å; F238-I240 VanDerWaalsContact C-N 3.3Å; F238-I240 PolarHBondContact O-N 3.5Å; F238-A241 PolarHBondContact O-N 2.96Å; F238-F242 HydrophobicContact CD1-CB 4.48Å; F238-F242 HydrophobicContact CE1-CB 4.16Å; F238-F242 HydrophobicContact CE1-CD2 4.44Å; F238-F242 HydrophobicContact CE1-CG 4.35Å; F238-F242 HydrophobicContact CZ-CB 4.36Å; F238-F242 HydrophobicContact CZ-CD2 4.29Å; F238-F242 WeakPolarHBondContact O-CB 3.34Å; F238-F242 PolarHBondContact O-N 3.41Å |
| 239 | A | 95 | Very high | 93.9 | Very high | 10 Ų | 10 | 57.5 Ų | 57.5 | 8% | 0.083 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -59.2 | -40.5 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | Y215 P230 G235 K236 F242 A243 | Y215-A239 HydrophobicContact CE1-CB 4.46Å; P230-A239 HydrophobicContact CG-CB 4.49Å; G235-A239 WeakPolarHBondContact O-CB 3.03Å; G235-A239 PolarHBondContact O-N 3.02Å; K236-A239 PolarHBondContact O-N 3.02Å; A239-F242 PolarHBondContact O-N 2.88Å; A239-A243 VanDerWaalsContact O-CB 3.27Å; A239-A243 WeakPolarHBondContact O-CB 3.49Å; A239-A243 PolarHBondContact O-N 3.02Å |
| 240 | I | 95.7 | Very high | 94.3 | Very high | 109 Ų | 109 | 53.4 Ų | 53.4 | 56% | 0.559 | 31% | 0.305 | S | S | * | . | H | α-helix | trans | -62.8 | -50.3 | 174.9 | -65.2 | 164.4 | 0 | 0 | 0 | 110.7 | K236 I237 F238 F242 A243 L244 | K236-I240 WeakPolarHBondContact O-CG1 3.37Å; K236-I240 PolarHBondContact O-N 3.35Å; K236-I240 VanDerWaalsContact O-N 3.07Å; I237-I240 PolarHBondContact O-N 3.28Å; F238-I240 VanDerWaalsContact C-N 3.3Å; F238-I240 PolarHBondContact O-N 3.5Å; I240-F242 VanDerWaalsContact C-N 3.32Å; I240-F242 PolarHBondContact O-N 3.24Å; I240-A243 PolarHBondContact O-N 3.16Å; I240-L244 HydrophobicContact CG2-CD1 4.41Å; I240-L244 WeakPolarHBondContact O-CG 3.48Å; I240-L244 PolarHBondContact O-N 3.33Å |
| 241 | A | 96.7 | Very high | 94.4 | Very high | 53 Ų | 53 | 57.7 Ų | 57.7 | 44% | 0.438 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -62.4 | -40.5 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | I237 F238 L244 | I237-A241 PolarHBondContact O-N 2.82Å; F238-A241 PolarHBondContact O-N 2.96Å; A241-L244 PolarHBondContact O-N 2.96Å |
| 242 | F | 96.2 | Very high | 94.7 | Very high | 6 Ų | 6 | 59.8 Ų | 59.8 | 3% | 0.026 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -64.1 | -39.8 | 176 | 177.9 | -104.5 | 0 | 0 | 0 | 112 | Y125 A216 V219 L220 F238 A239 I240 G246 | Y125-F242 HydrophobicContact CD1-CD2 4.43Å; Y125-F242 AromaticContact CD1-CE2 3.54Å; Y125-F242 HydrophobicContact CD1-CE2 3.54Å; Y125-F242 AromaticContact CD1-CZ 3.78Å; Y125-F242 HydrophobicContact CD1-CZ 3.78Å; Y125-F242 HydrophobicContact CD2-CE2 4.37Å; Y125-F242 AromaticContact CE1-CD2 3.56Å; Y125-F242 HydrophobicContact CE1-CD2 3.56Å; Y125-F242 HydrophobicContact CE1-CE1 4.27Å; Y125-F242 AromaticContact CE1-CE2 3.05Å; Y125-F242 HydrophobicContact CE1-CE2 3.05Å; Y125-F242 HydrophobicContact CE1-CG 4.32Å; Y125-F242 AromaticContact CE1-CZ 3.47Å; Y125-F242 HydrophobicContact CE1-CZ 3.47Å; Y125-F242 VanDerWaalsContact CE1-CZ 3.47Å; Y125-F242 HydrophobicContact CE2-CD2 4.14Å; Y125-F242 AromaticContact CE2-CE2 3.97Å; Y125-F242 HydrophobicContact CE2-CE2 3.97Å; Y125-F242 HydrophobicContact CG-CE2 4.18Å; Y125-F242 AromaticContact CZ-CD2 3.37Å; Y125-F242 AromaticContact CZ-CE2 3.3Å; Y125-F242 WeakPolarHBondContact O-CE2 3.44Å; Y125-F242 WeakPolarHBondContact OH-CD2 3.36Å; Y125-F242 PolarHBondContact OH-O 3.47Å; A216-F242 HydrophobicContact CB-CE1 4.01Å; A216-F242 HydrophobicContact CB-CZ 4.13Å; V219-F242 HydrophobicContact CG1-CD1 4.38Å; L220-F242 HydrophobicContact CD1-CD1 3.79Å; L220-F242 HydrophobicContact CD1-CE1 3.11Å; L220-F242 HydrophobicContact CD1-CZ 3.6Å; F238-F242 HydrophobicContact CD1-CB 4.48Å; F238-F242 HydrophobicContact CE1-CB 4.16Å; F238-F242 HydrophobicContact CE1-CD2 4.44Å; F238-F242 HydrophobicContact CE1-CG 4.35Å; F238-F242 HydrophobicContact CZ-CB 4.36Å; F238-F242 HydrophobicContact CZ-CD2 4.29Å; F238-F242 WeakPolarHBondContact O-CB 3.34Å; F238-F242 PolarHBondContact O-N 3.41Å; A239-F242 PolarHBondContact O-N 2.88Å; I240-F242 VanDerWaalsContact C-N 3.32Å; I240-F242 PolarHBondContact O-N 3.24Å; F242-G246 WeakPolarHBondContact O-CA 3.25Å; F242-G246 PolarHBondContact O-N 2.72Å |
| 243 | A | 95.6 | Very high | 94.8 | Very high | 17 Ų | 17 | 58 Ų | 58 | 14% | 0.14 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -67.2 | -40.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | V219 A239 I240 V245 G246 I247 | V219-A243 HydrophobicContact CG1-CB 3.62Å; A239-A243 VanDerWaalsContact O-CB 3.27Å; A239-A243 WeakPolarHBondContact O-CB 3.49Å; A239-A243 PolarHBondContact O-N 3.02Å; I240-A243 PolarHBondContact O-N 3.16Å; A243-V245 VanDerWaalsContact C-N 3.26Å; A243-V245 PolarHBondContact O-N 3.06Å; A243-G246 PolarHBondContact O-N 3.4Å; A243-I247 HydrophobicContact CB-CD1 4.04Å; A243-I247 WeakPolarHBondContact O-CB 3.48Å; A243-I247 VanDerWaalsContact O-CG1 3.26Å; A243-I247 WeakPolarHBondContact O-CG1 3.41Å; A243-I247 PolarHBondContact O-N 3.16Å |
| 244 | L | 95.9 | Very high | 94.7 | Very high | 127 Ų | 127 | 52.6 Ų | 52.6 | 67% | 0.665 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -59.3 | -35.8 | -180 | -74 | 172.9 | 0 | 0 | 0 | 113.2 | I240 A241 P248 | I240-L244 HydrophobicContact CG2-CD1 4.41Å; I240-L244 WeakPolarHBondContact O-CG 3.48Å; I240-L244 PolarHBondContact O-N 3.33Å; A241-L244 PolarHBondContact O-N 2.96Å; L244-P248 WeakPolarHBondContact O-CD 3.18Å; L244-P248 WeakPolarHBondContact O-CG 3.31Å |
| 245 | V | 95.7 | Very high | 94.6 | Very high | 92 Ų | 92 | 52.8 Ų | 52.8 | 56% | 0.558 | 29% | 0.29 | S | S | * | . | H | α-helix | trans | -90 | -36.2 | 176 | -179.4 | 0 | 0 | 0 | 0 | 111.4 | Y125 A243 P248 L249 | Y125-V245 HydrophobicContact CE2-CG1 4.48Å; A243-V245 VanDerWaalsContact C-N 3.26Å; A243-V245 PolarHBondContact O-N 3.06Å; V245-P248 WeakPolarHBondContact O-CD 3.11Å; V245-L249 PolarHBondContact O-N 2.84Å |
| 246 | G | 95.7 | Very high | 94.4 | Very high | 0 Ų | 0 | 54.9 Ų | 54.9 | 0% | 0 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -71.1 | -40 | -174.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | Y125 F242 A243 L249 M250 | Y125-G246 VanDerWaalsContact CE1-CA 3.49Å; F242-G246 WeakPolarHBondContact O-CA 3.25Å; F242-G246 PolarHBondContact O-N 2.72Å; A243-G246 PolarHBondContact O-N 3.4Å; G246-L249 PolarHBondContact O-N 3.09Å; G246-M250 WeakPolarHBondContact O-CB 3.32Å; G246-M250 PolarHBondContact O-N 3.25Å |
| 247 | I | 94.5 | Very high | 94.1 | Very high | 88 Ų | 88 | 51.4 Ų | 51.4 | 45% | 0.451 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -64.1 | -48.5 | -178.4 | -65.3 | 164.2 | 0 | 0 | 0 | 111.1 | A243 L249 M250 F251 | A243-I247 HydrophobicContact CB-CD1 4.04Å; A243-I247 WeakPolarHBondContact O-CB 3.48Å; A243-I247 VanDerWaalsContact O-CG1 3.26Å; A243-I247 WeakPolarHBondContact O-CG1 3.41Å; A243-I247 PolarHBondContact O-N 3.16Å; I247-L249 VanDerWaalsContact C-N 3.32Å; I247-L249 PolarHBondContact O-N 2.82Å; I247-M250 PolarHBondContact O-N 3.44Å; I247-F251 WeakPolarHBondContact O-CB 3.28Å; I247-F251 PolarHBondContact O-N 2.93Å |
| 248 | P | 95.1 | Very high | 93.7 | Very high | 66 Ų | 66 | 45.9 Ų | 45.9 | 43% | 0.429 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -59.3 | -40.8 | 173 | -25.3 | 34.6 | 0 | 0 | 0 | 113.1 | L244 V245 F251 I252 | L244-P248 WeakPolarHBondContact O-CD 3.18Å; L244-P248 WeakPolarHBondContact O-CG 3.31Å; V245-P248 WeakPolarHBondContact O-CD 3.11Å; P248-F251 PolarHBondContact O-N 3.03Å; P248-I252 VanDerWaalsContact O-CG1 3.29Å; P248-I252 WeakPolarHBondContact O-CG1 3.28Å; P248-I252 PolarHBondContact O-N 2.9Å |
| 249 | L | 94.4 | Very high | 93.2 | Very high | 33 Ų | 33 | 50 Ų | 50 | 17% | 0.173 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -61.3 | -48.9 | 176.9 | 178.9 | 64.1 | 0 | 0 | 0 | 111 | L122 Y125 V245 G246 I247 F251 I252 T253 | L122-L249 HydrophobicContact CD1-CD2 4.18Å; L122-L249 HydrophobicContact CD1-CG 4.07Å; Y125-L249 HydrophobicContact CD1-CD2 4.09Å; Y125-L249 HydrophobicContact CG-CD2 3.97Å; V245-L249 PolarHBondContact O-N 2.84Å; G246-L249 PolarHBondContact O-N 3.09Å; I247-L249 VanDerWaalsContact C-N 3.32Å; I247-L249 PolarHBondContact O-N 2.82Å; L249-F251 VanDerWaalsContact C-N 3.31Å; L249-F251 PolarHBondContact O-N 3.47Å; L249-I252 PolarHBondContact O-N 3.29Å; L249-T253 HydrophobicContact CD1-CG2 4.29Å; L249-T253 HydrophobicContact CG-CG2 4.46Å; L249-T253 WeakPolarHBondContact O-CG2 3.46Å; L249-T253 PolarHBondContact O-N 3.21Å; L249-T253 PolarHBondContact O-OG1 3.18Å |
| 250 | M | 92.8 | Very high | 92.8 | Very high | 8 Ų | 8 | 52.5 Ų | 52.5 | 4% | 0.039 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -57.1 | -45.5 | 175.5 | -178.8 | 67.2 | -124.7 | 0 | 0 | 110.8 | L122 L220 T221 G246 I247 T253 A254 V388 L391 | L122-M250 HydrophobicContact CD1-CB 4.35Å; L122-M250 HydrophobicContact CD1-SD 4.19Å; L122-M250 HydrophobicContact CD2-CE 4.31Å; L122-M250 HydrophobicContact CD2-SD 3.79Å; L220-M250 HydrophobicContact CB-CB 4.28Å; L220-M250 HydrophobicContact CB-CG 4.46Å; T221-M250 HydrophobicContact CG2-CG 4.48Å; T221-M250 HydrophobicContact CG2-SD 3.94Å; G246-M250 WeakPolarHBondContact O-CB 3.32Å; G246-M250 PolarHBondContact O-N 3.25Å; I247-M250 PolarHBondContact O-N 3.44Å; M250-T253 WeakPolarHBondContact CA-OG1 3.39Å; M250-T253 PolarHBondContact O-N 3.42Å; M250-T253 PolarHBondContact O-OG1 3.5Å; M250-A254 HydrophobicContact CE-CB 3.96Å; M250-A254 WeakPolarHBondContact O-CB 3.28Å; M250-A254 PolarHBondContact O-N 2.92Å; M250-V388 HydrophobicContact CE-CG1 4.22Å; M250-L391 HydrophobicContact CE-CB 4.07Å; M250-L391 HydrophobicContact CE-CD1 3.45Å; M250-L391 VanDerWaalsContact CE-CD1 3.45Å; M250-L391 HydrophobicContact CE-CG 4.41Å; M250-L391 HydrophobicContact SD-CD1 4.07Å |
| 251 | F | 92.6 | Very high | 92.4 | Very high | 99 Ų | 99 | 49.6 Ų | 49.6 | 43% | 0.434 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -62.8 | -45.9 | 179.9 | -167.7 | -99 | 0 | 0 | 0 | 112.6 | L60 I247 P248 L249 T253 A254 A255 | L60-F251 HydrophobicContact CD2-CZ 3.99Å; I247-F251 WeakPolarHBondContact O-CB 3.28Å; I247-F251 PolarHBondContact O-N 2.93Å; P248-F251 PolarHBondContact O-N 3.03Å; L249-F251 VanDerWaalsContact C-N 3.31Å; L249-F251 PolarHBondContact O-N 3.47Å; F251-T253 VanDerWaalsContact C-N 3.34Å; F251-T253 PolarHBondContact O-N 3.18Å; F251-A254 PolarHBondContact O-N 3.22Å; F251-A255 WeakPolarHBondContact O-CB 3.45Å; F251-A255 PolarHBondContact O-N 3.49Å |
| 252 | I | 93 | Very high | 91.7 | Very high | 100 Ų | 100 | 48 Ų | 48 | 51% | 0.513 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -60.8 | -44.7 | 175.9 | -67.9 | 165.8 | 0 | 0 | 0 | 110.4 | L118 P248 L249 A254 A255 D256 | L118-I252 HydrophobicContact CD2-CG2 4.29Å; P248-I252 VanDerWaalsContact O-CG1 3.29Å; P248-I252 WeakPolarHBondContact O-CG1 3.28Å; P248-I252 PolarHBondContact O-N 2.9Å; L249-I252 PolarHBondContact O-N 3.29Å; I252-A254 PolarHBondContact O-N 3.23Å; I252-A255 PolarHBondContact O-N 2.91Å; I252-D256 WeakPolarHBondContact O-CB 3.41Å; I252-D256 PolarHBondContact O-N 3.28Å |
| 253 | T | 92.6 | Very high | 91.1 | Very high | 0 Ų | 0 | 51 Ų | 51 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -63.4 | -41.4 | 178.2 | 66.4 | 0 | 0 | 0 | 0 | 112.4 | L118 L122 L249 M250 F251 I257 | L118-T253 HydrophobicContact CD1-CG2 3.99Å; L118-T253 HydrophobicContact CD2-CG2 4.02Å; L118-T253 HydrophobicContact CG-CG2 3.6Å; L122-T253 HydrophobicContact CB-CG2 3.94Å; L122-T253 HydrophobicContact CD1-CG2 4.36Å; L122-T253 HydrophobicContact CD2-CG2 4.24Å; L122-T253 HydrophobicContact CG-CG2 4.41Å; L249-T253 HydrophobicContact CD1-CG2 4.29Å; L249-T253 HydrophobicContact CG-CG2 4.46Å; L249-T253 WeakPolarHBondContact O-CG2 3.46Å; L249-T253 PolarHBondContact O-N 3.21Å; L249-T253 PolarHBondContact O-OG1 3.18Å; M250-T253 WeakPolarHBondContact CA-OG1 3.39Å; M250-T253 PolarHBondContact O-N 3.42Å; M250-T253 PolarHBondContact O-OG1 3.5Å; F251-T253 VanDerWaalsContact C-N 3.34Å; F251-T253 PolarHBondContact O-N 3.18Å; T253-I257 WeakPolarHBondContact O-CB 3.08Å; T253-I257 WeakPolarHBondContact O-CD1 3.43Å; T253-I257 WeakPolarHBondContact O-CG1 3.27Å; T253-I257 PolarHBondContact O-N 2.96Å |
| 254 | A | 92.2 | Very high | 90.4 | Very high | 4 Ų | 4 | 52.4 Ų | 52.4 | 3% | 0.033 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -68.5 | -37.4 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | M250 F251 I252 G258 L391 T395 | M250-A254 HydrophobicContact CE-CB 3.96Å; M250-A254 WeakPolarHBondContact O-CB 3.28Å; M250-A254 PolarHBondContact O-N 2.92Å; F251-A254 PolarHBondContact O-N 3.22Å; I252-A254 PolarHBondContact O-N 3.23Å; A254-G258 WeakPolarHBondContact O-CA 3.18Å; A254-G258 PolarHBondContact O-N 2.91Å; A254-L391 HydrophobicContact CB-CB 4.5Å; A254-T395 HydrophobicContact CB-CG2 4.09Å; A254-T395 PolarHBondContact O-OG1 3.3Å |
| 255 | A | 90.2 | Very high | 89.7 | Confident | 41 Ų | 41 | 48.4 Ų | 48.4 | 34% | 0.339 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -68 | -43.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112 | F251 I252 G258 K259 | F251-A255 WeakPolarHBondContact O-CB 3.45Å; F251-A255 PolarHBondContact O-N 3.49Å; I252-A255 PolarHBondContact O-N 2.91Å; A255-G258 PolarHBondContact O-N 3.19Å; A255-K259 WeakPolarHBondContact O-CB 3.47Å; A255-K259 PolarHBondContact O-N 3.44Å |
| 256 | D | 89.7 | Confident | 88.9 | Confident | 45 Ų | 45 | 49 Ų | 49 | 24% | 0.241 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -63.9 | -48.5 | 178.4 | -175.5 | 53.8 | 0 | 0 | 0 | 111.7 | H115 L118 I252 G258 K259 F260 | H115-D256 IonicContact CE1-OD1 3.87Å; H115-D256 PolarHBondContact CE1-OD1 2.99Å; H115-D256 IonicContact CE1-OD2 3.16Å; H115-D256 IonicContact CG-OD2 2.8Å; H115-D256 IonicContact ND1-OD1 2.93Å; H115-D256 PolarHBondContact ND1-OD1 3.48Å; H115-D256 IonicContact ND1-OD2 3.02Å; H115-D256 PolarHBondContact ND1-OD2 3.21Å; L118-D256 HydrophobicContact CD2-CB 3.8Å; L118-D256 WeakPolarHBondContact CD2-OD2 3.32Å; I252-D256 WeakPolarHBondContact O-CB 3.41Å; I252-D256 PolarHBondContact O-N 3.28Å; D256-G258 VanDerWaalsContact C-N 3.34Å; D256-G258 PolarHBondContact O-N 2.85Å; D256-K259 PolarHBondContact O-N 2.89Å; D256-F260 PolarHBondContact O-N 3.43Å; D256-F260 VanDerWaalsContact O-N 3.08Å |
| 257 | I | 89.7 | Confident | 88.2 | Confident | 20 Ų | 20 | 56.1 Ų | 56.1 | 10% | 0.103 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -64.3 | -41.2 | 175.2 | -61.6 | 165.7 | 0 | 0 | 0 | 110.3 | L119 T253 K259 F260 L261 V388 A392 | L119-I257 HydrophobicContact CD1-CD1 4.28Å; T253-I257 WeakPolarHBondContact O-CB 3.08Å; T253-I257 WeakPolarHBondContact O-CD1 3.43Å; T253-I257 WeakPolarHBondContact O-CG1 3.27Å; T253-I257 PolarHBondContact O-N 2.96Å; I257-K259 VanDerWaalsContact C-N 3.34Å; I257-K259 PolarHBondContact O-N 3.18Å; I257-F260 PolarHBondContact O-N 2.94Å; I257-L261 HydrophobicContact CG2-CD1 3.92Å; I257-L261 HydrophobicContact CG2-CG 4.19Å; I257-L261 WeakPolarHBondContact O-CB 3.3Å; I257-L261 VanDerWaalsContact O-CG 3.28Å; I257-L261 WeakPolarHBondContact O-CG 3.4Å; I257-L261 PolarHBondContact O-N 3.24Å; I257-V388 HydrophobicContact CD1-CG1 4.21Å; I257-A392 HydrophobicContact CB-CB 3.57Å; I257-A392 HydrophobicContact CG2-CB 3.33Å |
| 258 | G | 88.7 | Confident | 87.5 | Confident | 1 Ų | 1 | 56.2 Ų | 56.2 | 1% | 0.01 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -60.2 | -42.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | A254 A255 D256 L261 S262 A392 M396 | A254-G258 WeakPolarHBondContact O-CA 3.18Å; A254-G258 PolarHBondContact O-N 2.91Å; A255-G258 PolarHBondContact O-N 3.19Å; D256-G258 VanDerWaalsContact C-N 3.34Å; D256-G258 PolarHBondContact O-N 2.85Å; G258-L261 PolarHBondContact O-N 3.17Å; G258-S262 PolarHBondContact O-N 3.47Å; G258-A392 WeakPolarHBondContact CA-O 3.49Å; G258-M396 WeakPolarHBondContact O-CG 3.06Å |
| 259 | K | 86.1 | Confident | 86.7 | Confident | 132 Ų | 132 | 55 Ų | 55 | 57% | 0.574 | 27% | 0.272 | S | S | * | . | H | α-helix | trans | -62.9 | -48 | 174.3 | -173.5 | 178.5 | 178 | -178.8 | 0 | 111.6 | A255 D256 I257 L261 S262 E263 | A255-K259 WeakPolarHBondContact O-CB 3.47Å; A255-K259 PolarHBondContact O-N 3.44Å; D256-K259 PolarHBondContact O-N 2.89Å; I257-K259 VanDerWaalsContact C-N 3.34Å; I257-K259 PolarHBondContact O-N 3.18Å; K259-L261 VanDerWaalsContact C-N 3.29Å; K259-L261 PolarHBondContact O-N 3.13Å; K259-S262 PolarHBondContact O-N 3.44Å; K259-S262 VanDerWaalsContact O-N 3.12Å; K259-S262 PolarHBondContact O-OG 3.39Å; K259-E263 WeakPolarHBondContact CE-OE1 3.26Å; K259-E263 PolarHBondContact O-N 3.36Å; K259-E263 VanDerWaalsContact O-N 3.07Å |
| 260 | F | 86.2 | Confident | 85.9 | Confident | 62 Ų | 62 | 57.4 Ų | 57.4 | 27% | 0.272 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -57.7 | -42.5 | 176.5 | 175.5 | -98.2 | 0 | 0 | 0 | 112.2 | H115 D256 I257 T264 | H115-F260 AromaticContact CD2-CD2 3.65Å; H115-F260 AromaticContact NE2-CD2 3.84Å; D256-F260 PolarHBondContact O-N 3.43Å; D256-F260 VanDerWaalsContact O-N 3.08Å; I257-F260 PolarHBondContact O-N 2.94Å; F260-T264 WeakPolarHBondContact O-CB 3.3Å; F260-T264 PolarHBondContact O-N 3.48Å; F260-T264 PolarHBondContact O-OG1 3.05Å |
| 261 | L | 86 | Confident | 85.3 | Confident | 47 Ų | 47 | 64.4 Ų | 64.4 | 25% | 0.246 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -64.4 | -41.5 | 175.3 | -71.7 | 173.6 | 0 | 0 | 0 | 111.8 | I257 G258 K259 E263 T264 F265 A392 V393 M396 | I257-L261 HydrophobicContact CG2-CD1 3.92Å; I257-L261 HydrophobicContact CG2-CG 4.19Å; I257-L261 WeakPolarHBondContact O-CB 3.3Å; I257-L261 VanDerWaalsContact O-CG 3.28Å; I257-L261 WeakPolarHBondContact O-CG 3.4Å; I257-L261 PolarHBondContact O-N 3.24Å; G258-L261 PolarHBondContact O-N 3.17Å; K259-L261 VanDerWaalsContact C-N 3.29Å; K259-L261 PolarHBondContact O-N 3.13Å; L261-E263 PolarHBondContact O-N 2.84Å; L261-T264 PolarHBondContact O-N 2.87Å; L261-F265 VanDerWaalsContact O-CB 3.29Å; L261-F265 WeakPolarHBondContact O-CB 3.29Å; L261-F265 PolarHBondContact O-N 2.91Å; L261-A392 HydrophobicContact CD1-CB 4.05Å; L261-V393 HydrophobicContact CD1-CG2 3.86Å; L261-M396 VanDerWaalsContact C-SD 3.56Å; L261-M396 HydrophobicContact CB-SD 3.69Å |
| 262 | S | 83.1 | Confident | 84.6 | Confident | 21 Ų | 21 | 62.4 Ų | 62.4 | 15% | 0.147 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -61.5 | -45.2 | 179.3 | 75.7 | 0 | 0 | 0 | 0 | 112.1 | G258 K259 T264 F265 Q266 M396 | G258-S262 PolarHBondContact O-N 3.47Å; K259-S262 PolarHBondContact O-N 3.44Å; K259-S262 VanDerWaalsContact O-N 3.12Å; K259-S262 PolarHBondContact O-OG 3.39Å; S262-T264 VanDerWaalsContact C-N 3.33Å; S262-T264 PolarHBondContact O-N 3.05Å; S262-F265 PolarHBondContact O-N 3Å; S262-Q266 WeakPolarHBondContact O-CB 3.45Å; S262-Q266 VanDerWaalsContact O-CG 3.3Å; S262-Q266 WeakPolarHBondContact O-CG 3.46Å; S262-Q266 PolarHBondContact O-N 3Å; S262-M396 VanDerWaalsContact CA-SD 3.53Å; S262-M396 PolarHBondContact N-SD 2.55Å; S262-M396 VanDerWaalsContact N-SD 3.35Å |
| 263 | E | 82.5 | Confident | 84 | Confident | 67 Ų | 67 | 61.4 Ų | 61.4 | 31% | 0.313 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -66.9 | -38.4 | 178.6 | -68.1 | -179.5 | -165.5 | 0 | 0 | 111.2 | K259 L261 R267 | K259-E263 WeakPolarHBondContact CE-OE1 3.26Å; K259-E263 PolarHBondContact O-N 3.36Å; K259-E263 VanDerWaalsContact O-N 3.07Å; L261-E263 PolarHBondContact O-N 2.84Å; E263-R267 WeakPolarHBondContact O-CB 3.48Å; E263-R267 VanDerWaalsContact O-CG 3.23Å; E263-R267 WeakPolarHBondContact O-CG 3.24Å; E263-R267 PolarHBondContact O-N 2.88Å; E263-R267 PolarHBondContact O-NE 3.45Å; E263-R267 IonicContact OE2-NH2 2.92Å; E263-R267 PolarHBondContact OE2-NH2 3.26Å |
| 264 | T | 81.2 | Confident | 83.4 | Confident | 48 Ų | 48 | 69.2 Ų | 69.2 | 29% | 0.294 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -66.5 | -45.7 | 176.6 | -59 | 0 | 0 | 0 | 0 | 110.6 | F260 L261 S262 R267 I268 | F260-T264 WeakPolarHBondContact O-CB 3.3Å; F260-T264 PolarHBondContact O-N 3.48Å; F260-T264 PolarHBondContact O-OG1 3.05Å; L261-T264 PolarHBondContact O-N 2.87Å; S262-T264 VanDerWaalsContact C-N 3.33Å; S262-T264 PolarHBondContact O-N 3.05Å; T264-R267 PolarHBondContact O-N 3.33Å; T264-I268 HydrophobicContact CG2-CD1 3.84Å; T264-I268 VanDerWaalsContact O-CG1 3.25Å; T264-I268 WeakPolarHBondContact O-CG1 3.44Å; T264-I268 PolarHBondContact O-N 2.76Å |
| 265 | F | 81.4 | Confident | 82.9 | Confident | 43 Ų | 43 | 74.6 Ų | 74.6 | 19% | 0.189 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -62.7 | -45.8 | 178 | -178.5 | -104.6 | 0 | 0 | 0 | 111.6 | L261 S262 R267 I268 C269 A328 Y329 L332 | L261-F265 VanDerWaalsContact O-CB 3.29Å; L261-F265 WeakPolarHBondContact O-CB 3.29Å; L261-F265 PolarHBondContact O-N 2.91Å; S262-F265 PolarHBondContact O-N 3Å; F265-R267 VanDerWaalsContact C-N 3.35Å; F265-R267 PolarHBondContact O-N 3.4Å; F265-I268 PolarHBondContact O-N 2.72Å; F265-C269 WeakPolarHBondContact CE1-SG 2.99Å; F265-C269 WeakPolarHBondContact CZ-SG 3.48Å; F265-C269 WeakPolarHBondContact O-CB 3.46Å; F265-C269 PolarHBondContact O-N 2.86Å; F265-C269 PolarHBondContact O-SG 3.36Å; F265-C269 VanDerWaalsContact O-SG 3.38Å; F265-A328 HydrophobicContact CZ-CB 4.45Å; F265-Y329 HydrophobicContact CE1-CD1 4.37Å; F265-Y329 HydrophobicContact CE1-CE1 4.05Å; F265-L332 HydrophobicContact CD2-CD1 4.01Å; F265-L332 HydrophobicContact CE2-CD1 3.87Å |
| 266 | Q | 79 | Confident | 82.3 | Confident | 105 Ų | 105 | 79.7 Ų | 79.7 | 49% | 0.491 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -59.9 | -44 | 175.5 | -75.2 | 177.7 | -7.7 | 0 | 0 | 111.9 | S262 I268 C269 V270 | S262-Q266 WeakPolarHBondContact O-CB 3.45Å; S262-Q266 VanDerWaalsContact O-CG 3.3Å; S262-Q266 WeakPolarHBondContact O-CG 3.46Å; S262-Q266 PolarHBondContact O-N 3Å; Q266-I268 VanDerWaalsContact C-N 3.33Å; Q266-I268 PolarHBondContact O-N 3.06Å; Q266-C269 PolarHBondContact O-N 3.5Å; Q266-V270 WeakPolarHBondContact O-CG2 3.36Å; Q266-V270 PolarHBondContact O-N 3.31Å |
| 267 | R | 80.4 | Confident | 81.8 | Confident | 149 Ų | 149 | 86.8 Ų | 86.8 | 56% | 0.562 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -59.3 | -44.4 | 174.6 | -76.7 | 179.7 | -120.7 | -136.8 | 2.4 | 111.6 | E263 T264 F265 W271 | E263-R267 WeakPolarHBondContact O-CB 3.48Å; E263-R267 VanDerWaalsContact O-CG 3.23Å; E263-R267 WeakPolarHBondContact O-CG 3.24Å; E263-R267 PolarHBondContact O-N 2.88Å; E263-R267 PolarHBondContact O-NE 3.45Å; E263-R267 IonicContact OE2-NH2 2.92Å; E263-R267 PolarHBondContact OE2-NH2 3.26Å; T264-R267 PolarHBondContact O-N 3.33Å; F265-R267 VanDerWaalsContact C-N 3.35Å; F265-R267 PolarHBondContact O-N 3.4Å; R267-W271 WeakPolarHBondContact O-CB 3.43Å; R267-W271 PolarHBondContact O-N 3.31Å |
| 268 | I | 81.3 | Confident | 81.4 | Confident | 89 Ų | 89 | 88.1 Ų | 88.1 | 46% | 0.456 | 41% | 0.409 | S | S | . | . | H | α-helix | trans | -64.8 | -43.8 | 177.5 | -68.7 | 165.8 | 0 | 0 | 0 | 111 | T264 F265 Q266 W271 S272 | T264-I268 HydrophobicContact CG2-CD1 3.84Å; T264-I268 VanDerWaalsContact O-CG1 3.25Å; T264-I268 WeakPolarHBondContact O-CG1 3.44Å; T264-I268 PolarHBondContact O-N 2.76Å; F265-I268 PolarHBondContact O-N 2.72Å; Q266-I268 VanDerWaalsContact C-N 3.33Å; Q266-I268 PolarHBondContact O-N 3.06Å; I268-W271 PolarHBondContact O-N 3.21Å; I268-S272 WeakPolarHBondContact O-CB 3.35Å; I268-S272 PolarHBondContact O-N 3.08Å |
| 269 | C | 77.1 | Confident | 81.1 | Confident | 42 Ų | 42 | 90 Ų | 90 | 28% | 0.284 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -63.3 | -45.4 | 178.1 | -74 | 0 | 0 | 0 | 0 | 112.1 | F265 Q266 W271 S272 N273 | F265-C269 WeakPolarHBondContact CE1-SG 2.99Å; F265-C269 WeakPolarHBondContact CZ-SG 3.48Å; F265-C269 WeakPolarHBondContact O-CB 3.46Å; F265-C269 PolarHBondContact O-N 2.86Å; F265-C269 PolarHBondContact O-SG 3.36Å; F265-C269 VanDerWaalsContact O-SG 3.38Å; Q266-C269 PolarHBondContact O-N 3.5Å; C269-W271 VanDerWaalsContact C-N 3.35Å; C269-S272 PolarHBondContact O-N 3.11Å; C269-N273 WeakPolarHBondContact O-CB 3.14Å; C269-N273 PolarHBondContact O-N 2.99Å |
| 270 | V | 79 | Confident | 80.9 | Confident | 82 Ų | 82 | 88.1 Ų | 88.1 | 50% | 0.497 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -66.3 | -40.1 | 177.2 | 173.6 | 0 | 0 | 0 | 0 | 110.8 | Q266 N273 R274 | Q266-V270 WeakPolarHBondContact O-CG2 3.36Å; Q266-V270 PolarHBondContact O-N 3.31Å; V270-N273 PolarHBondContact O-N 3.31Å; V270-R274 WeakPolarHBondContact O-CB 3.48Å; V270-R274 WeakPolarHBondContact O-CG 3.32Å; V270-R274 PolarHBondContact O-N 3.48Å |
| 271 | W | 80.4 | Confident | 80.5 | Confident | 156 Ų | 156 | 87.4 Ų | 87.4 | 59% | 0.591 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -63 | -44.6 | 173.5 | 175.3 | 75 | 0 | 0 | 0 | 112 | R267 I268 C269 R274 F275 | R267-W271 WeakPolarHBondContact O-CB 3.43Å; R267-W271 PolarHBondContact O-N 3.31Å; I268-W271 PolarHBondContact O-N 3.21Å; C269-W271 VanDerWaalsContact C-N 3.35Å; W271-R274 PolarHBondContact O-N 3.35Å; W271-F275 WeakPolarHBondContact O-CB 3.46Å; W271-F275 PolarHBondContact O-N 3.32Å |
| 272 | S | 77.2 | Confident | 80.2 | Confident | 57 Ų | 57 | 90.7 Ų | 90.7 | 40% | 0.399 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -63.3 | -41.5 | 176.9 | -176.1 | 0 | 0 | 0 | 0 | 111.6 | I268 C269 F275 Y276 | I268-S272 WeakPolarHBondContact O-CB 3.35Å; I268-S272 PolarHBondContact O-N 3.08Å; C269-S272 PolarHBondContact O-N 3.11Å; S272-F275 PolarHBondContact O-N 2.95Å; S272-Y276 VanDerWaalsContact O-CB 3.28Å; S272-Y276 WeakPolarHBondContact O-CB 3.26Å; S272-Y276 PolarHBondContact O-N 2.79Å |
| 273 | N | 79.5 | Confident | 79.9 | Confident | 78 Ų | 78 | 96.8 Ų | 96.8 | 42% | 0.417 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -65.5 | -40.4 | 174.7 | -78.5 | -5.7 | 0 | 0 | 0 | 112.1 | C269 V270 Y276 R277 | C269-N273 WeakPolarHBondContact O-CB 3.14Å; C269-N273 PolarHBondContact O-N 2.99Å; V270-N273 PolarHBondContact O-N 3.31Å; N273-Y276 PolarHBondContact O-N 2.94Å; N273-R277 WeakPolarHBondContact O-CB 3.24Å; N273-R277 WeakPolarHBondContact O-CG 3.02Å; N273-R277 PolarHBondContact O-N 2.8Å |
| 274 | R | 80.4 | Confident | 79.3 | Confident | 164 Ų | 164 | 96 Ų | 96 | 62% | 0.619 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -63.6 | -43.1 | 173.3 | -76.5 | -171.9 | -68.9 | 178.9 | -1.5 | 111.4 | V270 W271 R277 A278 | V270-R274 WeakPolarHBondContact O-CB 3.48Å; V270-R274 WeakPolarHBondContact O-CG 3.32Å; V270-R274 PolarHBondContact O-N 3.48Å; W271-R274 PolarHBondContact O-N 3.35Å; R274-R277 PolarHBondContact O-N 3.3Å; R274-A278 WeakPolarHBondContact O-CB 3.29Å; R274-A278 PolarHBondContact O-N 3.49Å |
| 275 | F | 82.2 | Confident | 78.4 | Confident | 118 Ų | 118 | 98.3 Ų | 98.3 | 52% | 0.518 | 48% | 0.477 | S | S | . | . | H | α-helix | trans | -64.5 | -44.9 | 176.5 | -175.7 | -98.7 | 0 | 0 | 0 | 111.6 | W271 S272 R277 A278 C279 | W271-F275 WeakPolarHBondContact O-CB 3.46Å; W271-F275 PolarHBondContact O-N 3.32Å; S272-F275 PolarHBondContact O-N 2.95Å; F275-R277 PolarHBondContact O-N 3.11Å; F275-A278 PolarHBondContact O-N 2.99Å; F275-C279 WeakPolarHBondContact CE1-SG 3.47Å; F275-C279 VanDerWaalsContact CZ-SG 3.58Å; F275-C279 WeakPolarHBondContact O-CB 3.43Å; F275-C279 PolarHBondContact O-N 2.93Å; F275-C279 PolarHBondContact O-SG 2.81Å |
| 276 | Y | 77.5 | Confident | 77.3 | Confident | 147 Ų | 147 | 103.7 Ų | 103.7 | 58% | 0.576 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -59.6 | -46 | 175.4 | 177.9 | -99.5 | 0 | 0 | 0 | 111.4 | S272 N273 A278 C279 L280 | S272-Y276 VanDerWaalsContact O-CB 3.28Å; S272-Y276 WeakPolarHBondContact O-CB 3.26Å; S272-Y276 PolarHBondContact O-N 2.79Å; N273-Y276 PolarHBondContact O-N 2.94Å; Y276-A278 PolarHBondContact O-N 3.43Å; Y276-C279 PolarHBondContact O-N 3.48Å; Y276-L280 HydrophobicContact CE1-CD2 4.38Å; Y276-L280 VanDerWaalsContact O-CB 3.31Å; Y276-L280 WeakPolarHBondContact O-CB 3.28Å; Y276-L280 PolarHBondContact O-N 3.23Å |
| 277 | R | 79.8 | Confident | 76.4 | Confident | 194 Ų | 194 | 106 Ų | 106 | 73% | 0.732 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -61.6 | -40.9 | 174.2 | -75.7 | -178.1 | 173.3 | -168.3 | -2.1 | 112.1 | N273 R274 F275 L280 A281 | N273-R277 WeakPolarHBondContact O-CB 3.24Å; N273-R277 WeakPolarHBondContact O-CG 3.02Å; N273-R277 PolarHBondContact O-N 2.8Å; R274-R277 PolarHBondContact O-N 3.3Å; F275-R277 PolarHBondContact O-N 3.11Å; R277-L280 PolarHBondContact O-N 3.39Å; R277-A281 VanDerWaalsContact O-CB 3.25Å; R277-A281 WeakPolarHBondContact O-CB 3.44Å; R277-A281 PolarHBondContact O-N 3.38Å |
| 278 | A | 80.2 | Confident | 75 | Confident | 49 Ų | 49 | 105.6 Ų | 105.6 | 41% | 0.405 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -65.5 | -42.9 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | R274 F275 Y276 A281 N282 | R274-A278 WeakPolarHBondContact O-CB 3.29Å; R274-A278 PolarHBondContact O-N 3.49Å; F275-A278 PolarHBondContact O-N 2.99Å; Y276-A278 PolarHBondContact O-N 3.43Å; A278-A281 PolarHBondContact O-N 3.46Å; A278-N282 VanDerWaalsContact O-CG 3.26Å; A278-N282 PolarHBondContact O-N 3.05Å; A278-N282 PolarHBondContact O-ND2 3.3Å |
| 279 | C | 82.2 | Confident | 73.6 | Confident | 40 Ų | 40 | 108.9 Ų | 108.9 | 27% | 0.27 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.6 | -47.9 | 173.9 | -76.3 | 0 | 0 | 0 | 0 | 111.4 | F275 Y276 A281 N282 F283 | F275-C279 WeakPolarHBondContact CE1-SG 3.47Å; F275-C279 VanDerWaalsContact CZ-SG 3.58Å; F275-C279 WeakPolarHBondContact O-CB 3.43Å; F275-C279 PolarHBondContact O-N 2.93Å; F275-C279 PolarHBondContact O-SG 2.81Å; Y276-C279 PolarHBondContact O-N 3.48Å; C279-A281 VanDerWaalsContact C-N 3.32Å; C279-A281 PolarHBondContact O-N 2.83Å; C279-N282 PolarHBondContact O-N 3.23Å; C279-F283 WeakPolarHBondContact O-CD2 3.39Å; C279-F283 PolarHBondContact O-N 3.04Å |
| 280 | L | 81.7 | Confident | 72.4 | Confident | 93 Ų | 93 | 114.1 Ų | 114.1 | 49% | 0.487 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -62.8 | -39.3 | 179.2 | -166.4 | 74.5 | 0 | 0 | 0 | 111.5 | Y276 R277 F283 S284 | Y276-L280 HydrophobicContact CE1-CD2 4.38Å; Y276-L280 VanDerWaalsContact O-CB 3.31Å; Y276-L280 WeakPolarHBondContact O-CB 3.28Å; Y276-L280 PolarHBondContact O-N 3.23Å; R277-L280 PolarHBondContact O-N 3.39Å; L280-F283 PolarHBondContact O-N 3.11Å; L280-S284 VanDerWaalsContact O-CB 3.32Å; L280-S284 WeakPolarHBondContact O-CB 3.41Å; L280-S284 PolarHBondContact O-N 3.37Å |
| 281 | A | 78.6 | Confident | 70.9 | Confident | 46 Ų | 46 | 112.8 Ų | 112.8 | 38% | 0.38 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -63 | -40.9 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112 | R277 A278 C279 F283 S284 N285 | R277-A281 VanDerWaalsContact O-CB 3.25Å; R277-A281 WeakPolarHBondContact O-CB 3.44Å; R277-A281 PolarHBondContact O-N 3.38Å; A278-A281 PolarHBondContact O-N 3.46Å; C279-A281 VanDerWaalsContact C-N 3.32Å; C279-A281 PolarHBondContact O-N 2.83Å; A281-F283 PolarHBondContact O-N 2.86Å; A281-S284 PolarHBondContact O-N 3Å; A281-N285 WeakPolarHBondContact O-CB 3.3Å; A281-N285 PolarHBondContact O-N 2.98Å |
| 282 | N | 80.1 | Confident | 69.1 | Low | 116 Ų | 116 | 113.3 Ų | 113.3 | 62% | 0.62 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -65 | -37.1 | 175.6 | -72 | -15.5 | 0 | 0 | 0 | 112.4 | A278 C279 | A278-N282 VanDerWaalsContact O-CG 3.26Å; A278-N282 PolarHBondContact O-N 3.05Å; A278-N282 PolarHBondContact O-ND2 3.3Å; C279-N282 PolarHBondContact O-N 3.23Å |
| 283 | F | 76.7 | Confident | 67.3 | Low | 149 Ų | 149 | 118 Ų | 118 | 65% | 0.654 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -71.6 | -42.6 | 173.7 | -76.3 | -70.5 | 0 | 0 | 0 | 112.4 | C279 L280 A281 K286 E287 | C279-F283 WeakPolarHBondContact O-CD2 3.39Å; C279-F283 PolarHBondContact O-N 3.04Å; L280-F283 PolarHBondContact O-N 3.11Å; A281-F283 PolarHBondContact O-N 2.86Å; F283-K286 VanDerWaalsContact O-CB 3.29Å; F283-K286 WeakPolarHBondContact O-CB 3.42Å; F283-K286 PolarHBondContact O-N 3.42Å; F283-K286 VanDerWaalsContact O-N 3.17Å; F283-E287 PolarHBondContact O-N 3.33Å |
| 284 | S | 68.7 | Low | 65.5 | Low | 50 Ų | 50 | 125 Ų | 125 | 35% | 0.35 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -66.5 | -38 | 179.5 | -178.7 | 0 | 0 | 0 | 0 | 112.7 | L280 A281 K286 E287 K288 | L280-S284 VanDerWaalsContact O-CB 3.32Å; L280-S284 WeakPolarHBondContact O-CB 3.41Å; L280-S284 PolarHBondContact O-N 3.37Å; A281-S284 PolarHBondContact O-N 3Å; S284-K286 PolarHBondContact O-N 3.31Å; S284-E287 PolarHBondContact O-N 2.99Å; S284-K288 PolarHBondContact O-N 3.15Å |
| 285 | N | 63.3 | Low | 63.4 | Low | 97 Ų | 97 | 126.1 Ų | 126.1 | 52% | 0.519 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -62 | -31.1 | 173.9 | -80.5 | -10.4 | 0 | 0 | 0 | 112.2 | A281 E287 K288 Q289 | A281-N285 WeakPolarHBondContact O-CB 3.3Å; A281-N285 PolarHBondContact O-N 2.98Å; N285-E287 VanDerWaalsContact C-N 3.28Å; N285-E287 PolarHBondContact O-N 3.48Å; N285-K288 PolarHBondContact O-N 2.92Å; N285-Q289 PolarHBondContact O-N 3.41Å |
| 286 | K | 59.1 | Low | 61.2 | Low | 157 Ų | 157 | 130.5 Ų | 130.5 | 68% | 0.683 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -68.6 | -28.3 | 174.9 | -156.9 | 175.7 | -177.4 | -180 | 0 | 112.3 | F283 S284 | F283-K286 VanDerWaalsContact O-CB 3.29Å; F283-K286 WeakPolarHBondContact O-CB 3.42Å; F283-K286 PolarHBondContact O-N 3.42Å; F283-K286 VanDerWaalsContact O-N 3.17Å; S284-K286 PolarHBondContact O-N 3.31Å |
| 287 | E | 58.6 | Low | 59.5 | Low | 153 Ų | 153 | 128.6 Ų | 128.6 | 72% | 0.715 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -83.9 | -35.7 | 175.7 | -162.9 | 168.7 | -172.5 | 0 | 0 | 112.1 | F283 S284 N285 Q289 I290 | F283-E287 PolarHBondContact O-N 3.33Å; S284-E287 PolarHBondContact O-N 2.99Å; N285-E287 VanDerWaalsContact C-N 3.28Å; N285-E287 PolarHBondContact O-N 3.48Å; E287-Q289 VanDerWaalsContact C-N 3.3Å; E287-Q289 PolarHBondContact O-N 2.88Å; E287-I290 PolarHBondContact O-N 3.47Å; E287-I290 VanDerWaalsContact O-N 3.11Å |
| 288 | K | 51.6 | Low | 57.8 | Low | 141 Ų | 141 | 127.8 Ų | 127.8 | 61% | 0.613 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -67.1 | -26.3 | 175.4 | -75.1 | -176.3 | 178.7 | 178.4 | 0 | 113.8 | S284 N285 I290 G291 Q292 | S284-K288 PolarHBondContact O-N 3.15Å; N285-K288 PolarHBondContact O-N 2.92Å; K288-I290 PolarHBondContact O-N 3.07Å; K288-G291 PolarHBondContact O-N 3.01Å; K288-G291 VanDerWaalsContact O-N 3.14Å; K288-Q292 PolarHBondContact O-N 3.44Å |
| 289 | Q | 51.2 | Low | 56.2 | Low | 158 Ų | 158 | 129.4 Ų | 129.4 | 74% | 0.738 | 66% | 0.658 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.6 | -15.9 | 171.9 | -82.1 | -173.4 | -23.4 | 0 | 0 | 113.9 | N285 E287 | N285-Q289 PolarHBondContact O-N 3.41Å; E287-Q289 VanDerWaalsContact C-N 3.3Å; E287-Q289 PolarHBondContact O-N 2.88Å |
| 290 | I | 52.6 | Low | 54.5 | Low | 152 Ų | 152 | 136.2 Ų | 136.2 | 78% | 0.779 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88.8 | -14.3 | 175.8 | -61.1 | 175.6 | 0 | 0 | 0 | 111.6 | E287 K288 | E287-I290 PolarHBondContact O-N 3.47Å; E287-I290 VanDerWaalsContact O-N 3.11Å; K288-I290 PolarHBondContact O-N 3.07Å |
| 291 | G | 46.6 | Very low | 52.6 | Low | 54 Ų | 54 | 143 Ų | 143 | 56% | 0.557 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -115.8 | 2.1 | -172.3 | 0 | 0 | 0 | 0 | 0 | 116.6 | K288 D293 | K288-G291 PolarHBondContact O-N 3.01Å; K288-G291 VanDerWaalsContact O-N 3.14Å; G291-D293 PolarHBondContact O-N 3.39Å |
| 292 | Q | 43 | Very low | 51.2 | Low | 166 Ų | 166 | 143.4 Ų | 143.4 | 78% | 0.776 | 71% | 0.705 | S | S | * | * | trans | -79 | 30.2 | -167.5 | -151.8 | 173.1 | 3.7 | 0 | 0 | 115.7 | K288 | K288-Q292 PolarHBondContact O-N 3.44Š| ||
| 293 | D | 39.5 | Very low | 50 | Low | 155 Ų | 155 | 141.1 Ų | 141.1 | 83% | 0.829 | 70% | 0.695 | S | S | * | * | S | Bend | trans | -121.5 | 60.7 | 164.2 | -86.9 | -27.6 | 0 | 0 | 0 | 109.4 | G291 | G291-D293 PolarHBondContact O-N 3.39Š|
| 294 | R | 42.4 | Very low | 48.6 | Very low | 225 Ų | 225 | 140.3 Ų | 140.3 | 85% | 0.849 | 70% | 0.696 | S | S | * | * | S | Bend | trans | -169.6 | 118.1 | 157.6 | -107 | 147.4 | 175.7 | -171.4 | -2 | 112.9 | ||
| 295 | K | 34.7 | Very low | 47.8 | Very low | 188 Ų | 188 | 144.1 Ų | 144.1 | 82% | 0.817 | 71% | 0.707 | S | S | * | * | trans | 85.1 | 75.2 | 152.2 | -54.6 | -175.3 | -179.8 | -172.2 | 0 | 116.8 | ||||
| 296 | F | 37.7 | Very low | 47.6 | Very low | 211 Ų | 211 | 143 Ų | 143 | 93% | 0.925 | 70% | 0.701 | S | S | * | * | trans | -58.6 | 144.1 | 134.8 | -168.3 | -105.6 | 0 | 0 | 0 | 109.5 | ||||
| 297 | S | 41.5 | Very low | 47.6 | Very low | 106 Ų | 106 | 140.6 Ų | 140.6 | 74% | 0.741 | 70% | 0.696 | S | S | * | * | S | Bend | trans | 102.6 | 35.5 | 163.7 | -159.8 | 0 | 0 | 0 | 0 | 121.1 | ||
| 298 | E | 43.8 | Very low | 47.5 | Very low | 177 Ų | 177 | 138.7 Ų | 138.7 | 83% | 0.827 | 69% | 0.689 | S | S | * | * | trans | -136.3 | 23.6 | 160.7 | -141.7 | 154.6 | -165.8 | 0 | 0 | 114.1 | E300 | E298-E300 VanDerWaalsContact C-N 3.35Å; E298-E300 PolarHBondContact O-N 3.21Å | ||
| 299 | A | 47.4 | Very low | 47.7 | Very low | 83 Ų | 83 | 133.5 Ų | 133.5 | 69% | 0.686 | 67% | 0.673 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.8 | 2.7 | -165.9 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||
| 300 | E | 46.1 | Very low | 47.8 | Very low | 183 Ų | 183 | 130.1 Ų | 130.1 | 86% | 0.855 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.5 | -7.2 | -174.4 | -94.4 | -178.9 | 154.1 | 0 | 0 | 115.6 | E298 | E298-E300 VanDerWaalsContact C-N 3.35Å; E298-E300 PolarHBondContact O-N 3.21Å |
| 301 | R | 41.6 | Very low | 47.7 | Very low | 237 Ų | 237 | 128.8 Ų | 128.8 | 89% | 0.894 | 65% | 0.65 | S | S | * | * | S | Bend | trans | -104.4 | -9 | -179.3 | -134.9 | 177.8 | -163.7 | 177.3 | 4.7 | 114.6 | ||
| 302 | S | 49.7 | Very low | 48 | Very low | 53 Ų | 53 | 129 Ų | 129 | 37% | 0.371 | 65% | 0.647 | S | S | . | * | S | Bend | trans | -87.4 | -22.8 | 179.3 | 77.6 | 0 | 0 | 0 | 0 | 113.1 | I304 F305 D306 | S302-I304 PolarHBondContact O-N 2.96Å; S302-F305 PolarHBondContact O-N 3.34Å; S302-D306 WeakPolarHBondContact CB-OD2 3.33Å; S302-D306 WeakPolarHBondContact O-CB 3.44Å; S302-D306 PolarHBondContact O-N 3.18Å; S302-D306 PolarHBondContact OG-OD2 2.81Å |
| 303 | T | 53.2 | Low | 48.2 | Very low | 68 Ų | 68 | 125.2 Ų | 125.2 | 42% | 0.417 | 63% | 0.632 | S | S | . | * | H | α-helix | trans | -57.6 | -49.1 | -169.9 | 55.3 | 0 | 0 | 0 | 0 | 114.5 | F305 D306 D307 | T303-F305 PolarHBondContact O-N 3.44Å; T303-D306 PolarHBondContact O-N 2.88Å; T303-D307 WeakPolarHBondContact O-CB 3.36Å; T303-D307 PolarHBondContact O-N 3.36Å |
| 304 | I | 49.1 | Very low | 48.7 | Very low | 132 Ų | 132 | 123.9 Ų | 123.9 | 68% | 0.677 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -71.7 | -34.2 | -175.6 | -58.3 | 174.4 | 0 | 0 | 0 | 112.3 | S302 L308 | S302-I304 PolarHBondContact O-N 2.96Å; I304-L308 PolarHBondContact O-N 3.4Å |
| 305 | F | 51.5 | Low | 48.9 | Very low | 130 Ų | 130 | 118.7 Ų | 118.7 | 57% | 0.57 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -81.4 | -31.9 | 178.6 | -165.3 | -88.3 | 0 | 0 | 0 | 111.2 | S302 T303 A309 | S302-F305 PolarHBondContact O-N 3.34Å; T303-F305 PolarHBondContact O-N 3.44Å; F305-A309 WeakPolarHBondContact O-CB 3.28Å; F305-A309 PolarHBondContact O-N 3.48Å |
| 306 | D | 59.6 | Low | 49.5 | Very low | 74 Ų | 74 | 115.9 Ų | 115.9 | 40% | 0.396 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -63.6 | -45.8 | 168.8 | -70.4 | -23.1 | 0 | 0 | 0 | 109.3 | S302 T303 L308 A309 D310 | S302-D306 WeakPolarHBondContact CB-OD2 3.33Å; S302-D306 WeakPolarHBondContact O-CB 3.44Å; S302-D306 PolarHBondContact O-N 3.18Å; S302-D306 PolarHBondContact OG-OD2 2.81Å; T303-D306 PolarHBondContact O-N 2.88Å; D306-L308 PolarHBondContact O-N 3.09Å; D306-A309 CarbonylContact O-C 3.57Å; D306-A309 PolarHBondContact O-N 3.39Å; D306-D310 WeakPolarHBondContact O-CB 3.31Å; D306-D310 PolarHBondContact O-N 2.84Å |
| 307 | D | 57.8 | Low | 50 | Low | 107 Ų | 107 | 111.2 Ų | 111.2 | 57% | 0.572 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -59.2 | -43.2 | 177.1 | -68.9 | -24.1 | 0 | 0 | 0 | 112.1 | T303 D310 E311 | T303-D307 WeakPolarHBondContact O-CB 3.36Å; T303-D307 PolarHBondContact O-N 3.36Å; D307-D310 PolarHBondContact O-N 2.8Å; D307-E311 PolarHBondContact O-N 3.12Å |
| 308 | L | 57.4 | Low | 50.4 | Low | 112 Ų | 112 | 109.4 Ų | 109.4 | 59% | 0.586 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -76.7 | -31.9 | 179.2 | -136.4 | 79.7 | 0 | 0 | 0 | 113 | I304 D306 D310 A312 | I304-L308 PolarHBondContact O-N 3.4Å; D306-L308 PolarHBondContact O-N 3.09Å; L308-D310 VanDerWaalsContact C-N 3.33Å; L308-A312 WeakPolarHBondContact O-CB 3.18Å; L308-A312 PolarHBondContact O-N 3.01Å; L308-A312 VanDerWaalsContact O-N 3.07Å |
| 309 | A | 55.3 | Low | 50.6 | Low | 32 Ų | 32 | 103.5 Ų | 103.5 | 26% | 0.264 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -71 | -33.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 110.6 | F305 D306 N313 | F305-A309 WeakPolarHBondContact O-CB 3.28Å; F305-A309 PolarHBondContact O-N 3.48Å; D306-A309 CarbonylContact O-C 3.57Å; D306-A309 PolarHBondContact O-N 3.39Å; A309-N313 WeakPolarHBondContact O-CA 3.23Å; A309-N313 WeakPolarHBondContact O-CB 3.35Å; A309-N313 PolarHBondContact O-N 2.69Å; A309-N313 PolarHBondContact O-ND2 3.35Å; A309-N313 VanDerWaalsContact O-ND2 3.11Å |
| 310 | D | 52.9 | Low | 50.7 | Low | 87 Ų | 87 | 105.4 Ų | 105.4 | 47% | 0.465 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -68.6 | -42.4 | 173.2 | -75.5 | -16.7 | 0 | 0 | 0 | 110.2 | D306 D307 L308 N313 E314 | D306-D310 WeakPolarHBondContact O-CB 3.31Å; D306-D310 PolarHBondContact O-N 2.84Å; D307-D310 PolarHBondContact O-N 2.8Å; L308-D310 VanDerWaalsContact C-N 3.33Å; D310-N313 CarbonylContact O-C 3.57Å; D310-N313 PolarHBondContact O-N 2.89Å; D310-E314 WeakPolarHBondContact O-CB 3.33Å; D310-E314 VanDerWaalsContact O-CG 3.28Å; D310-E314 WeakPolarHBondContact O-CG 3.3Å; D310-E314 PolarHBondContact O-N 3.41Å |
| 311 | E | 51.7 | Low | 51.1 | Low | 124 Ų | 124 | 99.1 Ų | 99.1 | 58% | 0.579 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -64.9 | -41.6 | 175.6 | -158 | 175.8 | -157.8 | 0 | 0 | 112.3 | D307 E314 D315 | D307-E311 PolarHBondContact O-N 3.12Å; E311-E314 PolarHBondContact O-N 3.47Å; E311-D315 PolarHBondContact O-N 3.2Å |
| 312 | A | 51.9 | Low | 51.7 | Low | 58 Ų | 58 | 88.6 Ų | 88.6 | 48% | 0.479 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -69.1 | -37.4 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | L308 E314 D315 E316 | L308-A312 WeakPolarHBondContact O-CB 3.18Å; L308-A312 PolarHBondContact O-N 3.01Å; L308-A312 VanDerWaalsContact O-N 3.07Å; A312-E314 VanDerWaalsContact C-N 3.3Å; A312-D315 PolarHBondContact O-N 3.09Å; A312-E316 PolarHBondContact O-N 3.21Å; A312-E316 VanDerWaalsContact O-N 3.09Å |
| 313 | N | 46.9 | Very low | 51.9 | Low | 88 Ų | 88 | 95.7 Ų | 95.7 | 47% | 0.471 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.9 | -30.1 | 171.9 | -79.2 | -28.6 | 0 | 0 | 0 | 111 | A309 D310 L317 | A309-N313 WeakPolarHBondContact O-CA 3.23Å; A309-N313 WeakPolarHBondContact O-CB 3.35Å; A309-N313 PolarHBondContact O-N 2.69Å; A309-N313 PolarHBondContact O-ND2 3.35Å; A309-N313 VanDerWaalsContact O-ND2 3.11Å; D310-N313 CarbonylContact O-C 3.57Å; D310-N313 PolarHBondContact O-N 2.89Å; N313-L317 WeakPolarHBondContact O-CA 3.45Å; N313-L317 WeakPolarHBondContact O-CB 3.17Å; N313-L317 PolarHBondContact O-N 3.37Å |
| 314 | E | 50 | Low | 52.4 | Low | 127 Ų | 127 | 99.1 Ų | 99.1 | 59% | 0.593 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -68.4 | -40.2 | 175.7 | -81.3 | -169.9 | -176.3 | 0 | 0 | 110.9 | D310 E311 A312 T318 | D310-E314 WeakPolarHBondContact O-CB 3.33Å; D310-E314 VanDerWaalsContact O-CG 3.28Å; D310-E314 WeakPolarHBondContact O-CG 3.3Å; D310-E314 PolarHBondContact O-N 3.41Å; E311-E314 PolarHBondContact O-N 3.47Å; A312-E314 VanDerWaalsContact C-N 3.3Å; E314-T318 WeakPolarHBondContact O-CB 3.39Å; E314-T318 WeakPolarHBondContact O-CG2 3.45Å; E314-T318 PolarHBondContact O-N 3.27Å; E314-T318 PolarHBondContact O-OG1 3.5Å; E314-T318 VanDerWaalsContact O-OG1 3.07Å |
| 315 | D | 47.5 | Very low | 53.6 | Low | 115 Ų | 115 | 93.8 Ų | 93.8 | 62% | 0.615 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -69.4 | -36 | 174.6 | -82.4 | -20.7 | 0 | 0 | 0 | 113.2 | E311 A312 T318 S319 | E311-D315 PolarHBondContact O-N 3.2Å; A312-D315 PolarHBondContact O-N 3.09Å; D315-T318 WeakPolarHBondContact CA-OG1 3.34Å; D315-T318 PolarHBondContact O-OG1 2.99Å; D315-S319 PolarHBondContact O-N 3.25Å; D315-S319 PolarHBondContact O-OG 2.95Å |
| 316 | E | 47.8 | Very low | 54.7 | Low | 129 Ų | 129 | 91 Ų | 91 | 60% | 0.603 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -76.9 | -38.8 | 175.3 | -159.9 | 163.4 | -162.3 | 0 | 0 | 111.3 | A312 T318 S319 D320 | A312-E316 PolarHBondContact O-N 3.21Å; A312-E316 VanDerWaalsContact O-N 3.09Å; E316-T318 PolarHBondContact O-N 3.49Å; E316-S319 WeakPolarHBondContact O-CA 3.4Å; E316-S319 VanDerWaalsContact O-CB 3.28Å; E316-S319 WeakPolarHBondContact O-CB 3.39Å; E316-S319 PolarHBondContact O-N 3.39Å; E316-D320 PolarHBondContact O-N 3.29Å |
| 317 | L | 47.3 | Very low | 55.8 | Low | 113 Ų | 113 | 89.2 Ų | 89.2 | 59% | 0.592 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -65.4 | -37.5 | 172.6 | -175.3 | 68.4 | 0 | 0 | 0 | 110.8 | N313 S319 D320 S321 | N313-L317 WeakPolarHBondContact O-CA 3.45Å; N313-L317 WeakPolarHBondContact O-CB 3.17Å; N313-L317 PolarHBondContact O-N 3.37Å; L317-S319 PolarHBondContact O-N 2.87Å; L317-D320 PolarHBondContact O-N 3.06Å; L317-S321 WeakPolarHBondContact O-CA 3.31Å; L317-S321 WeakPolarHBondContact O-CB 3.49Å; L317-S321 PolarHBondContact O-N 3.49Å; L317-S321 PolarHBondContact O-OG 3.48Å |
| 318 | T | 49 | Very low | 56.9 | Low | 69 Ų | 69 | 85.2 Ų | 85.2 | 42% | 0.423 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -65.7 | -24.2 | 172.2 | 57.8 | 0 | 0 | 0 | 0 | 112.3 | E314 D315 E316 S321 | E314-T318 WeakPolarHBondContact O-CB 3.39Å; E314-T318 WeakPolarHBondContact O-CG2 3.45Å; E314-T318 PolarHBondContact O-N 3.27Å; E314-T318 PolarHBondContact O-OG1 3.5Å; E314-T318 VanDerWaalsContact O-OG1 3.07Å; D315-T318 WeakPolarHBondContact CA-OG1 3.34Å; D315-T318 PolarHBondContact O-OG1 2.99Å; E316-T318 PolarHBondContact O-N 3.49Å; T318-S321 WeakPolarHBondContact CA-OG 3.33Å |
| 319 | S | 48.5 | Very low | 58.1 | Low | 53 Ų | 53 | 81.3 Ų | 81.3 | 37% | 0.371 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -79.5 | -44.9 | 176.1 | -56.8 | 0 | 0 | 0 | 0 | 111.8 | D315 E316 L317 L322 | D315-S319 PolarHBondContact O-N 3.25Å; D315-S319 PolarHBondContact O-OG 2.95Å; E316-S319 WeakPolarHBondContact O-CA 3.4Å; E316-S319 VanDerWaalsContact O-CB 3.28Å; E316-S319 WeakPolarHBondContact O-CB 3.39Å; E316-S319 PolarHBondContact O-N 3.39Å; L317-S319 PolarHBondContact O-N 2.87Å; S319-L322 WeakPolarHBondContact O-CB 3.36Å; S319-L322 PolarHBondContact O-N 3.04Å |
| 320 | D | 49.9 | Very low | 59.6 | Low | 122 Ų | 122 | 84 Ų | 84 | 65% | 0.652 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -72.7 | -32.6 | 174.4 | -81.3 | -8.8 | 0 | 0 | 0 | 112.6 | E316 L317 L322 W323 | E316-D320 PolarHBondContact O-N 3.29Å; L317-D320 PolarHBondContact O-N 3.06Å; D320-L322 PolarHBondContact O-N 3.07Å; D320-W323 PolarHBondContact O-N 3.12Å |
| 321 | S | 54.3 | Low | 61.2 | Low | 51 Ų | 51 | 83.7 Ų | 83.7 | 36% | 0.357 | 45% | 0.448 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.4 | 9.5 | 174.9 | 64 | 0 | 0 | 0 | 0 | 113.7 | L317 T318 P325 | L317-S321 WeakPolarHBondContact O-CA 3.31Å; L317-S321 WeakPolarHBondContact O-CB 3.49Å; L317-S321 PolarHBondContact O-N 3.49Å; L317-S321 PolarHBondContact O-OG 3.48Å; T318-S321 WeakPolarHBondContact CA-OG 3.33Å; S321-P325 WeakPolarHBondContact O-CD 3.24Å; S321-P325 VanDerWaalsContact O-CG 3.25Å; S321-P325 WeakPolarHBondContact O-CG 3.45Å |
| 322 | L | 54.3 | Low | 63 | Low | 16 Ų | 16 | 79.6 Ų | 79.6 | 8% | 0.084 | 43% | 0.43 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -88.6 | -25.9 | 169.8 | -151.5 | 62.3 | 0 | 0 | 0 | 111.8 | S319 D320 P325 H404 Y408 | S319-L322 WeakPolarHBondContact O-CB 3.36Å; S319-L322 PolarHBondContact O-N 3.04Å; D320-L322 PolarHBondContact O-N 3.07Å; L322-P325 WeakPolarHBondContact O-CD 3.41Å; L322-P325 WeakPolarHBondContact O-CG 3.44Å; L322-H404 WeakPolarHBondContact CD1-ND1 3.4Å; L322-Y408 WeakPolarHBondContact CB-OH 3.44Å; L322-Y408 HydrophobicContact CD2-CD1 3.91Å; L322-Y408 HydrophobicContact CD2-CD2 3.91Å; L322-Y408 HydrophobicContact CD2-CE1 3.39Å; L322-Y408 HydrophobicContact CD2-CE2 3.37Å; L322-Y408 HydrophobicContact CD2-CG 4.16Å; L322-Y408 WeakPolarHBondContact CD2-OH 3.29Å; L322-Y408 HydrophobicContact CG-CD2 4.42Å; L322-Y408 HydrophobicContact CG-CE1 4.25Å; L322-Y408 HydrophobicContact CG-CE2 3.54Å; L322-Y408 VanDerWaalsContact CG-CZ 3.45Å; L322-Y408 VanDerWaalsContact CG-OH 3.3Å; L322-Y408 WeakPolarHBondContact CG-OH 3.41Å |
| 323 | W | 54.7 | Low | 64.8 | Low | 203 Ų | 203 | 78.3 Ų | 78.3 | 77% | 0.769 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -75.3 | -35.4 | 169.9 | -79.8 | 66.2 | 0 | 0 | 0 | 112 | D320 I326 G327 | D320-W323 PolarHBondContact O-N 3.12Å; W323-I326 PolarHBondContact O-N 3.36Å; W323-G327 PolarHBondContact O-N 2.8Å |
| 324 | F | 63.7 | Low | 67 | Low | 140 Ų | 140 | 76.9 Ų | 76.9 | 61% | 0.614 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -52.5 | -48.8 | 177.4 | -176.6 | -98.5 | 0 | 0 | 0 | 113.7 | A328 | F324-A328 WeakPolarHBondContact O-CB 3.38Å; F324-A328 PolarHBondContact O-N 2.88Å |
| 325 | P | 73.2 | Confident | 69 | Low | 19 Ų | 19 | 76.1 Ų | 76.1 | 12% | 0.123 | 41% | 0.41 | C | S | . | . | H | α-helix | trans | -66.4 | -45.2 | 177.6 | 11.5 | -18.8 | 0 | 0 | 0 | 112.3 | S321 L322 G327 A328 Y329 H404 | S321-P325 WeakPolarHBondContact O-CD 3.24Å; S321-P325 VanDerWaalsContact O-CG 3.25Å; S321-P325 WeakPolarHBondContact O-CG 3.45Å; L322-P325 WeakPolarHBondContact O-CD 3.41Å; L322-P325 WeakPolarHBondContact O-CG 3.44Å; P325-G327 VanDerWaalsContact C-N 3.33Å; P325-G327 PolarHBondContact O-N 2.79Å; P325-A328 WeakPolarHBondContact O-CB 3.3Å; P325-A328 PolarHBondContact O-N 3.24Å; P325-A328 VanDerWaalsContact O-N 3.11Å; P325-Y329 VanDerWaalsContact C-CD2 3.5Å; P325-Y329 VanDerWaalsContact C-CE2 3.42Å; P325-Y329 HydrophobicContact CB-CE2 3.67Å; P325-Y329 WeakPolarHBondContact O-CD2 3.49Å; P325-Y329 WeakPolarHBondContact O-CE2 3.19Å; P325-Y329 PolarHBondContact O-N 2.92Å; P325-H404 WeakPolarHBondContact CB-NE2 3.47Å; P325-H404 VanDerWaalsContact CG-CE1 3.44Å; P325-H404 WeakPolarHBondContact CG-CE1 3.38Å |
| 326 | I | 76.1 | Confident | 71.2 | Confident | 72 Ų | 72 | 72 Ų | 72 | 37% | 0.369 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -59.8 | -46.8 | 179.4 | -61.7 | 166.2 | 0 | 0 | 0 | 110.4 | W323 A328 Y329 V330 Y408 | W323-I326 PolarHBondContact O-N 3.36Å; I326-A328 VanDerWaalsContact C-N 3.34Å; I326-A328 PolarHBondContact O-N 2.94Å; I326-Y329 PolarHBondContact O-N 3.48Å; I326-V330 WeakPolarHBondContact O-CG2 3.48Å; I326-V330 PolarHBondContact O-N 3.49Å; I326-Y408 HydrophobicContact CD1-CE2 3.94Å |
| 327 | G | 81 | Confident | 73.4 | Confident | 36 Ų | 36 | 65.9 Ų | 65.9 | 37% | 0.371 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -57.7 | -46.3 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | W323 P325 Y329 V330 T331 | W323-G327 PolarHBondContact O-N 2.8Å; P325-G327 VanDerWaalsContact C-N 3.33Å; P325-G327 PolarHBondContact O-N 2.79Å; G327-Y329 VanDerWaalsContact C-N 3.28Å; G327-Y329 PolarHBondContact O-N 3.37Å; G327-V330 PolarHBondContact O-N 3.44Å; G327-T331 WeakPolarHBondContact O-CG2 3.4Å; G327-T331 PolarHBondContact O-N 2.93Å; G327-T331 PolarHBondContact O-OG1 3.23Å |
| 328 | A | 81 | Confident | 75.7 | Confident | 23 Ų | 23 | 62.2 Ų | 62.2 | 19% | 0.19 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -57.3 | -39.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | F265 F324 P325 I326 T331 L332 | F265-A328 HydrophobicContact CZ-CB 4.45Å; F324-A328 WeakPolarHBondContact O-CB 3.38Å; F324-A328 PolarHBondContact O-N 2.88Å; P325-A328 WeakPolarHBondContact O-CB 3.3Å; P325-A328 PolarHBondContact O-N 3.24Å; P325-A328 VanDerWaalsContact O-N 3.11Å; I326-A328 VanDerWaalsContact C-N 3.34Å; I326-A328 PolarHBondContact O-N 2.94Å; A328-T331 VanDerWaalsContact C-OG1 3.28Å; A328-T331 VanDerWaalsContact CA-OG1 3.29Å; A328-T331 WeakPolarHBondContact CA-OG1 3.32Å; A328-T331 PolarHBondContact O-N 3.48Å; A328-T331 PolarHBondContact O-OG1 3.37Å; A328-L332 WeakPolarHBondContact O-CB 3.45Å; A328-L332 PolarHBondContact O-N 3.22Å |
| 329 | Y | 82.3 | Confident | 77.8 | Confident | 31 Ų | 31 | 64 Ų | 64 | 12% | 0.122 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -71.6 | -41.6 | 178.6 | -52.4 | -45.9 | 0 | 0 | 0 | 113 | F265 P325 I326 G327 T331 L332 M333 L400 H404 | F265-Y329 HydrophobicContact CE1-CD1 4.37Å; F265-Y329 HydrophobicContact CE1-CE1 4.05Å; P325-Y329 VanDerWaalsContact C-CD2 3.5Å; P325-Y329 VanDerWaalsContact C-CE2 3.42Å; P325-Y329 HydrophobicContact CB-CE2 3.67Å; P325-Y329 WeakPolarHBondContact O-CD2 3.49Å; P325-Y329 WeakPolarHBondContact O-CE2 3.19Å; P325-Y329 PolarHBondContact O-N 2.92Å; I326-Y329 PolarHBondContact O-N 3.48Å; G327-Y329 VanDerWaalsContact C-N 3.28Å; G327-Y329 PolarHBondContact O-N 3.37Å; Y329-T331 VanDerWaalsContact C-N 3.27Å; Y329-T331 PolarHBondContact O-N 2.9Å; Y329-L332 WeakPolarHBondContact O-CB 3.37Å; Y329-L332 PolarHBondContact O-N 2.97Å; Y329-M333 PolarHBondContact O-N 3.35Å; Y329-L400 HydrophobicContact CD1-CD1 4.25Å; Y329-L400 HydrophobicContact CE1-CB 4.23Å; Y329-L400 HydrophobicContact CE1-CD1 3.57Å; Y329-L400 HydrophobicContact CE2-CB 4.17Å; Y329-H404 AromaticContact CE2-CD2 3.72Å; Y329-H404 AromaticContact CE2-NE2 3.78Å; Y329-H404 AromaticContact CZ-NE2 3.98Å; Y329-H404 PolarHBondContact OH-NE2 3.29Å |
| 330 | V | 87.3 | Confident | 79.9 | Confident | 87 Ų | 87 | 61.5 Ų | 61.5 | 53% | 0.527 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -61.1 | -41.4 | 173 | 175.7 | 0 | 0 | 0 | 0 | 109.8 | I326 G327 L332 M333 C334 | I326-V330 WeakPolarHBondContact O-CG2 3.48Å; I326-V330 PolarHBondContact O-N 3.49Å; G327-V330 PolarHBondContact O-N 3.44Å; V330-L332 PolarHBondContact O-N 3.11Å; V330-M333 PolarHBondContact O-N 3.34Å; V330-C334 WeakPolarHBondContact O-CB 3.31Å; V330-C334 PolarHBondContact O-N 3.18Å; V330-C334 PolarHBondContact O-SG 3.4Å |
| 331 | T | 87.6 | Confident | 81.9 | Confident | 81 Ų | 81 | 55.7 Ų | 55.7 | 50% | 0.497 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -65 | -38.5 | 175.5 | 59.1 | 0 | 0 | 0 | 0 | 112.4 | G327 A328 Y329 C334 L335 | G327-T331 WeakPolarHBondContact O-CG2 3.4Å; G327-T331 PolarHBondContact O-N 2.93Å; G327-T331 PolarHBondContact O-OG1 3.23Å; A328-T331 VanDerWaalsContact C-OG1 3.28Å; A328-T331 VanDerWaalsContact CA-OG1 3.29Å; A328-T331 WeakPolarHBondContact CA-OG1 3.32Å; A328-T331 PolarHBondContact O-N 3.48Å; A328-T331 PolarHBondContact O-OG1 3.37Å; Y329-T331 VanDerWaalsContact C-N 3.27Å; Y329-T331 PolarHBondContact O-N 2.9Å; T331-C334 PolarHBondContact O-N 3.16Å; T331-L335 WeakPolarHBondContact O-CB 3.35Å; T331-L335 VanDerWaalsContact O-CG 3.23Å; T331-L335 WeakPolarHBondContact O-CG 3.09Å; T331-L335 PolarHBondContact O-N 3.3Å |
| 332 | L | 88.3 | Confident | 83.7 | Confident | 39 Ų | 39 | 58.6 Ų | 58.6 | 20% | 0.204 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -62.1 | -45.7 | 175.8 | -175.8 | 78.1 | 0 | 0 | 0 | 111.5 | F265 A328 Y329 V330 L335 Y336 M396 | F265-L332 HydrophobicContact CD2-CD1 4.01Å; F265-L332 HydrophobicContact CE2-CD1 3.87Å; A328-L332 WeakPolarHBondContact O-CB 3.45Å; A328-L332 PolarHBondContact O-N 3.22Å; Y329-L332 WeakPolarHBondContact O-CB 3.37Å; Y329-L332 PolarHBondContact O-N 2.97Å; V330-L332 PolarHBondContact O-N 3.11Å; L332-L335 PolarHBondContact O-N 2.84Å; L332-Y336 WeakPolarHBondContact O-CB 3.44Å; L332-Y336 PolarHBondContact O-N 3.45Å; L332-M396 HydrophobicContact CD2-CE 3.19Å |
| 333 | M | 90.3 | Very high | 85.4 | Confident | 31 Ų | 31 | 59.9 Ų | 59.9 | 15% | 0.153 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -59.2 | -46.8 | 174.7 | -81.5 | -72.2 | -164.2 | 0 | 0 | 111.9 | Y329 V330 L335 Y336 C337 V393 V394 C397 | Y329-M333 PolarHBondContact O-N 3.35Å; V330-M333 PolarHBondContact O-N 3.34Å; M333-L335 VanDerWaalsContact C-N 3.35Å; M333-L335 PolarHBondContact O-N 3.26Å; M333-Y336 PolarHBondContact O-N 3.07Å; M333-C337 WeakPolarHBondContact O-CB 3.37Å; M333-C337 PolarHBondContact O-N 3.22Å; M333-C337 PolarHBondContact O-SG 3.38Å; M333-V393 HydrophobicContact CE-CG1 4.46Å; M333-V393 HydrophobicContact SD-CG1 4.08Å; M333-V394 VanDerWaalsContact CE-CA 3.47Å; M333-V394 HydrophobicContact CE-CB 3.99Å; M333-V394 HydrophobicContact CE-CG1 4.28Å; M333-V394 HydrophobicContact CE-CG2 3.67Å; M333-V394 HydrophobicContact SD-CG2 4.34Å; M333-C397 HydrophobicContact CE-CB 3.5Å; M333-C397 VanDerWaalsContact CE-SG 3.55Å |
| 334 | C | 92.6 | Very high | 86.9 | Confident | 58 Ų | 58 | 50.2 Ų | 50.2 | 39% | 0.392 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -62 | -41.1 | 176.7 | -71.9 | 0 | 0 | 0 | 0 | 112 | V330 T331 S338 | V330-C334 WeakPolarHBondContact O-CB 3.31Å; V330-C334 PolarHBondContact O-N 3.18Å; V330-C334 PolarHBondContact O-SG 3.4Å; T331-C334 PolarHBondContact O-N 3.16Å; C334-S338 WeakPolarHBondContact O-CB 3.41Å; C334-S338 PolarHBondContact O-N 3.18Å; C334-S338 PolarHBondContact O-OG 3.22Å |
| 335 | L | 92.9 | Very high | 88 | Confident | 110 Ų | 110 | 45.2 Ų | 45.2 | 58% | 0.576 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -64.3 | -44.3 | 176.2 | -73.6 | 170.5 | 0 | 0 | 0 | 111.3 | T331 L332 M333 S338 I339 | T331-L335 WeakPolarHBondContact O-CB 3.35Å; T331-L335 VanDerWaalsContact O-CG 3.23Å; T331-L335 WeakPolarHBondContact O-CG 3.09Å; T331-L335 PolarHBondContact O-N 3.3Å; L332-L335 PolarHBondContact O-N 2.84Å; M333-L335 VanDerWaalsContact C-N 3.35Å; M333-L335 PolarHBondContact O-N 3.26Å; L335-S338 WeakPolarHBondContact O-CB 3.3Å; L335-S338 PolarHBondContact O-N 3.43Å; L335-S338 VanDerWaalsContact O-N 3.16Å; L335-I339 WeakPolarHBondContact O-CG1 3.43Å; L335-I339 PolarHBondContact O-N 3.33Å |
| 336 | Y | 93.9 | Very high | 88.6 | Confident | 29 Ų | 29 | 48 Ų | 48 | 11% | 0.114 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -64.3 | -43.1 | 177.7 | -173 | -97 | 0 | 0 | 0 | 112.6 | L332 M333 S338 I339 G340 V364 Y386 I389 G390 V393 | L332-Y336 WeakPolarHBondContact O-CB 3.44Å; L332-Y336 PolarHBondContact O-N 3.45Å; M333-Y336 PolarHBondContact O-N 3.07Å; Y336-S338 VanDerWaalsContact C-N 3.26Å; Y336-S338 PolarHBondContact O-N 2.89Å; Y336-I339 PolarHBondContact O-N 3.49Å; Y336-G340 PolarHBondContact O-N 2.7Å; Y336-G340 VanDerWaalsContact O-N 3.09Å; Y336-V364 HydrophobicContact CD1-CG1 4.23Å; Y336-V364 HydrophobicContact CD1-CG2 4.01Å; Y336-V364 HydrophobicContact CE1-CG1 4.29Å; Y336-V364 HydrophobicContact CE1-CG2 3.64Å; Y336-Y386 HydrophobicContact CD1-CE2 4.14Å; Y336-Y386 HydrophobicContact CE1-CD2 4.1Å; Y336-Y386 HydrophobicContact CE1-CE1 4.44Å; Y336-Y386 AromaticContact CE1-CE2 3.39Å; Y336-Y386 HydrophobicContact CE1-CE2 3.39Å; Y336-Y386 AromaticContact CE1-CZ 3.59Å; Y336-Y386 HydrophobicContact CE2-CE2 4.22Å; Y336-Y386 AromaticContact CZ-CD2 3.75Å; Y336-Y386 AromaticContact CZ-CE2 3.45Å; Y336-Y386 VanDerWaalsContact CZ-CE2 3.45Å; Y336-Y386 PolarHBondContact O-OH 3.2Å; Y336-Y386 VanDerWaalsContact OH-CD2 3.26Å; Y336-Y386 WeakPolarHBondContact OH-CD2 3.46Å; Y336-Y386 WeakPolarHBondContact OH-CE2 2.72Å; Y336-Y386 PolarHBondContact OH-O 3.39Å; Y336-I389 HydrophobicContact CE2-CG2 3.81Å; Y336-G390 WeakPolarHBondContact OH-CA 3.35Å; Y336-G390 PolarHBondContact OH-N 3.42Å; Y336-V393 HydrophobicContact CD2-CG2 4.05Å; Y336-V393 HydrophobicContact CE2-CG2 4.16Å; Y336-V393 HydrophobicContact CG-CG1 4.43Å; Y336-V393 HydrophobicContact CG-CG2 4.31Å |
| 337 | C | 93.6 | Very high | 88.7 | Confident | 0 Ų | 0 | 46.4 Ų | 46.4 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -64.9 | -32.2 | 173.5 | -65.4 | 0 | 0 | 0 | 0 | 111.7 | M333 G340 A341 F357 | M333-C337 WeakPolarHBondContact O-CB 3.37Å; M333-C337 PolarHBondContact O-N 3.22Å; M333-C337 PolarHBondContact O-SG 3.38Å; C337-G340 PolarHBondContact O-N 2.9Å; C337-A341 WeakPolarHBondContact O-CB 3.34Å; C337-A341 PolarHBondContact O-N 2.94Å; C337-F357 HydrophobicContact CB-CD2 4.07Å; C337-F357 HydrophobicContact CB-CE2 3.52Å; C337-F357 HydrophobicContact CB-CZ 3.83Å |
| 338 | S | 94.8 | Very high | 88.4 | Confident | 36 Ų | 36 | 48.2 Ų | 48.2 | 25% | 0.252 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -67.5 | -39.7 | 174.7 | -58.6 | 0 | 0 | 0 | 0 | 111.9 | C334 L335 Y336 G340 A341 L342 | C334-S338 WeakPolarHBondContact O-CB 3.41Å; C334-S338 PolarHBondContact O-N 3.18Å; C334-S338 PolarHBondContact O-OG 3.22Å; L335-S338 WeakPolarHBondContact O-CB 3.3Å; L335-S338 PolarHBondContact O-N 3.43Å; L335-S338 VanDerWaalsContact O-N 3.16Å; Y336-S338 VanDerWaalsContact C-N 3.26Å; Y336-S338 PolarHBondContact O-N 2.89Å; S338-G340 VanDerWaalsContact C-N 3.33Å; S338-G340 PolarHBondContact O-N 2.67Å; S338-A341 PolarHBondContact O-N 3.32Å; S338-L342 WeakPolarHBondContact O-CG 3.43Å; S338-L342 PolarHBondContact O-N 3.47Å |
| 339 | I | 93.3 | Very high | 88 | Confident | 108 Ų | 108 | 54.1 Ų | 54.1 | 55% | 0.554 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -60.5 | -45.3 | 172.9 | -65.6 | 166.2 | 0 | 0 | 0 | 110.1 | L335 Y336 L342 L343 | L335-I339 WeakPolarHBondContact O-CG1 3.43Å; L335-I339 PolarHBondContact O-N 3.33Å; Y336-I339 PolarHBondContact O-N 3.49Å; I339-L342 PolarHBondContact O-N 3.2Å; I339-L343 WeakPolarHBondContact O-CB 3.23Å; I339-L343 PolarHBondContact O-N 2.88Å |
| 340 | G | 92.2 | Very high | 87.8 | Confident | 0 Ų | 0 | 59.6 Ų | 59.6 | 0% | 0 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -62.4 | -40.8 | 174.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | Y336 C337 S338 L342 L343 F344 Y386 | Y336-G340 PolarHBondContact O-N 2.7Å; Y336-G340 VanDerWaalsContact O-N 3.09Å; C337-G340 PolarHBondContact O-N 2.9Å; S338-G340 VanDerWaalsContact C-N 3.33Å; S338-G340 PolarHBondContact O-N 2.67Å; G340-L342 PolarHBondContact O-N 2.96Å; G340-L343 VanDerWaalsContact O-CB 3.32Å; G340-L343 WeakPolarHBondContact O-CB 3.41Å; G340-L343 PolarHBondContact O-N 3.33Å; G340-F344 WeakPolarHBondContact O-CD2 3.33Å; G340-F344 WeakPolarHBondContact O-CG 3.28Å; G340-F344 PolarHBondContact O-N 2.98Å; G340-Y386 VanDerWaalsContact CA-CE2 3.48Å |
| 341 | A | 92.6 | Very high | 87.5 | Confident | 0 Ų | 0 | 58.6 Ų | 58.6 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -62.5 | -43 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | C337 S338 L343 F344 C345 F353 A356 F357 | C337-A341 WeakPolarHBondContact O-CB 3.34Å; C337-A341 PolarHBondContact O-N 2.94Å; S338-A341 PolarHBondContact O-N 3.32Å; A341-L343 VanDerWaalsContact C-N 3.32Å; A341-F344 PolarHBondContact O-N 2.85Å; A341-C345 WeakPolarHBondContact O-CB 3.3Å; A341-C345 PolarHBondContact O-N 3.34Å; A341-C345 PolarHBondContact O-SG 3.31Å; A341-F353 HydrophobicContact CB-CD2 4.02Å; A341-F353 HydrophobicContact CB-CE2 3.61Å; A341-F353 HydrophobicContact CB-CZ 4.12Å; A341-A356 HydrophobicContact CB-CB 4.21Å; A341-F357 HydrophobicContact CB-CB 3.94Å; A341-F357 HydrophobicContact CB-CD2 4.32Å |
| 342 | L | 91.8 | Very high | 87.5 | Confident | 112 Ų | 112 | 56.4 Ų | 56.4 | 59% | 0.586 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -63.9 | -39.1 | 174.6 | -68.6 | 174.8 | 0 | 0 | 0 | 111.6 | S338 I339 G340 S346 F353 | S338-L342 WeakPolarHBondContact O-CG 3.43Å; S338-L342 PolarHBondContact O-N 3.47Å; I339-L342 PolarHBondContact O-N 3.2Å; G340-L342 PolarHBondContact O-N 2.96Å; L342-S346 WeakPolarHBondContact O-CB 3.43Å; L342-S346 PolarHBondContact O-N 2.9Å; L342-F353 HydrophobicContact CD2-CD2 4.42Å; L342-F353 HydrophobicContact CD2-CE2 4.18Å; L342-F353 HydrophobicContact CG-CE2 4.37Å |
| 343 | L | 89.6 | Confident | 87.7 | Confident | 42 Ų | 42 | 59.3 Ų | 59.3 | 22% | 0.22 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -60.1 | -47.7 | 174.1 | -169 | 76.7 | 0 | 0 | 0 | 110.7 | I339 G340 A341 S346 F347 L382 | I339-L343 WeakPolarHBondContact O-CB 3.23Å; I339-L343 PolarHBondContact O-N 2.88Å; G340-L343 VanDerWaalsContact O-CB 3.32Å; G340-L343 WeakPolarHBondContact O-CB 3.41Å; G340-L343 PolarHBondContact O-N 3.33Å; A341-L343 VanDerWaalsContact C-N 3.32Å; L343-S346 WeakPolarHBondContact O-CB 3.25Å; L343-S346 PolarHBondContact O-N 3.28Å; L343-F347 HydrophobicContact CB-CE2 4.4Å; L343-F347 HydrophobicContact CD1-CE1 4.37Å; L343-F347 HydrophobicContact CD1-CE2 4.09Å; L343-F347 HydrophobicContact CD1-CZ 3.54Å; L343-F347 HydrophobicContact CD2-CE2 3.92Å; L343-F347 HydrophobicContact CD2-CZ 4.11Å; L343-F347 HydrophobicContact CG-CD2 4.48Å; L343-F347 HydrophobicContact CG-CE2 3.43Å; L343-F347 VanDerWaalsContact CG-CE2 3.43Å; L343-F347 HydrophobicContact CG-CZ 3.44Å; L343-F347 VanDerWaalsContact CG-CZ 3.44Å; L343-F347 WeakPolarHBondContact O-CD2 3.1Å; L343-F347 VanDerWaalsContact O-CE2 3.24Å; L343-F347 WeakPolarHBondContact O-CE2 3.39Å; L343-F347 VanDerWaalsContact O-CG 3.29Å; L343-F347 WeakPolarHBondContact O-CG 3.3Å; L343-F347 PolarHBondContact O-N 3.16Å; L343-L382 HydrophobicContact CD1-CD1 4.21Å; L343-L382 HydrophobicContact CD2-CB 4.39Å |
| 344 | F | 87 | Confident | 87.7 | Confident | 1 Ų | 1 | 63.5 Ų | 63.5 | 0% | 0.004 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -70.4 | -39 | 179.1 | -67.3 | -56.4 | 0 | 0 | 0 | 114 | G340 A341 S346 F347 E348 W351 A356 F359 A360 I372 I383 Y386 | G340-F344 WeakPolarHBondContact O-CD2 3.33Å; G340-F344 WeakPolarHBondContact O-CG 3.28Å; G340-F344 PolarHBondContact O-N 2.98Å; A341-F344 PolarHBondContact O-N 2.85Å; F344-S346 PolarHBondContact O-N 3.44Å; F344-F347 HydrophobicContact CD1-CD2 4.14Å; F344-F347 HydrophobicContact CD1-CE2 4.49Å; F344-F347 PolarHBondContact O-N 2.89Å; F344-E348 PolarHBondContact O-N 3.38Å; F344-W351 HydrophobicContact CB-CE3 4.22Å; F344-W351 HydrophobicContact CB-CZ3 4.28Å; F344-W351 HydrophobicContact CG-CZ3 4.49Å; F344-A356 HydrophobicContact CB-CB 4.01Å; F344-F359 HydrophobicContact CD1-CD1 4.4Å; F344-F359 HydrophobicContact CD1-CE1 4.42Å; F344-F359 AromaticContact CD2-CD1 3.99Å; F344-F359 HydrophobicContact CD2-CD1 3.99Å; F344-F359 HydrophobicContact CE1-CD1 4.16Å; F344-F359 AromaticContact CE1-CE1 3.87Å; F344-F359 HydrophobicContact CE1-CE1 3.87Å; F344-F359 AromaticContact CE2-CD1 3.75Å; F344-F359 HydrophobicContact CE2-CD1 3.75Å; F344-F359 HydrophobicContact CE2-CE1 4.1Å; F344-F359 HydrophobicContact CG-CD1 4.34Å; F344-F359 AromaticContact CZ-CD1 3.85Å; F344-F359 HydrophobicContact CZ-CD1 3.85Å; F344-F359 AromaticContact CZ-CE1 3.7Å; F344-F359 HydrophobicContact CZ-CE1 3.7Å; F344-A360 HydrophobicContact CD2-CB 4Å; F344-A360 HydrophobicContact CE2-CB 3.84Å; F344-I372 HydrophobicContact CD1-CD1 4.12Å; F344-I372 HydrophobicContact CE1-CD1 4.36Å; F344-I383 HydrophobicContact CE1-CD1 4.01Å; F344-I383 HydrophobicContact CE1-CG1 3.93Å; F344-Y386 HydrophobicContact CE2-CE1 4.32Å |
| 345 | C | 87.5 | Confident | 87.6 | Confident | 34 Ų | 34 | 67 Ų | 67 | 23% | 0.23 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -64.5 | -27.4 | 173.6 | -78.2 | 0 | 0 | 0 | 0 | 112.6 | A341 F347 W351 A356 | A341-C345 WeakPolarHBondContact O-CB 3.3Å; A341-C345 PolarHBondContact O-N 3.34Å; A341-C345 PolarHBondContact O-SG 3.31Å; C345-F347 VanDerWaalsContact C-N 3.28Å; C345-W351 PolarHBondContact SG-O 3.03Å; C345-W351 VanDerWaalsContact SG-O 3.39Å; C345-A356 VanDerWaalsContact SG-CB 3.51Å |
| 346 | S | 84.3 | Confident | 87.5 | Confident | 78 Ų | 78 | 61.8 Ų | 61.8 | 55% | 0.545 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -70.3 | -24.9 | 172.6 | 164.7 | 0 | 0 | 0 | 0 | 112.8 | L342 L343 F344 | L342-S346 WeakPolarHBondContact O-CB 3.43Å; L342-S346 PolarHBondContact O-N 2.9Å; L343-S346 WeakPolarHBondContact O-CB 3.25Å; L343-S346 PolarHBondContact O-N 3.28Å; F344-S346 PolarHBondContact O-N 3.44Å |
| 347 | F | 78.3 | Confident | 87.4 | Confident | 39 Ų | 39 | 62.7 Ų | 62.7 | 17% | 0.171 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -92.2 | -48 | -177 | -55.9 | -39.6 | 0 | 0 | 0 | 111.6 | L343 F344 C345 Y379 L382 | L343-F347 HydrophobicContact CB-CE2 4.4Å; L343-F347 HydrophobicContact CD1-CE1 4.37Å; L343-F347 HydrophobicContact CD1-CE2 4.09Å; L343-F347 HydrophobicContact CD1-CZ 3.54Å; L343-F347 HydrophobicContact CD2-CE2 3.92Å; L343-F347 HydrophobicContact CD2-CZ 4.11Å; L343-F347 HydrophobicContact CG-CD2 4.48Å; L343-F347 HydrophobicContact CG-CE2 3.43Å; L343-F347 VanDerWaalsContact CG-CE2 3.43Å; L343-F347 HydrophobicContact CG-CZ 3.44Å; L343-F347 VanDerWaalsContact CG-CZ 3.44Å; L343-F347 WeakPolarHBondContact O-CD2 3.1Å; L343-F347 VanDerWaalsContact O-CE2 3.24Å; L343-F347 WeakPolarHBondContact O-CE2 3.39Å; L343-F347 VanDerWaalsContact O-CG 3.29Å; L343-F347 WeakPolarHBondContact O-CG 3.3Å; L343-F347 PolarHBondContact O-N 3.16Å; F344-F347 HydrophobicContact CD1-CD2 4.14Å; F344-F347 HydrophobicContact CD1-CE2 4.49Å; F344-F347 PolarHBondContact O-N 2.89Å; C345-F347 VanDerWaalsContact C-N 3.28Å; F347-Y379 AromaticContact CD1-CD1 3.37Å; F347-Y379 HydrophobicContact CD1-CD1 3.37Å; F347-Y379 AromaticContact CD1-CD2 3.96Å; F347-Y379 HydrophobicContact CD1-CD2 3.96Å; F347-Y379 AromaticContact CD1-CE1 3.42Å; F347-Y379 HydrophobicContact CD1-CE1 3.42Å; F347-Y379 VanDerWaalsContact CD1-CE1 3.42Å; F347-Y379 HydrophobicContact CD1-CE2 4.06Å; F347-Y379 AromaticContact CD1-CG 3.64Å; F347-Y379 HydrophobicContact CD1-CG 3.64Å; F347-Y379 AromaticContact CD1-CZ 3.78Å; F347-Y379 AromaticContact CE1-CD1 2.91Å; F347-Y379 HydrophobicContact CE1-CD1 2.91Å; F347-Y379 HydrophobicContact CE1-CD2 4.33Å; F347-Y379 AromaticContact CE1-CE1 3.16Å; F347-Y379 HydrophobicContact CE1-CE1 3.16Å; F347-Y379 AromaticContact CE1-CG 3.58Å; F347-Y379 HydrophobicContact CE1-CG 3.58Å; F347-Y379 HydrophobicContact CG-CD1 4.41Å; F347-Y379 HydrophobicContact CG-CG 4.32Å; F347-Y379 AromaticContact CZ-CD1 3.59Å; F347-Y379 HydrophobicContact CZ-CD1 3.59Å; F347-Y379 HydrophobicContact CZ-CE1 4.23Å; F347-Y379 HydrophobicContact CZ-CG 4.09Å; F347-L382 HydrophobicContact CE1-CD1 4.48Å; F347-L382 HydrophobicContact CZ-CD1 4.09Å |
| 348 | E | 76.3 | Confident | 87.3 | Confident | 74 Ų | 74 | 67 Ų | 67 | 35% | 0.346 | 35% | 0.351 | S | S | . | . | trans | -108.6 | 99.6 | -174.8 | -161.6 | 64.4 | -139.2 | 0 | 0 | 109.1 | F344 D350 W351 | F344-E348 PolarHBondContact O-N 3.38Å; E348-D350 PolarHBondContact O-N 2.91Å; E348-D350 VanDerWaalsContact O-N 3.13Å; E348-W351 HydrophobicContact CB-CB 4.21Å; E348-W351 HydrophobicContact CB-CD2 3.96Å; E348-W351 HydrophobicContact CB-CG 3.78Å; E348-W351 HydrophobicContact CG-CB 4.44Å; E348-W351 HydrophobicContact CG-CD2 4.01Å; E348-W351 HydrophobicContact CG-CG 3.69Å; E348-W351 PolarHBondContact O-N 3.15Å | ||
| 349 | N | 72.5 | Confident | 87.1 | Confident | 147 Ų | 147 | 66 Ų | 66 | 79% | 0.786 | 34% | 0.342 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -61.2 | -23.7 | -176.9 | -67.4 | -49.9 | 0 | 0 | 0 | 112.8 | W351 | N349-W351 VanDerWaalsContact C-N 3.28Å; N349-W351 PolarHBondContact O-N 3.34Å |
| 350 | D | 77.6 | Confident | 87 | Confident | 145 Ų | 145 | 60.9 Ų | 60.9 | 78% | 0.775 | 32% | 0.316 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.2 | -7.9 | 179.9 | -66.8 | -25.7 | 0 | 0 | 0 | 112.9 | E348 | E348-D350 PolarHBondContact O-N 2.91Å; E348-D350 VanDerWaalsContact O-N 3.13Å |
| 351 | W | 80.6 | Confident | 87 | Confident | 66 Ų | 66 | 64.9 Ų | 64.9 | 25% | 0.25 | 33% | 0.333 | C | S | . | . | trans | -91.8 | 117.6 | -175.2 | -75.7 | 20.8 | 0 | 0 | 0 | 112.5 | F344 C345 E348 N349 A356 F359 I372 | F344-W351 HydrophobicContact CB-CE3 4.22Å; F344-W351 HydrophobicContact CB-CZ3 4.28Å; F344-W351 HydrophobicContact CG-CZ3 4.49Å; C345-W351 PolarHBondContact SG-O 3.03Å; C345-W351 VanDerWaalsContact SG-O 3.39Å; E348-W351 HydrophobicContact CB-CB 4.21Å; E348-W351 HydrophobicContact CB-CD2 3.96Å; E348-W351 HydrophobicContact CB-CG 3.78Å; E348-W351 HydrophobicContact CG-CB 4.44Å; E348-W351 HydrophobicContact CG-CD2 4.01Å; E348-W351 HydrophobicContact CG-CG 3.69Å; E348-W351 PolarHBondContact O-N 3.15Å; N349-W351 VanDerWaalsContact C-N 3.28Å; N349-W351 PolarHBondContact O-N 3.34Å; W351-A356 HydrophobicContact CE3-CB 4.25Å; W351-F359 HydrophobicContact CH2-CD1 4.24Å; W351-F359 HydrophobicContact CH2-CD2 4.37Å; W351-F359 HydrophobicContact CH2-CG 4.14Å; W351-F359 HydrophobicContact CZ3-CB 4.12Å; W351-F359 AromaticContact CZ3-CD1 3.93Å; W351-F359 HydrophobicContact CZ3-CD1 3.93Å; W351-F359 AromaticContact CZ3-CG 3.96Å; W351-F359 HydrophobicContact CZ3-CG 3.96Å; W351-I372 HydrophobicContact CH2-CB 4.25Å; W351-I372 HydrophobicContact CH2-CD1 3.65Å; W351-I372 HydrophobicContact CH2-CG1 4Å; W351-I372 HydrophobicContact CZ2-CD1 4.29Å; W351-I372 HydrophobicContact CZ2-CG1 4.29Å; W351-I372 HydrophobicContact CZ3-CD1 4.09Å | ||
| 352 | G | 88.1 | Confident | 86.9 | Confident | 35 Ų | 35 | 65.5 Ų | 65.5 | 36% | 0.361 | 34% | 0.337 | S | S | . | . | trans | -64.3 | 148 | 165.6 | 0 | 0 | 0 | 0 | 0 | 112 | I354 H355 A356 | G352-I354 PolarHBondContact O-N 3.28Å; G352-I354 VanDerWaalsContact O-N 3.12Å; G352-H355 PolarHBondContact O-N 3.06Å; G352-A356 PolarHBondContact O-N 3.27Å; G352-A356 VanDerWaalsContact O-N 3.09Å | ||
| 353 | F | 91.5 | Very high | 86.8 | Confident | 100 Ų | 100 | 60.2 Ų | 60.2 | 44% | 0.439 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -51 | -39.7 | -178.6 | 179 | -98.3 | 0 | 0 | 0 | 113.6 | A341 L342 A356 F357 | A341-F353 HydrophobicContact CB-CD2 4.02Å; A341-F353 HydrophobicContact CB-CE2 3.61Å; A341-F353 HydrophobicContact CB-CZ 4.12Å; L342-F353 HydrophobicContact CD2-CD2 4.42Å; L342-F353 HydrophobicContact CD2-CE2 4.18Å; L342-F353 HydrophobicContact CG-CE2 4.37Å; F353-A356 PolarHBondContact O-N 3.48Å; F353-F357 HydrophobicContact CZ-CD2 4.41Å; F353-F357 VanDerWaalsContact O-CB 3.3Å; F353-F357 WeakPolarHBondContact O-CB 3.45Å; F353-F357 PolarHBondContact O-N 2.82Å |
| 354 | I | 91.6 | Very high | 86.9 | Confident | 119 Ų | 119 | 58.3 Ų | 58.3 | 61% | 0.61 | 30% | 0.299 | S | S | * | . | H | α-helix | trans | -67.9 | -36.3 | -179.7 | -165 | 61.9 | 0 | 0 | 0 | 112.8 | G352 F357 H358 | G352-I354 PolarHBondContact O-N 3.28Å; G352-I354 VanDerWaalsContact O-N 3.12Å; I354-F357 PolarHBondContact O-N 3.04Å; I354-H358 WeakPolarHBondContact O-CB 3.5Å; I354-H358 PolarHBondContact O-N 2.89Å |
| 355 | H | 89.6 | Confident | 87 | Confident | 133 Ų | 133 | 60.5 Ų | 60.5 | 62% | 0.616 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -68.7 | -43.8 | 176.1 | -70.7 | -65.5 | 0 | 0 | 0 | 110.3 | G352 H358 F359 | G352-H355 PolarHBondContact O-N 3.06Å; H355-H358 PolarHBondContact O-N 3.34Å; H355-F359 WeakPolarHBondContact O-CB 3.39Å; H355-F359 PolarHBondContact O-N 3.36Å |
| 356 | A | 90.7 | Very high | 87.1 | Confident | 0 Ų | 0 | 61.4 Ų | 61.4 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -61.9 | -42.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | A341 F344 C345 W351 G352 F353 F359 A360 | A341-A356 HydrophobicContact CB-CB 4.21Å; F344-A356 HydrophobicContact CB-CB 4.01Å; C345-A356 VanDerWaalsContact SG-CB 3.51Å; W351-A356 HydrophobicContact CE3-CB 4.25Å; G352-A356 PolarHBondContact O-N 3.27Å; G352-A356 VanDerWaalsContact O-N 3.09Å; F353-A356 PolarHBondContact O-N 3.48Å; A356-F359 PolarHBondContact O-N 3.37Å; A356-A360 WeakPolarHBondContact O-CB 3.17Å; A356-A360 PolarHBondContact O-N 3.14Å |
| 357 | F | 92.8 | Very high | 87.4 | Confident | 47 Ų | 47 | 61.9 Ų | 61.9 | 21% | 0.206 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -63.2 | -45.8 | 176.5 | -176.2 | -86 | 0 | 0 | 0 | 112 | C337 A341 F353 I354 F359 A360 F361 | C337-F357 HydrophobicContact CB-CD2 4.07Å; C337-F357 HydrophobicContact CB-CE2 3.52Å; C337-F357 HydrophobicContact CB-CZ 3.83Å; A341-F357 HydrophobicContact CB-CB 3.94Å; A341-F357 HydrophobicContact CB-CD2 4.32Å; F353-F357 HydrophobicContact CZ-CD2 4.41Å; F353-F357 VanDerWaalsContact O-CB 3.3Å; F353-F357 WeakPolarHBondContact O-CB 3.45Å; F353-F357 PolarHBondContact O-N 2.82Å; I354-F357 PolarHBondContact O-N 3.04Å; F357-F359 VanDerWaalsContact C-N 3.3Å; F357-F359 PolarHBondContact O-N 2.83Å; F357-A360 PolarHBondContact O-N 3.37Å; F357-F361 WeakPolarHBondContact O-CB 3.49Å; F357-F361 PolarHBondContact O-N 3.22Å |
| 358 | H | 91.6 | Very high | 87.5 | Confident | 91 Ų | 91 | 60.5 Ų | 60.5 | 42% | 0.421 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -61 | -40.9 | 176.4 | -178.6 | -122.7 | 0 | 0 | 0 | 111.8 | I354 H355 N362 M369 | I354-H358 WeakPolarHBondContact O-CB 3.5Å; I354-H358 PolarHBondContact O-N 2.89Å; H355-H358 PolarHBondContact O-N 3.34Å; H358-N362 PolarHBondContact CD2-ND2 3.24Å; H358-N362 PolarHBondContact CE1-ND2 3.32Å; H358-N362 PolarHBondContact NE2-ND2 3.28Å; H358-N362 WeakPolarHBondContact O-CB 3.48Å; H358-N362 VanDerWaalsContact O-CG 3.31Å; H358-N362 PolarHBondContact O-N 2.87Å; H358-N362 PolarHBondContact O-ND2 3.06Å; H358-N362 VanDerWaalsContact O-ND2 3.11Å; H358-M369 WeakPolarHBondContact CE1-CE 3.47Å; H358-M369 VanDerWaalsContact CE1-SD 3.55Å; H358-M369 VanDerWaalsContact ND1-CE 3.27Å; H358-M369 WeakPolarHBondContact ND1-CE 3.4Å |
| 359 | F | 89.6 | Confident | 87.3 | Confident | 15 Ų | 15 | 61.2 Ų | 61.2 | 7% | 0.066 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -66.3 | -44.4 | 175.9 | -176.3 | -97.8 | 0 | 0 | 0 | 112.5 | Y225 F344 W351 H355 A356 F357 N362 T363 I372 | Y225-F359 HydrophobicContact CE1-CZ 4.22Å; F344-F359 HydrophobicContact CD1-CD1 4.4Å; F344-F359 HydrophobicContact CD1-CE1 4.42Å; F344-F359 AromaticContact CD2-CD1 3.99Å; F344-F359 HydrophobicContact CD2-CD1 3.99Å; F344-F359 HydrophobicContact CE1-CD1 4.16Å; F344-F359 AromaticContact CE1-CE1 3.87Å; F344-F359 HydrophobicContact CE1-CE1 3.87Å; F344-F359 AromaticContact CE2-CD1 3.75Å; F344-F359 HydrophobicContact CE2-CD1 3.75Å; F344-F359 HydrophobicContact CE2-CE1 4.1Å; F344-F359 HydrophobicContact CG-CD1 4.34Å; F344-F359 AromaticContact CZ-CD1 3.85Å; F344-F359 HydrophobicContact CZ-CD1 3.85Å; F344-F359 AromaticContact CZ-CE1 3.7Å; F344-F359 HydrophobicContact CZ-CE1 3.7Å; W351-F359 HydrophobicContact CH2-CD1 4.24Å; W351-F359 HydrophobicContact CH2-CD2 4.37Å; W351-F359 HydrophobicContact CH2-CG 4.14Å; W351-F359 HydrophobicContact CZ3-CB 4.12Å; W351-F359 AromaticContact CZ3-CD1 3.93Å; W351-F359 HydrophobicContact CZ3-CD1 3.93Å; W351-F359 AromaticContact CZ3-CG 3.96Å; W351-F359 HydrophobicContact CZ3-CG 3.96Å; H355-F359 WeakPolarHBondContact O-CB 3.39Å; H355-F359 PolarHBondContact O-N 3.36Å; A356-F359 PolarHBondContact O-N 3.37Å; F357-F359 VanDerWaalsContact C-N 3.3Å; F357-F359 PolarHBondContact O-N 2.83Å; F359-N362 PolarHBondContact O-N 2.82Å; F359-T363 VanDerWaalsContact O-CB 3.28Å; F359-T363 WeakPolarHBondContact O-CB 3.47Å; F359-T363 PolarHBondContact O-N 3.05Å; F359-T363 PolarHBondContact O-OG1 3.47Å; F359-I372 HydrophobicContact CE1-CD1 4.47Å; F359-I372 HydrophobicContact CE1-CG2 4.23Å; F359-I372 HydrophobicContact CZ-CB 4.07Å; F359-I372 HydrophobicContact CZ-CG2 3.73Å |
| 360 | A | 91.3 | Very high | 87 | Confident | 0 Ų | 0 | 54.3 Ų | 54.3 | 0% | 0 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -60 | -48.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | F344 A356 F357 T363 V364 | F344-A360 HydrophobicContact CD2-CB 4Å; F344-A360 HydrophobicContact CE2-CB 3.84Å; A356-A360 WeakPolarHBondContact O-CB 3.17Å; A356-A360 PolarHBondContact O-N 3.14Å; F357-A360 PolarHBondContact O-N 3.37Å; A360-T363 WeakPolarHBondContact O-CB 3.44Å; A360-T363 PolarHBondContact O-N 3.31Å; A360-V364 VanDerWaalsContact O-CG2 3.3Å; A360-V364 WeakPolarHBondContact O-CG2 3.16Å; A360-V364 PolarHBondContact O-N 3.11Å |
| 361 | F | 92.5 | Very high | 86.4 | Confident | 84 Ų | 84 | 54 Ų | 54 | 37% | 0.368 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -58.2 | -51 | 177.5 | 177 | -98.6 | 0 | 0 | 0 | 112.2 | F357 T363 V364 V365 | F357-F361 WeakPolarHBondContact O-CB 3.49Å; F357-F361 PolarHBondContact O-N 3.22Å; F361-T363 PolarHBondContact O-N 3.21Å; F361-V364 PolarHBondContact O-N 3.41Å; F361-V365 HydrophobicContact CD2-CG2 4.04Å; F361-V365 HydrophobicContact CE1-CG2 4.22Å; F361-V365 HydrophobicContact CE2-CG2 3.67Å; F361-V365 HydrophobicContact CG-CG2 4.47Å; F361-V365 HydrophobicContact CZ-CG2 3.78Å; F361-V365 WeakPolarHBondContact O-CB 3.29Å; F361-V365 WeakPolarHBondContact O-CG2 3.33Å; F361-V365 PolarHBondContact O-N 2.93Å |
| 362 | N | 90.6 | Very high | 85.9 | Confident | 14 Ų | 14 | 52 Ų | 52 | 8% | 0.075 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -65.3 | -28.9 | 179.9 | -72.1 | -30.5 | 0 | 0 | 0 | 112.9 | H358 F359 T366 V367 G368 M369 | H358-N362 PolarHBondContact CD2-ND2 3.24Å; H358-N362 PolarHBondContact CE1-ND2 3.32Å; H358-N362 PolarHBondContact NE2-ND2 3.28Å; H358-N362 WeakPolarHBondContact O-CB 3.48Å; H358-N362 VanDerWaalsContact O-CG 3.31Å; H358-N362 PolarHBondContact O-N 2.87Å; H358-N362 PolarHBondContact O-ND2 3.06Å; H358-N362 VanDerWaalsContact O-ND2 3.11Å; F359-N362 PolarHBondContact O-N 2.82Å; N362-T366 PolarHBondContact O-N 3.25Å; N362-V367 HydrophobicContact CB-CB 4.27Å; N362-V367 PolarHBondContact O-N 3.39Å; N362-G368 PolarHBondContact O-N 3.29Å; N362-M369 HydrophobicContact CB-CG 4.42Å; N362-M369 WeakPolarHBondContact ND2-CE 3.23Å; N362-M369 PolarHBondContact ND2-SD 2.68Å |
| 363 | T | 89.4 | Confident | 85 | Confident | 1 Ų | 1 | 54.3 Ų | 54.3 | 1% | 0.006 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -69.3 | -48.6 | 174 | -70.5 | 0 | 0 | 0 | 0 | 111.1 | C223 Y225 F359 A360 F361 T366 V387 | C223-T363 PolarHBondContact SG-O 3.13Å; C223-T363 VanDerWaalsContact SG-O 3.42Å; Y225-T363 WeakPolarHBondContact OH-CG2 3.47Å; Y225-T363 PolarHBondContact OH-OG1 2.95Å; F359-T363 VanDerWaalsContact O-CB 3.28Å; F359-T363 WeakPolarHBondContact O-CB 3.47Å; F359-T363 PolarHBondContact O-N 3.05Å; F359-T363 PolarHBondContact O-OG1 3.47Å; A360-T363 WeakPolarHBondContact O-CB 3.44Å; A360-T363 PolarHBondContact O-N 3.31Å; F361-T363 PolarHBondContact O-N 3.21Å; T363-T366 PolarHBondContact O-N 2.88Å; T363-V387 HydrophobicContact CG2-CG2 3.52Å |
| 364 | V | 91.5 | Very high | 84.1 | Confident | 1 Ų | 1 | 50.1 Ų | 50.1 | 1% | 0.006 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -66.8 | -41.4 | -178.4 | 170.6 | 0 | 0 | 0 | 0 | 111.7 | Y336 A360 F361 T366 Y386 V394 | Y336-V364 HydrophobicContact CD1-CG1 4.23Å; Y336-V364 HydrophobicContact CD1-CG2 4.01Å; Y336-V364 HydrophobicContact CE1-CG1 4.29Å; Y336-V364 HydrophobicContact CE1-CG2 3.64Å; A360-V364 VanDerWaalsContact O-CG2 3.3Å; A360-V364 WeakPolarHBondContact O-CG2 3.16Å; A360-V364 PolarHBondContact O-N 3.11Å; F361-V364 PolarHBondContact O-N 3.41Å; V364-T366 PolarHBondContact O-N 3.41Å; V364-Y386 HydrophobicContact CG2-CE1 3.65Å; V364-Y386 VanDerWaalsContact CG2-OH 3.29Å; V364-Y386 WeakPolarHBondContact CG2-OH 2.91Å; V364-V394 HydrophobicContact CG1-CG2 3.35Å; V364-V394 VanDerWaalsContact O-CG2 3.26Å; V364-V394 WeakPolarHBondContact O-CG2 3.37Å |
| 365 | V | 90 | Very high | 83.1 | Confident | 47 Ų | 47 | 49.2 Ų | 49.2 | 29% | 0.285 | 26% | 0.264 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79 | 10.6 | 177.7 | -176.9 | 0 | 0 | 0 | 0 | 112.3 | F361 V367 | F361-V365 HydrophobicContact CD2-CG2 4.04Å; F361-V365 HydrophobicContact CE1-CG2 4.22Å; F361-V365 HydrophobicContact CE2-CG2 3.67Å; F361-V365 HydrophobicContact CG-CG2 4.47Å; F361-V365 HydrophobicContact CZ-CG2 3.78Å; F361-V365 WeakPolarHBondContact O-CB 3.29Å; F361-V365 WeakPolarHBondContact O-CG2 3.33Å; F361-V365 PolarHBondContact O-N 2.93Å; V365-V367 HydrophobicContact CB-CG2 4.32Å; V365-V367 HydrophobicContact CG1-CG2 4.03Å; V365-V367 PolarHBondContact O-N 3.48Å |
| 366 | T | 89.7 | Confident | 82.8 | Confident | 54 Ų | 54 | 46.9 Ų | 46.9 | 33% | 0.331 | 26% | 0.256 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 54.9 | 23.2 | 179 | 71 | 0 | 0 | 0 | 0 | 115.3 | T221 N362 T363 V364 L391 | T221-T366 WeakPolarHBondContact O-CG2 3.39Å; N362-T366 PolarHBondContact O-N 3.25Å; T363-T366 PolarHBondContact O-N 2.88Å; V364-T366 PolarHBondContact O-N 3.41Å; T366-L391 HydrophobicContact CG2-CD2 3.15Å; T366-L391 HydrophobicContact CG2-CG 4.41Å |
| 367 | V | 89.2 | Confident | 82.4 | Confident | 87 Ų | 87 | 49.7 Ų | 49.7 | 53% | 0.527 | 28% | 0.279 | S | S | . | . | trans | -76.1 | -43.7 | 173.5 | 179.2 | 0 | 0 | 0 | 0 | 110.4 | N362 V365 | N362-V367 HydrophobicContact CB-CB 4.27Å; N362-V367 PolarHBondContact O-N 3.39Å; V365-V367 HydrophobicContact CB-CG2 4.32Å; V365-V367 HydrophobicContact CG1-CG2 4.03Å; V365-V367 PolarHBondContact O-N 3.48Å | ||
| 368 | G | 81.3 | Confident | 82 | Confident | 11 Ų | 11 | 52.4 Ų | 52.4 | 11% | 0.113 | 30% | 0.299 | C | S | . | . | trans | 47.7 | 102.1 | 179.5 | 0 | 0 | 0 | 0 | 0 | 116.2 | C223 N362 G370 | C223-G368 WeakPolarHBondContact O-CA 3.48Å; N362-G368 PolarHBondContact O-N 3.29Å; G368-G370 VanDerWaalsContact C-N 3.26Å; G368-G370 PolarHBondContact O-N 3.32Å | ||
| 369 | M | 71.7 | Confident | 81.7 | Confident | 88 Ų | 88 | 52 Ų | 52 | 43% | 0.433 | 29% | 0.294 | S | S | . | . | trans | -92 | 26.5 | 173 | -58.1 | -167.7 | -47.1 | 0 | 0 | 113.1 | H358 N362 N371 | H358-M369 WeakPolarHBondContact CE1-CE 3.47Å; H358-M369 VanDerWaalsContact CE1-SD 3.55Å; H358-M369 VanDerWaalsContact ND1-CE 3.27Å; H358-M369 WeakPolarHBondContact ND1-CE 3.4Å; N362-M369 HydrophobicContact CB-CG 4.42Å; N362-M369 WeakPolarHBondContact ND2-CE 3.23Å; N362-M369 PolarHBondContact ND2-SD 2.68Å; M369-N371 PolarHBondContact O-N 2.87Å | ||
| 370 | G | 65.5 | Low | 81.6 | Confident | 2 Ų | 2 | 51.5 Ų | 51.5 | 2% | 0.021 | 29% | 0.292 | C | S | . | . | trans | -34.9 | 122.5 | -154.7 | 0 | 0 | 0 | 0 | 0 | 118.1 | Y225 G368 | Y225-G370 VanDerWaalsContact CD1-CA 3.49Å; G368-G370 VanDerWaalsContact C-N 3.26Å; G368-G370 PolarHBondContact O-N 3.32Å | ||
| 371 | N | 66.1 | Low | 81.4 | Confident | 139 Ų | 139 | 54.9 Ų | 54.9 | 74% | 0.743 | 32% | 0.315 | S | S | * | . | trans | -157.4 | 49.1 | 168.8 | -78.4 | -43 | 0 | 0 | 0 | 111.3 | M369 | M369-N371 PolarHBondContact O-N 2.87Š| ||
| 372 | I | 70.1 | Confident | 81.3 | Confident | 24 Ų | 24 | 54.3 Ų | 54.3 | 12% | 0.123 | 32% | 0.315 | C | S | . | . | trans | -119.8 | 132.2 | 171.9 | -158 | 171.5 | 0 | 0 | 0 | 110.1 | F344 W351 F359 V374 | F344-I372 HydrophobicContact CD1-CD1 4.12Å; F344-I372 HydrophobicContact CE1-CD1 4.36Å; W351-I372 HydrophobicContact CH2-CB 4.25Å; W351-I372 HydrophobicContact CH2-CD1 3.65Å; W351-I372 HydrophobicContact CH2-CG1 4Å; W351-I372 HydrophobicContact CZ2-CD1 4.29Å; W351-I372 HydrophobicContact CZ2-CG1 4.29Å; W351-I372 HydrophobicContact CZ3-CD1 4.09Å; F359-I372 HydrophobicContact CE1-CD1 4.47Å; F359-I372 HydrophobicContact CE1-CG2 4.23Å; F359-I372 HydrophobicContact CZ-CB 4.07Å; F359-I372 HydrophobicContact CZ-CG2 3.73Å; I372-V374 HydrophobicContact CG2-CG2 4.14Å | ||
| 373 | V | 68.3 | Low | 81.3 | Confident | 84 Ų | 84 | 53.8 Ų | 53.8 | 51% | 0.509 | 31% | 0.313 | S | S | . | . | trans | -104.6 | 101.3 | 175.7 | -176.5 | 0 | 0 | 0 | 0 | 107.5 | F227 T375 | F227-V373 HydrophobicContact CD2-CG2 4.11Å; F227-V373 HydrophobicContact CE2-CG2 3.49Å; F227-V373 VanDerWaalsContact CE2-CG2 3.49Å; F227-V373 HydrophobicContact CZ-CG1 4.31Å; F227-V373 HydrophobicContact CZ-CG2 4.08Å; V373-T375 HydrophobicContact CG1-CG2 4.41Å; V373-T375 PolarHBondContact O-N 2.8Å | ||
| 374 | V | 72.6 | Confident | 81.3 | Confident | 11 Ų | 11 | 54.1 Ų | 54.1 | 7% | 0.067 | 32% | 0.315 | C | S | . | . | trans | -86.7 | 111.5 | 177.2 | -171.4 | 0 | 0 | 0 | 0 | 108.3 | L214 I372 L380 I383 | L214-V374 HydrophobicContact CD1-CB 4.2Å; L214-V374 HydrophobicContact CD1-CG2 3.97Å; I372-V374 HydrophobicContact CG2-CG2 4.14Å; V374-L380 HydrophobicContact CG1-CB 4.1Å; V374-I383 HydrophobicContact CG1-CD1 4.29Å; V374-I383 HydrophobicContact CG2-CD1 3.47Å; V374-I383 VanDerWaalsContact CG2-CD1 3.47Å | ||
| 375 | T | 70.8 | Confident | 81.3 | Confident | 101 Ų | 101 | 57.3 Ų | 57.3 | 62% | 0.62 | 33% | 0.331 | S | S | * | . | trans | -87.4 | -35.8 | 176.8 | 50.3 | 0 | 0 | 0 | 0 | 112.3 | V373 | V373-T375 HydrophobicContact CG1-CG2 4.41Å; V373-T375 PolarHBondContact O-N 2.8Å | ||
| 376 | D | 82.9 | Confident | 81.4 | Confident | 84 Ų | 84 | 55.7 Ų | 55.7 | 45% | 0.449 | 32% | 0.32 | S | S | . | . | trans | -90.5 | 134.9 | -171.7 | -56.1 | -38.5 | 0 | 0 | 0 | 112.7 | V378 Y379 L380 | D376-V378 PolarHBondContact O-N 3.45Å; D376-Y379 HydrophobicContact CB-CD2 3.48Å; D376-Y379 VanDerWaalsContact CB-CD2 3.48Å; D376-Y379 HydrophobicContact CB-CE2 4.01Å; D376-Y379 HydrophobicContact CB-CG 4.21Å; D376-Y379 PolarHBondContact O-N 2.94Å; D376-Y379 VanDerWaalsContact OD2-CD2 3.31Å; D376-Y379 WeakPolarHBondContact OD2-CD2 3.36Å; D376-Y379 WeakPolarHBondContact OD2-CE2 3.48Å; D376-L380 PolarHBondContact O-N 3.38Å | ||
| 377 | A | 82.4 | Confident | 81.5 | Confident | 59 Ų | 59 | 53.1 Ų | 53.1 | 49% | 0.488 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -66.3 | -33.4 | -176.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | L380 C381 | A377-L380 WeakPolarHBondContact O-CB 3.2Å; A377-C381 PolarHBondContact O-N 2.91Å; A377-C381 VanDerWaalsContact O-N 3.13Å; A377-C381 PolarHBondContact O-SG 2.98Å; A377-C381 VanDerWaalsContact O-SG 3.4Å |
| 378 | V | 85.6 | Confident | 81.6 | Confident | 103 Ų | 103 | 49 Ų | 49 | 62% | 0.624 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -67.2 | -45.1 | 178.8 | 179.2 | 0 | 0 | 0 | 0 | 110.4 | D376 L380 C381 L382 | D376-V378 PolarHBondContact O-N 3.45Å; V378-L380 VanDerWaalsContact C-N 3.34Å; V378-L380 PolarHBondContact O-N 2.91Å; V378-C381 WeakPolarHBondContact O-CB 3.17Å; V378-C381 PolarHBondContact O-N 3.23Å; V378-L382 WeakPolarHBondContact O-CG 3.49Å; V378-L382 PolarHBondContact O-N 3.49Å |
| 379 | Y | 85.1 | Confident | 82 | Confident | 84 Ų | 84 | 51.1 Ų | 51.1 | 33% | 0.329 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -67.7 | -36.2 | 179.3 | -57.8 | -36.8 | 0 | 0 | 0 | 112.2 | F347 D376 C381 L382 I383 | F347-Y379 AromaticContact CD1-CD1 3.37Å; F347-Y379 HydrophobicContact CD1-CD1 3.37Å; F347-Y379 AromaticContact CD1-CD2 3.96Å; F347-Y379 HydrophobicContact CD1-CD2 3.96Å; F347-Y379 AromaticContact CD1-CE1 3.42Å; F347-Y379 HydrophobicContact CD1-CE1 3.42Å; F347-Y379 VanDerWaalsContact CD1-CE1 3.42Å; F347-Y379 HydrophobicContact CD1-CE2 4.06Å; F347-Y379 AromaticContact CD1-CG 3.64Å; F347-Y379 HydrophobicContact CD1-CG 3.64Å; F347-Y379 AromaticContact CD1-CZ 3.78Å; F347-Y379 AromaticContact CE1-CD1 2.91Å; F347-Y379 HydrophobicContact CE1-CD1 2.91Å; F347-Y379 HydrophobicContact CE1-CD2 4.33Å; F347-Y379 AromaticContact CE1-CE1 3.16Å; F347-Y379 HydrophobicContact CE1-CE1 3.16Å; F347-Y379 AromaticContact CE1-CG 3.58Å; F347-Y379 HydrophobicContact CE1-CG 3.58Å; F347-Y379 HydrophobicContact CG-CD1 4.41Å; F347-Y379 HydrophobicContact CG-CG 4.32Å; F347-Y379 AromaticContact CZ-CD1 3.59Å; F347-Y379 HydrophobicContact CZ-CD1 3.59Å; F347-Y379 HydrophobicContact CZ-CE1 4.23Å; F347-Y379 HydrophobicContact CZ-CG 4.09Å; D376-Y379 HydrophobicContact CB-CD2 3.48Å; D376-Y379 VanDerWaalsContact CB-CD2 3.48Å; D376-Y379 HydrophobicContact CB-CE2 4.01Å; D376-Y379 HydrophobicContact CB-CG 4.21Å; D376-Y379 PolarHBondContact O-N 2.94Å; D376-Y379 VanDerWaalsContact OD2-CD2 3.31Å; D376-Y379 WeakPolarHBondContact OD2-CD2 3.36Å; D376-Y379 WeakPolarHBondContact OD2-CE2 3.48Å; Y379-C381 VanDerWaalsContact C-N 3.35Å; Y379-C381 PolarHBondContact O-N 3.17Å; Y379-L382 HydrophobicContact CD1-CD1 4.31Å; Y379-L382 PolarHBondContact O-N 3.43Å; Y379-I383 WeakPolarHBondContact O-CG1 3.41Å; Y379-I383 PolarHBondContact O-N 3.47Å |
| 380 | L | 87.3 | Confident | 83 | Confident | 3 Ų | 3 | 47 Ų | 47 | 2% | 0.016 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -54.7 | -51 | 169.2 | 177.4 | 87.8 | 0 | 0 | 0 | 111.3 | P210 V213 L214 V374 D376 A377 V378 L382 I383 V384 | P210-L380 HydrophobicContact CB-CB 4.45Å; P210-L380 HydrophobicContact CB-CD1 3.83Å; P210-L380 HydrophobicContact CB-CD2 3.95Å; P210-L380 HydrophobicContact CB-CG 4.27Å; P210-L380 HydrophobicContact CG-CD2 4.49Å; P210-L380 WeakPolarHBondContact O-CD1 3.44Å; V213-L380 HydrophobicContact CB-CD1 4.22Å; V213-L380 HydrophobicContact CB-CD2 3.94Å; V213-L380 HydrophobicContact CB-CG 4.47Å; V213-L380 HydrophobicContact CG1-CD1 4.1Å; V213-L380 HydrophobicContact CG1-CD2 3.88Å; V213-L380 HydrophobicContact CG1-CG 4.11Å; V213-L380 HydrophobicContact CG2-CD2 4.23Å; L214-L380 HydrophobicContact CD1-CD1 4.22Å; L214-L380 HydrophobicContact CD2-CD1 3.85Å; L214-L380 HydrophobicContact CG-CD1 3.59Å; V374-L380 HydrophobicContact CG1-CB 4.1Å; D376-L380 PolarHBondContact O-N 3.38Å; A377-L380 WeakPolarHBondContact O-CB 3.2Å; V378-L380 VanDerWaalsContact C-N 3.34Å; V378-L380 PolarHBondContact O-N 2.91Å; L380-L382 VanDerWaalsContact C-N 3.29Å; L380-L382 PolarHBondContact O-N 3.37Å; L380-I383 PolarHBondContact O-N 2.73Å; L380-V384 HydrophobicContact CG-CG2 4.4Å; L380-V384 VanDerWaalsContact O-CG2 3.26Å; L380-V384 WeakPolarHBondContact O-CG2 3.42Å; L380-V384 PolarHBondContact O-N 3.42Å |
| 381 | C | 88 | Confident | 84.3 | Confident | 72 Ų | 72 | 47.7 Ų | 47.7 | 49% | 0.486 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -59.4 | -41.6 | 179.1 | -71.6 | 0 | 0 | 0 | 0 | 111.7 | A377 V378 Y379 V384 I385 | A377-C381 PolarHBondContact O-N 2.91Å; A377-C381 VanDerWaalsContact O-N 3.13Å; A377-C381 PolarHBondContact O-SG 2.98Å; A377-C381 VanDerWaalsContact O-SG 3.4Å; V378-C381 WeakPolarHBondContact O-CB 3.17Å; V378-C381 PolarHBondContact O-N 3.23Å; Y379-C381 VanDerWaalsContact C-N 3.35Å; Y379-C381 PolarHBondContact O-N 3.17Å; C381-V384 PolarHBondContact O-N 3.34Å; C381-I385 WeakPolarHBondContact O-CB 3.33Å; C381-I385 WeakPolarHBondContact O-CD1 3.44Å; C381-I385 VanDerWaalsContact O-CG1 3.25Å; C381-I385 WeakPolarHBondContact O-CG1 3.49Å; C381-I385 PolarHBondContact O-N 2.78Å |
| 382 | L | 89.7 | Confident | 85.4 | Confident | 71 Ų | 71 | 41.1 Ų | 41.1 | 37% | 0.372 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -63.6 | -41.9 | 176.4 | -66.6 | 176.9 | 0 | 0 | 0 | 112.1 | L343 F347 V378 Y379 L380 I385 Y386 | L343-L382 HydrophobicContact CD1-CD1 4.21Å; L343-L382 HydrophobicContact CD2-CB 4.39Å; F347-L382 HydrophobicContact CE1-CD1 4.48Å; F347-L382 HydrophobicContact CZ-CD1 4.09Å; V378-L382 WeakPolarHBondContact O-CG 3.49Å; V378-L382 PolarHBondContact O-N 3.49Å; Y379-L382 HydrophobicContact CD1-CD1 4.31Å; Y379-L382 PolarHBondContact O-N 3.43Å; L380-L382 VanDerWaalsContact C-N 3.29Å; L380-L382 PolarHBondContact O-N 3.37Å; L382-I385 PolarHBondContact O-N 2.83Å; L382-Y386 WeakPolarHBondContact O-CB 3.45Å; L382-Y386 PolarHBondContact O-N 2.91Å |
| 383 | I | 89.4 | Confident | 86.5 | Confident | 4 Ų | 4 | 40.5 Ų | 40.5 | 2% | 0.021 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -65.3 | -44.3 | 176.7 | -70.5 | 166.3 | 0 | 0 | 0 | 110.7 | L214 F344 V374 Y379 L380 I385 Y386 V387 | L214-I383 HydrophobicContact CD2-CG2 4.22Å; F344-I383 HydrophobicContact CE1-CD1 4.01Å; F344-I383 HydrophobicContact CE1-CG1 3.93Å; V374-I383 HydrophobicContact CG1-CD1 4.29Å; V374-I383 HydrophobicContact CG2-CD1 3.47Å; V374-I383 VanDerWaalsContact CG2-CD1 3.47Å; Y379-I383 WeakPolarHBondContact O-CG1 3.41Å; Y379-I383 PolarHBondContact O-N 3.47Å; L380-I383 PolarHBondContact O-N 2.73Å; I383-I385 PolarHBondContact O-N 3.3Å; I383-Y386 PolarHBondContact O-N 3.29Å; I383-V387 HydrophobicContact CG2-CG2 4.25Å; I383-V387 VanDerWaalsContact O-CG2 3.26Å; I383-V387 WeakPolarHBondContact O-CG2 3.25Å; I383-V387 PolarHBondContact O-N 2.92Å |
| 384 | V | 90.9 | Very high | 87.5 | Confident | 7 Ų | 7 | 37.5 Ų | 37.5 | 4% | 0.042 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -60.2 | -48.8 | 177.7 | 172.8 | 0 | 0 | 0 | 0 | 110.5 | L123 I126 V213 L217 L380 C381 Y386 V387 V388 | L123-V384 HydrophobicContact CD2-CG1 3.48Å; L123-V384 VanDerWaalsContact CD2-CG1 3.48Å; I126-V384 HydrophobicContact CD1-CG1 4.3Å; V213-V384 HydrophobicContact CG1-CG2 3.61Å; L217-V384 HydrophobicContact CD1-CG1 4.37Å; L217-V384 HydrophobicContact CD2-CG2 4.12Å; L380-V384 HydrophobicContact CG-CG2 4.4Å; L380-V384 VanDerWaalsContact O-CG2 3.26Å; L380-V384 WeakPolarHBondContact O-CG2 3.42Å; L380-V384 PolarHBondContact O-N 3.42Å; C381-V384 PolarHBondContact O-N 3.34Å; V384-Y386 VanDerWaalsContact C-N 3.33Å; V384-Y386 PolarHBondContact O-N 2.91Å; V384-V387 PolarHBondContact O-N 2.81Å; V384-V388 VanDerWaalsContact O-CG2 3.31Å; V384-V388 WeakPolarHBondContact O-CG2 3.34Å; V384-V388 PolarHBondContact O-N 2.95Å |
| 385 | I | 90.5 | Very high | 88.3 | Confident | 68 Ų | 68 | 38.2 Ų | 38.2 | 35% | 0.349 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -61.7 | -43.7 | 177.4 | -68.8 | 166.6 | 0 | 0 | 0 | 110.5 | C381 L382 I383 V388 I389 | C381-I385 WeakPolarHBondContact O-CB 3.33Å; C381-I385 WeakPolarHBondContact O-CD1 3.44Å; C381-I385 VanDerWaalsContact O-CG1 3.25Å; C381-I385 WeakPolarHBondContact O-CG1 3.49Å; C381-I385 PolarHBondContact O-N 2.78Å; L382-I385 PolarHBondContact O-N 2.83Å; I383-I385 PolarHBondContact O-N 3.3Å; I385-V388 PolarHBondContact O-N 3.49Å; I385-I389 HydrophobicContact CG2-CD1 3.63Å; I385-I389 HydrophobicContact CG2-CG1 4.38Å; I385-I389 WeakPolarHBondContact O-CB 3.38Å; I385-I389 VanDerWaalsContact O-CG1 3.3Å; I385-I389 WeakPolarHBondContact O-CG1 3.3Å; I385-I389 PolarHBondContact O-N 2.82Å |
| 386 | Y | 92.1 | Very high | 89.1 | Confident | 13 Ų | 13 | 33.7 Ų | 33.7 | 5% | 0.051 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -59.7 | -48.4 | 176.7 | 176.8 | -99.8 | 0 | 0 | 0 | 111.6 | Y336 G340 F344 V364 L382 I383 V384 V388 I389 G390 | Y336-Y386 HydrophobicContact CD1-CE2 4.14Å; Y336-Y386 HydrophobicContact CE1-CD2 4.1Å; Y336-Y386 HydrophobicContact CE1-CE1 4.44Å; Y336-Y386 AromaticContact CE1-CE2 3.39Å; Y336-Y386 HydrophobicContact CE1-CE2 3.39Å; Y336-Y386 AromaticContact CE1-CZ 3.59Å; Y336-Y386 HydrophobicContact CE2-CE2 4.22Å; Y336-Y386 AromaticContact CZ-CD2 3.75Å; Y336-Y386 AromaticContact CZ-CE2 3.45Å; Y336-Y386 VanDerWaalsContact CZ-CE2 3.45Å; Y336-Y386 PolarHBondContact O-OH 3.2Å; Y336-Y386 VanDerWaalsContact OH-CD2 3.26Å; Y336-Y386 WeakPolarHBondContact OH-CD2 3.46Å; Y336-Y386 WeakPolarHBondContact OH-CE2 2.72Å; Y336-Y386 PolarHBondContact OH-O 3.39Å; G340-Y386 VanDerWaalsContact CA-CE2 3.48Å; F344-Y386 HydrophobicContact CE2-CE1 4.32Å; V364-Y386 HydrophobicContact CG2-CE1 3.65Å; V364-Y386 VanDerWaalsContact CG2-OH 3.29Å; V364-Y386 WeakPolarHBondContact CG2-OH 2.91Å; L382-Y386 WeakPolarHBondContact O-CB 3.45Å; L382-Y386 PolarHBondContact O-N 2.91Å; I383-Y386 PolarHBondContact O-N 3.29Å; V384-Y386 VanDerWaalsContact C-N 3.33Å; V384-Y386 PolarHBondContact O-N 2.91Å; Y386-V388 PolarHBondContact O-N 2.83Å; Y386-I389 PolarHBondContact O-N 3.3Å; Y386-G390 WeakPolarHBondContact O-CA 3.37Å; Y386-G390 PolarHBondContact O-N 2.84Å |
| 387 | V | 91.3 | Very high | 89.3 | Confident | 1 Ų | 1 | 30.3 Ų | 30.3 | 1% | 0.006 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -63.3 | -43.1 | 179.7 | 174.3 | 0 | 0 | 0 | 0 | 111.3 | L217 T221 T363 I383 V384 G390 L391 | L217-V387 HydrophobicContact CD1-CB 4.42Å; L217-V387 HydrophobicContact CD1-CG1 4.14Å; L217-V387 HydrophobicContact CD2-CB 3.98Å; L217-V387 HydrophobicContact CD2-CG1 4.11Å; L217-V387 HydrophobicContact CD2-CG2 4.05Å; L217-V387 HydrophobicContact CG-CG1 4.26Å; T221-V387 HydrophobicContact CG2-CG1 3.88Å; T363-V387 HydrophobicContact CG2-CG2 3.52Å; I383-V387 HydrophobicContact CG2-CG2 4.25Å; I383-V387 VanDerWaalsContact O-CG2 3.26Å; I383-V387 WeakPolarHBondContact O-CG2 3.25Å; I383-V387 PolarHBondContact O-N 2.92Å; V384-V387 PolarHBondContact O-N 2.81Å; V387-G390 PolarHBondContact O-N 3.33Å; V387-L391 HydrophobicContact CG1-CD1 4.22Å; V387-L391 WeakPolarHBondContact O-CG 3.37Å; V387-L391 PolarHBondContact O-N 3.26Å |
| 388 | V | 91.3 | Very high | 89.4 | Confident | 0 Ų | 0 | 32.2 Ų | 32.2 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -64 | -44.3 | 179.4 | 173.3 | 0 | 0 | 0 | 0 | 111.5 | L119 L122 L217 M250 I257 V384 I385 Y386 A392 | L119-V388 HydrophobicContact CD1-CB 4.4Å; L119-V388 HydrophobicContact CD1-CG1 3.5Å; L119-V388 VanDerWaalsContact CD1-CG1 3.5Å; L122-V388 HydrophobicContact CD2-CB 4.49Å; L122-V388 HydrophobicContact CD2-CG1 3.74Å; L122-V388 HydrophobicContact CD2-CG2 3.83Å; L217-V388 HydrophobicContact CD1-CG2 4.28Å; M250-V388 HydrophobicContact CE-CG1 4.22Å; I257-V388 HydrophobicContact CD1-CG1 4.21Å; V384-V388 VanDerWaalsContact O-CG2 3.31Å; V384-V388 WeakPolarHBondContact O-CG2 3.34Å; V384-V388 PolarHBondContact O-N 2.95Å; I385-V388 PolarHBondContact O-N 3.49Å; Y386-V388 PolarHBondContact O-N 2.83Å; V388-A392 PolarHBondContact O-N 2.75Å |
| 389 | I | 91.1 | Very high | 89.3 | Confident | 56 Ų | 56 | 31.7 Ų | 31.7 | 29% | 0.287 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -67.4 | -39.1 | 175.2 | -65.9 | 171.8 | 0 | 0 | 0 | 110.6 | Y336 I385 Y386 L391 A392 V393 | Y336-I389 HydrophobicContact CE2-CG2 3.81Å; I385-I389 HydrophobicContact CG2-CD1 3.63Å; I385-I389 HydrophobicContact CG2-CG1 4.38Å; I385-I389 WeakPolarHBondContact O-CB 3.38Å; I385-I389 VanDerWaalsContact O-CG1 3.3Å; I385-I389 WeakPolarHBondContact O-CG1 3.3Å; I385-I389 PolarHBondContact O-N 2.82Å; Y386-I389 PolarHBondContact O-N 3.3Å; I389-L391 VanDerWaalsContact C-N 3.33Å; I389-L391 PolarHBondContact O-N 2.81Å; I389-A392 CarbonylContact O-C 3.47Å; I389-A392 WeakPolarHBondContact O-CA 3.34Å; I389-A392 WeakPolarHBondContact O-CB 3.48Å; I389-A392 PolarHBondContact O-N 3.26Å; I389-V393 HydrophobicContact CG2-CG2 4.35Å; I389-V393 WeakPolarHBondContact O-CG2 3.37Å; I389-V393 PolarHBondContact O-N 2.98Å |
| 390 | G | 92.3 | Very high | 89 | Confident | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -62.2 | -42 | -179.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | Y336 Y386 V387 A392 V393 V394 | Y336-G390 WeakPolarHBondContact OH-CA 3.35Å; Y336-G390 PolarHBondContact OH-N 3.42Å; Y386-G390 WeakPolarHBondContact O-CA 3.37Å; Y386-G390 PolarHBondContact O-N 2.84Å; V387-G390 PolarHBondContact O-N 3.33Å; G390-A392 VanDerWaalsContact C-N 3.3Å; G390-A392 PolarHBondContact O-N 2.77Å; G390-V393 WeakPolarHBondContact O-CB 3.47Å; G390-V393 PolarHBondContact O-N 3.46Å; G390-V394 WeakPolarHBondContact O-CG2 3.28Å; G390-V394 PolarHBondContact O-N 3.42Å |
| 391 | L | 91.9 | Very high | 88.8 | Confident | 18 Ų | 18 | 30.8 Ų | 30.8 | 9% | 0.094 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -58.3 | -43.2 | 170.8 | -75.7 | 167.3 | 0 | 0 | 0 | 112.1 | T221 M250 A254 T366 V387 I389 V393 V394 T395 | T221-L391 HydrophobicContact CG2-CD1 3.31Å; M250-L391 HydrophobicContact CE-CB 4.07Å; M250-L391 HydrophobicContact CE-CD1 3.45Å; M250-L391 VanDerWaalsContact CE-CD1 3.45Å; M250-L391 HydrophobicContact CE-CG 4.41Å; M250-L391 HydrophobicContact SD-CD1 4.07Å; A254-L391 HydrophobicContact CB-CB 4.5Å; T366-L391 HydrophobicContact CG2-CD2 3.15Å; T366-L391 HydrophobicContact CG2-CG 4.41Å; V387-L391 HydrophobicContact CG1-CD1 4.22Å; V387-L391 WeakPolarHBondContact O-CG 3.37Å; V387-L391 PolarHBondContact O-N 3.26Å; I389-L391 VanDerWaalsContact C-N 3.33Å; I389-L391 PolarHBondContact O-N 2.81Å; L391-V393 VanDerWaalsContact C-N 3.32Å; L391-V393 PolarHBondContact O-N 3.27Å; L391-V394 PolarHBondContact O-N 2.9Å; L391-T395 WeakPolarHBondContact O-CG2 3.28Å; L391-T395 PolarHBondContact O-N 3.35Å; L391-T395 PolarHBondContact O-OG1 2.8Å |
| 392 | A | 91 | Very high | 88.7 | Confident | 0 Ų | 0 | 29.9 Ų | 29.9 | 0% | 0 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -65.7 | -34.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.9 | I257 G258 L261 V388 I389 G390 V394 T395 M396 | I257-A392 HydrophobicContact CB-CB 3.57Å; I257-A392 HydrophobicContact CG2-CB 3.33Å; G258-A392 WeakPolarHBondContact CA-O 3.49Å; L261-A392 HydrophobicContact CD1-CB 4.05Å; V388-A392 PolarHBondContact O-N 2.75Å; I389-A392 CarbonylContact O-C 3.47Å; I389-A392 WeakPolarHBondContact O-CA 3.34Å; I389-A392 WeakPolarHBondContact O-CB 3.48Å; I389-A392 PolarHBondContact O-N 3.26Å; G390-A392 VanDerWaalsContact C-N 3.3Å; G390-A392 PolarHBondContact O-N 2.77Å; A392-V394 VanDerWaalsContact C-N 3.35Å; A392-T395 VanDerWaalsContact CA-OG1 3.3Å; A392-T395 WeakPolarHBondContact CA-OG1 3.43Å; A392-T395 PolarHBondContact O-OG1 3.4Å; A392-M396 VanDerWaalsContact O-CB 3.24Å; A392-M396 WeakPolarHBondContact O-CB 3.27Å; A392-M396 PolarHBondContact O-N 2.85Å |
| 393 | V | 91.2 | Very high | 88.4 | Confident | 11 Ų | 11 | 29.7 Ų | 29.7 | 7% | 0.067 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -66.4 | -40.1 | 172.1 | 174.2 | 0 | 0 | 0 | 0 | 110.3 | L261 M333 Y336 I389 G390 L391 M396 C397 | L261-V393 HydrophobicContact CD1-CG2 3.86Å; M333-V393 HydrophobicContact CE-CG1 4.46Å; M333-V393 HydrophobicContact SD-CG1 4.08Å; Y336-V393 HydrophobicContact CD2-CG2 4.05Å; Y336-V393 HydrophobicContact CE2-CG2 4.16Å; Y336-V393 HydrophobicContact CG-CG1 4.43Å; Y336-V393 HydrophobicContact CG-CG2 4.31Å; I389-V393 HydrophobicContact CG2-CG2 4.35Å; I389-V393 WeakPolarHBondContact O-CG2 3.37Å; I389-V393 PolarHBondContact O-N 2.98Å; G390-V393 WeakPolarHBondContact O-CB 3.47Å; G390-V393 PolarHBondContact O-N 3.46Å; L391-V393 VanDerWaalsContact C-N 3.32Å; L391-V393 PolarHBondContact O-N 3.27Å; V393-M396 PolarHBondContact O-N 3.07Å; V393-C397 WeakPolarHBondContact O-CB 3.32Å; V393-C397 PolarHBondContact O-N 2.74Å; V393-C397 PolarHBondContact O-SG 3.48Å; V393-C397 VanDerWaalsContact O-SG 3.34Å |
| 394 | V | 90.3 | Very high | 88 | Confident | 21 Ų | 21 | 31 Ų | 31 | 13% | 0.127 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -65.8 | -47.5 | 176.9 | 180 | 0 | 0 | 0 | 0 | 112.1 | M333 V364 G390 L391 A392 M396 C397 I398 | M333-V394 VanDerWaalsContact CE-CA 3.47Å; M333-V394 HydrophobicContact CE-CB 3.99Å; M333-V394 HydrophobicContact CE-CG1 4.28Å; M333-V394 HydrophobicContact CE-CG2 3.67Å; M333-V394 HydrophobicContact SD-CG2 4.34Å; V364-V394 HydrophobicContact CG1-CG2 3.35Å; V364-V394 VanDerWaalsContact O-CG2 3.26Å; V364-V394 WeakPolarHBondContact O-CG2 3.37Å; G390-V394 WeakPolarHBondContact O-CG2 3.28Å; G390-V394 PolarHBondContact O-N 3.42Å; L391-V394 PolarHBondContact O-N 2.9Å; A392-V394 VanDerWaalsContact C-N 3.35Å; V394-M396 VanDerWaalsContact C-N 3.31Å; V394-M396 PolarHBondContact O-N 3.31Å; V394-C397 PolarHBondContact O-N 3.46Å; V394-I398 HydrophobicContact CG1-CD1 3.83Å; V394-I398 HydrophobicContact CG1-CG1 4.41Å; V394-I398 VanDerWaalsContact O-CG1 3.31Å; V394-I398 WeakPolarHBondContact O-CG1 3.19Å; V394-I398 PolarHBondContact O-N 2.94Å |
| 395 | T | 89.2 | Confident | 87.7 | Confident | 27 Ų | 27 | 34.8 Ų | 34.8 | 17% | 0.166 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -59.5 | -44.7 | 176 | 53.9 | 0 | 0 | 0 | 0 | 110.8 | A254 L391 A392 C397 I398 D399 | A254-T395 HydrophobicContact CB-CG2 4.09Å; A254-T395 PolarHBondContact O-OG1 3.3Å; L391-T395 WeakPolarHBondContact O-CG2 3.28Å; L391-T395 PolarHBondContact O-N 3.35Å; L391-T395 PolarHBondContact O-OG1 2.8Å; A392-T395 VanDerWaalsContact CA-OG1 3.3Å; A392-T395 WeakPolarHBondContact CA-OG1 3.43Å; A392-T395 PolarHBondContact O-OG1 3.4Å; T395-C397 PolarHBondContact O-N 2.79Å; T395-I398 PolarHBondContact O-N 3.35Å; T395-I398 VanDerWaalsContact O-N 3.15Å; T395-D399 PolarHBondContact O-N 3.43Å |
| 396 | M | 87.5 | Confident | 87.4 | Confident | 5 Ų | 5 | 36.2 Ų | 36.2 | 3% | 0.025 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -57.2 | -46 | 175.2 | -169.8 | -161.4 | 78.5 | 0 | 0 | 112.6 | G258 L261 S262 L332 A392 V393 V394 I398 D399 L400 | G258-M396 WeakPolarHBondContact O-CG 3.06Å; L261-M396 VanDerWaalsContact C-SD 3.56Å; L261-M396 HydrophobicContact CB-SD 3.69Å; S262-M396 VanDerWaalsContact CA-SD 3.53Å; S262-M396 PolarHBondContact N-SD 2.55Å; S262-M396 VanDerWaalsContact N-SD 3.35Å; L332-M396 HydrophobicContact CD2-CE 3.19Å; A392-M396 VanDerWaalsContact O-CB 3.24Å; A392-M396 WeakPolarHBondContact O-CB 3.27Å; A392-M396 PolarHBondContact O-N 2.85Å; V393-M396 PolarHBondContact O-N 3.07Å; V394-M396 VanDerWaalsContact C-N 3.31Å; V394-M396 PolarHBondContact O-N 3.31Å; M396-I398 VanDerWaalsContact C-N 3.33Å; M396-D399 PolarHBondContact O-N 3.47Å; M396-L400 HydrophobicContact CE-CD1 4.35Å; M396-L400 HydrophobicContact CG-CD1 4.21Å; M396-L400 WeakPolarHBondContact O-CG 3.37Å; M396-L400 PolarHBondContact O-N 2.76Å; M396-L400 VanDerWaalsContact O-N 3.07Å |
| 397 | C | 86.4 | Confident | 87 | Confident | 13 Ų | 13 | 37.4 Ų | 37.4 | 9% | 0.088 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -65.1 | -37.9 | 177.7 | -74.6 | 0 | 0 | 0 | 0 | 112 | M333 V393 V394 T395 A401 | M333-C397 HydrophobicContact CE-CB 3.5Å; M333-C397 VanDerWaalsContact CE-SG 3.55Å; V393-C397 WeakPolarHBondContact O-CB 3.32Å; V393-C397 PolarHBondContact O-N 2.74Å; V393-C397 PolarHBondContact O-SG 3.48Å; V393-C397 VanDerWaalsContact O-SG 3.34Å; V394-C397 PolarHBondContact O-N 3.46Å; T395-C397 PolarHBondContact O-N 2.79Å; C397-A401 WeakPolarHBondContact O-CB 3.04Å; C397-A401 PolarHBondContact O-N 2.89Å |
| 398 | I | 85.5 | Confident | 86.6 | Confident | 99 Ų | 99 | 40.5 Ų | 40.5 | 51% | 0.508 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -65.1 | -47.7 | 176.2 | -69.9 | 169.2 | 0 | 0 | 0 | 110.6 | V394 T395 M396 L400 A401 S402 | V394-I398 HydrophobicContact CG1-CD1 3.83Å; V394-I398 HydrophobicContact CG1-CG1 4.41Å; V394-I398 VanDerWaalsContact O-CG1 3.31Å; V394-I398 WeakPolarHBondContact O-CG1 3.19Å; V394-I398 PolarHBondContact O-N 2.94Å; T395-I398 PolarHBondContact O-N 3.35Å; T395-I398 VanDerWaalsContact O-N 3.15Å; M396-I398 VanDerWaalsContact C-N 3.33Å; I398-L400 PolarHBondContact O-N 3.03Å; I398-A401 PolarHBondContact O-N 3.49Å; I398-S402 VanDerWaalsContact O-CB 3.3Å; I398-S402 WeakPolarHBondContact O-CB 3.42Å; I398-S402 PolarHBondContact O-N 2.9Å |
| 399 | D | 83 | Confident | 86.4 | Confident | 93 Ų | 93 | 46.8 Ų | 46.8 | 50% | 0.497 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -60.8 | -46.7 | -179.1 | -70.4 | -24.3 | 0 | 0 | 0 | 111.3 | T395 M396 S402 T403 | T395-D399 PolarHBondContact O-N 3.43Å; M396-D399 PolarHBondContact O-N 3.47Å; D399-S402 WeakPolarHBondContact O-CB 3.34Å; D399-S402 PolarHBondContact O-N 2.82Å; D399-T403 PolarHBondContact O-N 3.17Å |
| 400 | L | 80.2 | Confident | 86.1 | Confident | 22 Ų | 22 | 50.8 Ų | 50.8 | 12% | 0.115 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -68.8 | -44.4 | 178.2 | -67.6 | 175.4 | 0 | 0 | 0 | 111.8 | Y329 M396 I398 S402 T403 H404 | Y329-L400 HydrophobicContact CD1-CD1 4.25Å; Y329-L400 HydrophobicContact CE1-CB 4.23Å; Y329-L400 HydrophobicContact CE1-CD1 3.57Å; Y329-L400 HydrophobicContact CE2-CB 4.17Å; M396-L400 HydrophobicContact CE-CD1 4.35Å; M396-L400 HydrophobicContact CG-CD1 4.21Å; M396-L400 WeakPolarHBondContact O-CG 3.37Å; M396-L400 PolarHBondContact O-N 2.76Å; M396-L400 VanDerWaalsContact O-N 3.07Å; I398-L400 PolarHBondContact O-N 3.03Å; L400-S402 PolarHBondContact O-N 3.5Å; L400-T403 PolarHBondContact O-N 3.07Å; L400-T403 VanDerWaalsContact O-N 3.16Å; L400-T403 PolarHBondContact O-OG1 3.09Å; L400-H404 PolarHBondContact O-CD2 3.47Å; L400-H404 VanDerWaalsContact O-CD2 3.22Å; L400-H404 PolarHBondContact O-N 3.46Å |
| 401 | A | 83 | Confident | 85.8 | Confident | 45 Ų | 45 | 55 Ų | 55 | 37% | 0.372 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -57.5 | -38.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | C397 I398 H404 L405 | C397-A401 WeakPolarHBondContact O-CB 3.04Å; C397-A401 PolarHBondContact O-N 2.89Å; I398-A401 PolarHBondContact O-N 3.49Å; A401-H404 PolarHBondContact O-N 2.7Å; A401-L405 WeakPolarHBondContact O-CB 3.47Å; A401-L405 PolarHBondContact O-N 3.18Å |
| 402 | S | 85.2 | Confident | 85.4 | Confident | 53 Ų | 53 | 59.2 Ų | 59.2 | 37% | 0.371 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -58.4 | -47.6 | 175.4 | -174.9 | 0 | 0 | 0 | 0 | 111.8 | I398 D399 L400 H404 L405 Q406 | I398-S402 VanDerWaalsContact O-CB 3.3Å; I398-S402 WeakPolarHBondContact O-CB 3.42Å; I398-S402 PolarHBondContact O-N 2.9Å; D399-S402 WeakPolarHBondContact O-CB 3.34Å; D399-S402 PolarHBondContact O-N 2.82Å; L400-S402 PolarHBondContact O-N 3.5Å; S402-H404 VanDerWaalsContact C-N 3.34Å; S402-H404 PolarHBondContact O-N 2.79Å; S402-L405 PolarHBondContact O-N 3.43Å; S402-Q406 WeakPolarHBondContact O-CB 3.24Å; S402-Q406 VanDerWaalsContact O-CG 3.31Å; S402-Q406 WeakPolarHBondContact O-CG 3.32Å; S402-Q406 PolarHBondContact O-N 2.83Å |
| 403 | T | 82.4 | Confident | 85 | Confident | 68 Ų | 68 | 64.4 Ų | 64.4 | 42% | 0.417 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -60.6 | -39.4 | 178.6 | 64.2 | 0 | 0 | 0 | 0 | 113.4 | D399 L400 T407 | D399-T403 PolarHBondContact O-N 3.17Å; L400-T403 PolarHBondContact O-N 3.07Å; L400-T403 VanDerWaalsContact O-N 3.16Å; L400-T403 PolarHBondContact O-OG1 3.09Å; T403-T407 PolarHBondContact O-N 3.27Å; T403-T407 PolarHBondContact O-OG1 3.18Å; T403-T407 VanDerWaalsContact O-OG1 3.07Å |
| 404 | H | 81 | Confident | 84.7 | Confident | 32 Ų | 32 | 70.1 Ų | 70.1 | 15% | 0.148 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -69.8 | -43.9 | 176.4 | -74 | -68.9 | 0 | 0 | 0 | 111.2 | L322 P325 Y329 L400 A401 S402 Q406 T407 Y408 | L322-H404 WeakPolarHBondContact CD1-ND1 3.4Å; P325-H404 WeakPolarHBondContact CB-NE2 3.47Å; P325-H404 VanDerWaalsContact CG-CE1 3.44Å; P325-H404 WeakPolarHBondContact CG-CE1 3.38Å; Y329-H404 AromaticContact CE2-CD2 3.72Å; Y329-H404 AromaticContact CE2-NE2 3.78Å; Y329-H404 AromaticContact CZ-NE2 3.98Å; Y329-H404 PolarHBondContact OH-NE2 3.29Å; L400-H404 PolarHBondContact O-CD2 3.47Å; L400-H404 VanDerWaalsContact O-CD2 3.22Å; L400-H404 PolarHBondContact O-N 3.46Å; A401-H404 PolarHBondContact O-N 2.7Å; S402-H404 VanDerWaalsContact C-N 3.34Å; S402-H404 PolarHBondContact O-N 2.79Å; H404-Q406 VanDerWaalsContact C-N 3.34Å; H404-Q406 PolarHBondContact O-N 3.46Å; H404-T407 WeakPolarHBondContact O-CA 2.87Å; H404-T407 WeakPolarHBondContact O-CB 3.34Å; H404-T407 PolarHBondContact O-N 3.34Å; H404-Y408 WeakPolarHBondContact O-CD2 3.38Å; H404-Y408 PolarHBondContact O-N 3.48Å |
| 405 | L | 84.5 | Confident | 84.4 | Confident | 86 Ų | 86 | 75.9 Ų | 75.9 | 45% | 0.45 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -61.9 | -41.7 | 179 | -161 | 168.9 | 0 | 0 | 0 | 110.9 | A401 S402 T407 Y408 F409 | A401-L405 WeakPolarHBondContact O-CB 3.47Å; A401-L405 PolarHBondContact O-N 3.18Å; S402-L405 PolarHBondContact O-N 3.43Å; L405-T407 VanDerWaalsContact C-N 3.31Å; L405-T407 PolarHBondContact O-N 2.94Å; L405-Y408 WeakPolarHBondContact O-CB 3.28Å; L405-Y408 PolarHBondContact O-N 2.7Å; L405-F409 HydrophobicContact CD2-CD2 3.23Å; L405-F409 HydrophobicContact CD2-CE1 4.27Å; L405-F409 HydrophobicContact CD2-CE2 2.91Å; L405-F409 HydrophobicContact CD2-CG 4.06Å; L405-F409 HydrophobicContact CD2-CZ 3.49Å; L405-F409 VanDerWaalsContact CD2-CZ 3.49Å; L405-F409 HydrophobicContact CG-CE2 4.39Å; L405-F409 PolarHBondContact O-N 3.01Å |
| 406 | Q | 85.7 | Confident | 84 | Confident | 98 Ų | 98 | 76.4 Ų | 76.4 | 46% | 0.458 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -59.1 | -41 | 171.3 | -73.4 | 179 | -3.8 | 0 | 0 | 112.3 | S402 H404 F409 R410 | S402-Q406 WeakPolarHBondContact O-CB 3.24Å; S402-Q406 VanDerWaalsContact O-CG 3.31Å; S402-Q406 WeakPolarHBondContact O-CG 3.32Å; S402-Q406 PolarHBondContact O-N 2.83Å; H404-Q406 VanDerWaalsContact C-N 3.34Å; H404-Q406 PolarHBondContact O-N 3.46Å; Q406-F409 PolarHBondContact O-N 3.43Å; Q406-R410 WeakPolarHBondContact O-CB 3.31Å; Q406-R410 PolarHBondContact O-N 3Å |
| 407 | T | 83.1 | Confident | 83.5 | Confident | 37 Ų | 37 | 81.4 Ų | 81.4 | 23% | 0.227 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -66.1 | -40.6 | 176.3 | -60.4 | 0 | 0 | 0 | 0 | 111.6 | T403 H404 L405 R410 K411 | T403-T407 PolarHBondContact O-N 3.27Å; T403-T407 PolarHBondContact O-OG1 3.18Å; T403-T407 VanDerWaalsContact O-OG1 3.07Å; H404-T407 WeakPolarHBondContact O-CA 2.87Å; H404-T407 WeakPolarHBondContact O-CB 3.34Å; H404-T407 PolarHBondContact O-N 3.34Å; L405-T407 VanDerWaalsContact C-N 3.31Å; L405-T407 PolarHBondContact O-N 2.94Å; T407-R410 PolarHBondContact O-N 3.47Å; T407-K411 WeakPolarHBondContact O-CG 3.5Å; T407-K411 PolarHBondContact O-N 3.06Å |
| 408 | Y | 83.9 | Confident | 83.1 | Confident | 66 Ų | 66 | 83.3 Ų | 83.3 | 26% | 0.259 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -61.5 | -47.2 | 172.1 | -82.2 | -72.2 | 0 | 0 | 0 | 111.9 | L322 I326 H404 L405 R410 K411 I412 | L322-Y408 WeakPolarHBondContact CB-OH 3.44Å; L322-Y408 HydrophobicContact CD2-CD1 3.91Å; L322-Y408 HydrophobicContact CD2-CD2 3.91Å; L322-Y408 HydrophobicContact CD2-CE1 3.39Å; L322-Y408 HydrophobicContact CD2-CE2 3.37Å; L322-Y408 HydrophobicContact CD2-CG 4.16Å; L322-Y408 WeakPolarHBondContact CD2-OH 3.29Å; L322-Y408 HydrophobicContact CG-CD2 4.42Å; L322-Y408 HydrophobicContact CG-CE1 4.25Å; L322-Y408 HydrophobicContact CG-CE2 3.54Å; L322-Y408 VanDerWaalsContact CG-CZ 3.45Å; L322-Y408 VanDerWaalsContact CG-OH 3.3Å; L322-Y408 WeakPolarHBondContact CG-OH 3.41Å; I326-Y408 HydrophobicContact CD1-CE2 3.94Å; H404-Y408 WeakPolarHBondContact O-CD2 3.38Å; H404-Y408 PolarHBondContact O-N 3.48Å; L405-Y408 WeakPolarHBondContact O-CB 3.28Å; L405-Y408 PolarHBondContact O-N 2.7Å; Y408-R410 VanDerWaalsContact C-N 3.27Å; Y408-R410 PolarHBondContact O-N 3.33Å; Y408-K411 PolarHBondContact O-N 2.87Å; Y408-K411 VanDerWaalsContact O-N 3.14Å; Y408-I412 WeakPolarHBondContact O-CG1 3.12Å; Y408-I412 PolarHBondContact O-N 3.18Å |
| 409 | F | 86.1 | Confident | 82.5 | Confident | 133 Ų | 133 | 86.1 Ų | 86.1 | 58% | 0.583 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -60 | -40.4 | 176.4 | -80.9 | -37.9 | 0 | 0 | 0 | 111.8 | L405 Q406 I412 H413 | L405-F409 HydrophobicContact CD2-CD2 3.23Å; L405-F409 HydrophobicContact CD2-CE1 4.27Å; L405-F409 HydrophobicContact CD2-CE2 2.91Å; L405-F409 HydrophobicContact CD2-CG 4.06Å; L405-F409 HydrophobicContact CD2-CZ 3.49Å; L405-F409 VanDerWaalsContact CD2-CZ 3.49Å; L405-F409 HydrophobicContact CG-CE2 4.39Å; L405-F409 PolarHBondContact O-N 3.01Å; Q406-F409 PolarHBondContact O-N 3.43Å; F409-I412 PolarHBondContact O-N 3.46Å; F409-H413 VanDerWaalsContact O-CB 3.3Å; F409-H413 WeakPolarHBondContact O-CB 3.38Å; F409-H413 PolarHBondContact O-N 3.15Å |
| 410 | R | 85.1 | Confident | 82.1 | Confident | 140 Ų | 140 | 88.5 Ų | 88.5 | 53% | 0.528 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -61.6 | -46.3 | 174 | -174.5 | 170.9 | 67.5 | -139.1 | -2 | 111.3 | Q406 T407 Y408 H413 Y414 | Q406-R410 WeakPolarHBondContact O-CB 3.31Å; Q406-R410 PolarHBondContact O-N 3Å; T407-R410 PolarHBondContact O-N 3.47Å; Y408-R410 VanDerWaalsContact C-N 3.27Å; Y408-R410 PolarHBondContact O-N 3.33Å; R410-H413 PolarHBondContact O-N 2.97Å; R410-Y414 HydrophobicContact CG-CD2 3.75Å; R410-Y414 HydrophobicContact CG-CE2 3.46Å; R410-Y414 VanDerWaalsContact CG-CE2 3.46Å; R410-Y414 WeakPolarHBondContact O-CD2 3.25Å; R410-Y414 PolarHBondContact O-N 3.36Å |
| 411 | K | 85.8 | Confident | 81.6 | Confident | 87 Ų | 87 | 97 Ų | 97 | 38% | 0.378 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -60.2 | -44.7 | 175.2 | -75.4 | -174.3 | 178.2 | -173 | 0 | 111.9 | T407 Y408 H413 Y414 F415 | T407-K411 WeakPolarHBondContact O-CG 3.5Å; T407-K411 PolarHBondContact O-N 3.06Å; Y408-K411 PolarHBondContact O-N 2.87Å; Y408-K411 VanDerWaalsContact O-N 3.14Å; K411-H413 VanDerWaalsContact C-N 3.34Å; K411-H413 PolarHBondContact O-N 3.1Å; K411-Y414 PolarHBondContact O-N 2.93Å; K411-F415 WeakPolarHBondContact O-CB 3.46Å; K411-F415 PolarHBondContact O-N 3.24Å |
| 412 | I | 83 | Confident | 80.7 | Confident | 107 Ų | 107 | 99.9 Ų | 99.9 | 55% | 0.549 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -61.8 | -42.9 | 176.2 | -69.2 | 168.4 | 0 | 0 | 0 | 110.6 | Y408 F409 F415 G416 | Y408-I412 WeakPolarHBondContact O-CG1 3.12Å; Y408-I412 PolarHBondContact O-N 3.18Å; F409-I412 PolarHBondContact O-N 3.46Å; I412-F415 PolarHBondContact O-N 2.84Å; I412-G416 PolarHBondContact O-N 3.35Å |
| 413 | H | 82.2 | Confident | 79.9 | Confident | 110 Ų | 110 | 102 Ų | 102 | 51% | 0.509 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -64.1 | -42.3 | 177.1 | 179.3 | -99 | 0 | 0 | 0 | 111.7 | F409 R410 K411 G416 R417 | F409-H413 VanDerWaalsContact O-CB 3.3Å; F409-H413 WeakPolarHBondContact O-CB 3.38Å; F409-H413 PolarHBondContact O-N 3.15Å; R410-H413 PolarHBondContact O-N 2.97Å; K411-H413 VanDerWaalsContact C-N 3.34Å; K411-H413 PolarHBondContact O-N 3.1Å; H413-G416 PolarHBondContact O-N 3.19Å; H413-R417 PolarHBondContact O-N 2.82Å |
| 414 | Y | 85 | Confident | 79 | Confident | 131 Ų | 131 | 102 Ų | 102 | 51% | 0.514 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.4 | -42.7 | 172.5 | -80.8 | -69.8 | 0 | 0 | 0 | 112.5 | R410 K411 G416 R417 A418 | R410-Y414 HydrophobicContact CG-CD2 3.75Å; R410-Y414 HydrophobicContact CG-CE2 3.46Å; R410-Y414 VanDerWaalsContact CG-CE2 3.46Å; R410-Y414 WeakPolarHBondContact O-CD2 3.25Å; R410-Y414 PolarHBondContact O-N 3.36Å; K411-Y414 PolarHBondContact O-N 2.93Å; Y414-G416 VanDerWaalsContact C-N 3.32Å; Y414-G416 PolarHBondContact O-N 3.48Å; Y414-R417 PolarHBondContact O-N 2.82Å; Y414-A418 WeakPolarHBondContact O-CB 3.37Å; Y414-A418 PolarHBondContact O-N 3.3Å |
| 415 | F | 84.9 | Confident | 78.3 | Confident | 142 Ų | 142 | 102.6 Ų | 102.6 | 62% | 0.623 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -61.7 | -41.2 | 174.6 | -177.8 | -98.2 | 0 | 0 | 0 | 111.6 | K411 I412 R417 A418 R419 | K411-F415 WeakPolarHBondContact O-CB 3.46Å; K411-F415 PolarHBondContact O-N 3.24Å; I412-F415 PolarHBondContact O-N 2.84Å; F415-R417 PolarHBondContact O-N 3.3Å; F415-A418 PolarHBondContact O-N 2.89Å; F415-R419 VanDerWaalsContact O-CB 3.27Å; F415-R419 WeakPolarHBondContact O-CB 3.09Å; F415-R419 PolarHBondContact O-N 3.39Å |
| 416 | G | 80 | Confident | 77.7 | Confident | 37 Ų | 37 | 101.7 Ų | 101.7 | 38% | 0.381 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -57.4 | -47.5 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112 | I412 H413 Y414 R419 Q420 | I412-G416 PolarHBondContact O-N 3.35Å; H413-G416 PolarHBondContact O-N 3.19Å; Y414-G416 VanDerWaalsContact C-N 3.32Å; Y414-G416 PolarHBondContact O-N 3.48Å; G416-R419 PolarHBondContact O-N 2.71Å; G416-Q420 WeakPolarHBondContact O-CB 3.36Å; G416-Q420 PolarHBondContact O-N 3.11Å |
| 417 | R | 77.4 | Confident | 77.2 | Confident | 110 Ų | 110 | 102.4 Ų | 102.4 | 42% | 0.415 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -65.9 | -39.6 | 175.5 | -69.4 | -158.1 | -65.2 | -157.1 | -0.7 | 113.1 | H413 Y414 F415 Q420 R421 | H413-R417 PolarHBondContact O-N 2.82Å; Y414-R417 PolarHBondContact O-N 2.82Å; F415-R417 PolarHBondContact O-N 3.3Å; R417-Q420 PolarHBondContact O-N 3.4Å; R417-R421 PolarHBondContact O-N 3.49Å |
| 418 | A | 77.5 | Confident | 76.8 | Confident | 54 Ų | 54 | 106 Ų | 106 | 45% | 0.446 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -64.4 | -43.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | Y414 F415 Q420 R421 F422 | Y414-A418 WeakPolarHBondContact O-CB 3.37Å; Y414-A418 PolarHBondContact O-N 3.3Å; F415-A418 PolarHBondContact O-N 2.89Å; A418-Q420 VanDerWaalsContact C-N 3.35Å; A418-Q420 PolarHBondContact O-N 3.17Å; A418-R421 PolarHBondContact O-N 3.08Å; A418-F422 WeakPolarHBondContact O-CB 3.18Å; A418-F422 PolarHBondContact O-N 3.35Å |
| 419 | R | 74.3 | Confident | 76.2 | Confident | 157 Ų | 157 | 106.4 Ų | 106.4 | 59% | 0.592 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -61.6 | -41.6 | 173.9 | -176 | -179.9 | 179 | -172.8 | 0.1 | 111.5 | F415 G416 F422 L423 | F415-R419 VanDerWaalsContact O-CB 3.27Å; F415-R419 WeakPolarHBondContact O-CB 3.09Å; F415-R419 PolarHBondContact O-N 3.39Å; G416-R419 PolarHBondContact O-N 2.71Å; R419-F422 PolarHBondContact O-N 2.66Å; R419-L423 HydrophobicContact CG-CD1 3.96Å; R419-L423 HydrophobicContact CG-CG 4.36Å; R419-L423 WeakPolarHBondContact O-CB 3.32Å; R419-L423 WeakPolarHBondContact O-CG 3.29Å; R419-L423 PolarHBondContact O-N 2.91Å |
| 420 | Q | 74.4 | Confident | 75.6 | Confident | 144 Ų | 144 | 104.5 Ų | 104.5 | 67% | 0.673 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -64.5 | -40.7 | 176 | -170.2 | 175.6 | 2.5 | 0 | 0 | 111.9 | G416 R417 A418 L423 G424 | G416-Q420 WeakPolarHBondContact O-CB 3.36Å; G416-Q420 PolarHBondContact O-N 3.11Å; R417-Q420 PolarHBondContact O-N 3.4Å; A418-Q420 VanDerWaalsContact C-N 3.35Å; A418-Q420 PolarHBondContact O-N 3.17Å; Q420-L423 PolarHBondContact O-N 3.44Å; Q420-G424 PolarHBondContact O-N 2.88Å |
| 421 | R | 70.2 | Confident | 75.3 | Confident | 200 Ų | 200 | 104.1 Ų | 104.1 | 76% | 0.755 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.7 | -40.7 | 172 | -74.1 | -177 | -171.8 | 161.8 | 1 | 112.4 | R417 A418 G424 M425 | R417-R421 PolarHBondContact O-N 3.49Å; A418-R421 PolarHBondContact O-N 3.08Å; R421-G424 PolarHBondContact O-N 3.45Å; R421-M425 PolarHBondContact O-N 3.11Å; R421-M425 VanDerWaalsContact O-N 3.17Å |
| 422 | F | 64.3 | Low | 74.9 | Confident | 106 Ų | 106 | 104.5 Ų | 104.5 | 47% | 0.465 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -68.2 | -38.7 | 177.7 | -165.7 | -95.2 | 0 | 0 | 0 | 112.3 | A418 R419 M425 V433 | A418-F422 WeakPolarHBondContact O-CB 3.18Å; A418-F422 PolarHBondContact O-N 3.35Å; R419-F422 PolarHBondContact O-N 2.66Å; F422-M425 HydrophobicContact CE2-CE 4.29Å; F422-M425 WeakPolarHBondContact O-CB 3.35Å; F422-M425 PolarHBondContact O-N 3.45Å; F422-V433 HydrophobicContact CE2-CG1 4.34Å; F422-V433 HydrophobicContact CZ-CG1 4.44Å |
| 423 | L | 67.2 | Low | 74.6 | Confident | 98 Ų | 98 | 102.2 Ų | 102.2 | 51% | 0.513 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -71.1 | -33.6 | 174.7 | -73.7 | 172 | 0 | 0 | 0 | 112.2 | R419 Q420 M425 R430 | R419-L423 HydrophobicContact CG-CD1 3.96Å; R419-L423 HydrophobicContact CG-CG 4.36Å; R419-L423 WeakPolarHBondContact O-CB 3.32Å; R419-L423 WeakPolarHBondContact O-CG 3.29Å; R419-L423 PolarHBondContact O-N 2.91Å; Q420-L423 PolarHBondContact O-N 3.44Å; L423-M425 VanDerWaalsContact C-N 3.27Å; L423-M425 PolarHBondContact O-N 3.46Å; L423-R430 PolarHBondContact O-NH2 3.19Å |
| 424 | G | 64.3 | Low | 74.4 | Confident | 68 Ų | 68 | 99.9 Ų | 99.9 | 70% | 0.701 | 50% | 0.504 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.4 | 0 | 175.1 | 0 | 0 | 0 | 0 | 0 | 115 | Q420 R421 | Q420-G424 PolarHBondContact O-N 2.88Å; R421-G424 PolarHBondContact O-N 3.45Å |
| 425 | M | 66.2 | Low | 74.2 | Confident | 43 Ų | 43 | 96.4 Ų | 96.4 | 21% | 0.212 | 49% | 0.494 | C | S | . | . | S | Bend | trans | -76 | 131.6 | 178.7 | -152.2 | 175.2 | 66 | 0 | 0 | 110.3 | R421 F422 L423 I429 R430 V433 | R421-M425 PolarHBondContact O-N 3.11Å; R421-M425 VanDerWaalsContact O-N 3.17Å; F422-M425 HydrophobicContact CE2-CE 4.29Å; F422-M425 WeakPolarHBondContact O-CB 3.35Å; F422-M425 PolarHBondContact O-N 3.45Å; L423-M425 VanDerWaalsContact C-N 3.27Å; L423-M425 PolarHBondContact O-N 3.46Å; M425-I429 VanDerWaalsContact CE-C 3.42Å; M425-I429 HydrophobicContact CE-CB 3.58Å; M425-I429 HydrophobicContact CE-CG2 3.4Å; M425-I429 HydrophobicContact CG-CB 3.68Å; M425-I429 HydrophobicContact CG-CD1 3.72Å; M425-I429 HydrophobicContact CG-CG1 4.22Å; M425-I429 HydrophobicContact CG-CG2 3.94Å; M425-I429 HydrophobicContact SD-CB 3.67Å; M425-I429 HydrophobicContact SD-CD1 4.32Å; M425-I429 HydrophobicContact SD-CG2 3.24Å; M425-I429 WeakPolarHBondContact SD-CG2 3.4Å; M425-R430 HydrophobicContact CE-CB 4.47Å; M425-R430 HydrophobicContact CE-CG 3.89Å; M425-V433 HydrophobicContact CE-CG2 4.05Å |
| 426 | S | 70.4 | Confident | 73.9 | Confident | 67 Ų | 67 | 92.1 Ų | 92.1 | 47% | 0.469 | 48% | 0.477 | S | S | . | . | trans | -57 | 151.1 | 178.5 | 55.4 | 0 | 0 | 0 | 0 | 111.9 | D428 I429 R430 | S426-D428 PolarHBondContact O-N 2.65Å; S426-D428 VanDerWaalsContact O-N 3.15Å; S426-I429 PolarHBondContact O-N 3.15Å; S426-R430 PolarHBondContact O-N 2.98Å | ||
| 427 | D | 76.6 | Confident | 73.7 | Confident | 113 Ų | 113 | 92.9 Ų | 92.9 | 60% | 0.604 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -53.5 | -37.2 | -175 | -69.7 | -35 | 0 | 0 | 0 | 112.5 | I429 R430 E431 | D427-I429 PolarHBondContact O-N 3.34Å; D427-R430 WeakPolarHBondContact O-CB 3.46Å; D427-R430 PolarHBondContact O-N 3.39Å; D427-R430 VanDerWaalsContact O-N 3.1Å; D427-R430 IonicContact OD1-NH1 3.35Å; D427-E431 PolarHBondContact O-N 2.94Å |
| 428 | D | 73.8 | Confident | 73.8 | Confident | 114 Ų | 114 | 91 Ų | 91 | 61% | 0.61 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -57.1 | -42.5 | 177.5 | -56.1 | -2.1 | 0 | 0 | 0 | 113.5 | S426 R430 E431 I432 | S426-D428 PolarHBondContact O-N 2.65Å; S426-D428 VanDerWaalsContact O-N 3.15Å; D428-R430 VanDerWaalsContact C-N 3.34Å; D428-E431 WeakPolarHBondContact O-CB 3.39Å; D428-E431 PolarHBondContact O-N 3.47Å; D428-I432 WeakPolarHBondContact O-CG1 3.45Å; D428-I432 PolarHBondContact O-N 2.94Å; D428-I432 VanDerWaalsContact O-N 3.08Å |
| 429 | I | 72.5 | Confident | 73.8 | Confident | 73 Ų | 73 | 89.2 Ų | 89.2 | 37% | 0.374 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -76 | -30.1 | -179 | -48.3 | 172.3 | 0 | 0 | 0 | 109.7 | M425 S426 D427 E431 I432 V433 | M425-I429 VanDerWaalsContact CE-C 3.42Å; M425-I429 HydrophobicContact CE-CB 3.58Å; M425-I429 HydrophobicContact CE-CG2 3.4Å; M425-I429 HydrophobicContact CG-CB 3.68Å; M425-I429 HydrophobicContact CG-CD1 3.72Å; M425-I429 HydrophobicContact CG-CG1 4.22Å; M425-I429 HydrophobicContact CG-CG2 3.94Å; M425-I429 HydrophobicContact SD-CB 3.67Å; M425-I429 HydrophobicContact SD-CD1 4.32Å; M425-I429 HydrophobicContact SD-CG2 3.24Å; M425-I429 WeakPolarHBondContact SD-CG2 3.4Å; S426-I429 PolarHBondContact O-N 3.15Å; D427-I429 PolarHBondContact O-N 3.34Å; I429-E431 VanDerWaalsContact C-N 3.3Å; I429-I432 PolarHBondContact O-N 3.45Å; I429-V433 WeakPolarHBondContact O-CG2 3.46Å; I429-V433 PolarHBondContact O-N 2.79Å |
| 430 | R | 73.6 | Confident | 74 | Confident | 93 Ų | 93 | 89 Ų | 89 | 35% | 0.351 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -63.9 | -39.7 | 172.4 | -68.8 | 179.9 | 175.7 | 174.7 | 1.8 | 110.5 | L423 M425 S426 D427 D428 V433 S434 | L423-R430 PolarHBondContact O-NH2 3.19Å; M425-R430 HydrophobicContact CE-CB 4.47Å; M425-R430 HydrophobicContact CE-CG 3.89Å; S426-R430 PolarHBondContact O-N 2.98Å; D427-R430 WeakPolarHBondContact O-CB 3.46Å; D427-R430 PolarHBondContact O-N 3.39Å; D427-R430 VanDerWaalsContact O-N 3.1Å; D427-R430 IonicContact OD1-NH1 3.35Å; D428-R430 VanDerWaalsContact C-N 3.34Å; R430-V433 PolarHBondContact O-N 3.47Å; R430-S434 WeakPolarHBondContact O-CB 3.46Å; R430-S434 PolarHBondContact O-N 3.3Å |
| 431 | E | 77.5 | Confident | 74.2 | Confident | 132 Ų | 132 | 90.9 Ų | 90.9 | 62% | 0.617 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -59.6 | -49.2 | 172.1 | -72.6 | -169.5 | 170.1 | 0 | 0 | 111.3 | D427 D428 I429 V433 S434 L435 | D427-E431 PolarHBondContact O-N 2.94Å; D428-E431 WeakPolarHBondContact O-CB 3.39Å; D428-E431 PolarHBondContact O-N 3.47Å; I429-E431 VanDerWaalsContact C-N 3.3Å; E431-V433 PolarHBondContact O-N 2.94Å; E431-S434 WeakPolarHBondContact O-CB 3.07Å; E431-S434 PolarHBondContact O-N 3.47Å; E431-S434 VanDerWaalsContact O-N 3.11Å; E431-S434 PolarHBondContact O-OG 2.85Å; E431-L435 WeakPolarHBondContact O-CB 3.49Å; E431-L435 PolarHBondContact O-N 2.98Å |
| 432 | I | 77.6 | Confident | 74.7 | Confident | 95 Ų | 95 | 89.6 Ų | 89.6 | 49% | 0.487 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -58.2 | -46.1 | 178.4 | -66.3 | 167.4 | 0 | 0 | 0 | 111.4 | D428 I429 S434 L435 I436 | D428-I432 WeakPolarHBondContact O-CG1 3.45Å; D428-I432 PolarHBondContact O-N 2.94Å; D428-I432 VanDerWaalsContact O-N 3.08Å; I429-I432 PolarHBondContact O-N 3.45Å; I432-S434 VanDerWaalsContact C-N 3.32Å; I432-S434 PolarHBondContact O-N 3.31Å; I432-L435 WeakPolarHBondContact O-CB 3.32Å; I432-L435 PolarHBondContact O-N 3.38Å; I432-I436 HydrophobicContact CG2-CD1 3.85Å; I432-I436 VanDerWaalsContact O-CG1 3.32Å; I432-I436 WeakPolarHBondContact O-CG1 3.41Å; I432-I436 PolarHBondContact O-N 2.88Å |
| 433 | V | 76.1 | Confident | 75.4 | Confident | 60 Ų | 60 | 90 Ų | 90 | 36% | 0.364 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -62.7 | -40.4 | 177.1 | 172 | 0 | 0 | 0 | 0 | 111.1 | F422 M425 I429 R430 E431 L435 I436 S437 | F422-V433 HydrophobicContact CE2-CG1 4.34Å; F422-V433 HydrophobicContact CZ-CG1 4.44Å; M425-V433 HydrophobicContact CE-CG2 4.05Å; I429-V433 WeakPolarHBondContact O-CG2 3.46Å; I429-V433 PolarHBondContact O-N 2.79Å; R430-V433 PolarHBondContact O-N 3.47Å; E431-V433 PolarHBondContact O-N 2.94Å; V433-L435 VanDerWaalsContact C-N 3.31Å; V433-L435 PolarHBondContact O-N 3.44Å; V433-I436 PolarHBondContact O-N 3.48Å; V433-S437 WeakPolarHBondContact O-CB 3.45Å; V433-S437 PolarHBondContact O-N 3.04Å |
| 434 | S | 78.4 | Confident | 75.6 | Confident | 60 Ų | 60 | 88.8 Ų | 88.8 | 42% | 0.42 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62.4 | -39.6 | 175.4 | 83.3 | 0 | 0 | 0 | 0 | 111.7 | R430 E431 I432 S437 T438 | R430-S434 WeakPolarHBondContact O-CB 3.46Å; R430-S434 PolarHBondContact O-N 3.3Å; E431-S434 WeakPolarHBondContact O-CB 3.07Å; E431-S434 PolarHBondContact O-N 3.47Å; E431-S434 VanDerWaalsContact O-N 3.11Å; E431-S434 PolarHBondContact O-OG 2.85Å; I432-S434 VanDerWaalsContact C-N 3.32Å; I432-S434 PolarHBondContact O-N 3.31Å; S434-S437 WeakPolarHBondContact O-CB 3.45Å; S434-S437 PolarHBondContact O-N 3.21Å; S434-S437 VanDerWaalsContact O-N 3.15Å; S434-S437 PolarHBondContact O-OG 3.45Å; S434-T438 WeakPolarHBondContact O-CG2 3.18Å; S434-T438 PolarHBondContact O-N 3.1Å; S434-T438 PolarHBondContact O-OG1 3.49Å |
| 435 | L | 80.6 | Confident | 76.3 | Confident | 58 Ų | 58 | 87.2 Ų | 87.2 | 30% | 0.304 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -70 | -38.5 | -179.3 | -148.6 | 140.5 | 0 | 0 | 0 | 111.7 | E431 I432 V433 S437 T438 L439 Y455 | E431-L435 WeakPolarHBondContact O-CB 3.49Å; E431-L435 PolarHBondContact O-N 2.98Å; I432-L435 WeakPolarHBondContact O-CB 3.32Å; I432-L435 PolarHBondContact O-N 3.38Å; V433-L435 VanDerWaalsContact C-N 3.31Å; V433-L435 PolarHBondContact O-N 3.44Å; L435-S437 VanDerWaalsContact C-N 3.31Å; L435-S437 PolarHBondContact O-N 2.95Å; L435-T438 PolarHBondContact O-OG1 3.46Å; L435-L439 HydrophobicContact CD2-CD1 4.39Å; L435-L439 WeakPolarHBondContact O-CB 3.12Å; L435-L439 WeakPolarHBondContact O-CG 3.46Å; L435-L439 PolarHBondContact O-N 3.03Å; L435-L439 VanDerWaalsContact O-N 3.1Å; L435-Y455 HydrophobicContact CD2-CD1 3.59Å; L435-Y455 HydrophobicContact CD2-CE1 3.63Å; L435-Y455 HydrophobicContact CG-CE1 4.23Å |
| 436 | I | 79.5 | Confident | 76.7 | Confident | 53 Ų | 53 | 92.9 Ų | 92.9 | 27% | 0.272 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -64.3 | -38.4 | 170.5 | -66 | 164 | 0 | 0 | 0 | 110.6 | I432 V433 L439 R440 L452 | I432-I436 HydrophobicContact CG2-CD1 3.85Å; I432-I436 VanDerWaalsContact O-CG1 3.32Å; I432-I436 WeakPolarHBondContact O-CG1 3.41Å; I432-I436 PolarHBondContact O-N 2.88Å; V433-I436 PolarHBondContact O-N 3.48Å; I436-L439 PolarHBondContact O-N 3.08Å; I436-R440 WeakPolarHBondContact O-CB 3.48Å; I436-R440 PolarHBondContact O-N 3.33Å; I436-L452 HydrophobicContact CG1-CD1 3.84Å |
| 437 | S | 76.4 | Confident | 76.9 | Confident | 53 Ų | 53 | 91.5 Ų | 91.5 | 37% | 0.371 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -69.1 | -38.1 | 179.6 | 84.4 | 0 | 0 | 0 | 0 | 113 | V433 S434 L435 R440 K441 | V433-S437 WeakPolarHBondContact O-CB 3.45Å; V433-S437 PolarHBondContact O-N 3.04Å; S434-S437 WeakPolarHBondContact O-CB 3.45Å; S434-S437 PolarHBondContact O-N 3.21Å; S434-S437 VanDerWaalsContact O-N 3.15Å; S434-S437 PolarHBondContact O-OG 3.45Å; L435-S437 VanDerWaalsContact C-N 3.31Å; L435-S437 PolarHBondContact O-N 2.95Å; S437-R440 PolarHBondContact O-N 3.36Å; S437-K441 PolarHBondContact O-N 3.47Å |
| 438 | T | 78.8 | Confident | 76.9 | Confident | 69 Ų | 69 | 89.4 Ų | 89.4 | 42% | 0.423 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -67.6 | -40.2 | 175.2 | 54.9 | 0 | 0 | 0 | 0 | 110.9 | S434 L435 K441 K442 | S434-T438 WeakPolarHBondContact O-CG2 3.18Å; S434-T438 PolarHBondContact O-N 3.1Å; S434-T438 PolarHBondContact O-OG1 3.49Å; L435-T438 PolarHBondContact O-OG1 3.46Å; T438-K441 PolarHBondContact O-N 3.43Å; T438-K442 WeakPolarHBondContact O-CB 3.44Å; T438-K442 PolarHBondContact O-N 2.92Å |
| 439 | L | 77.3 | Confident | 77.1 | Confident | 17 Ų | 17 | 94.2 Ų | 94.2 | 9% | 0.089 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -59.6 | -47 | 172.6 | -85.8 | 173.8 | 0 | 0 | 0 | 112.8 | L435 I436 K441 K442 K443 V447 L452 Y455 | L435-L439 HydrophobicContact CD2-CD1 4.39Å; L435-L439 WeakPolarHBondContact O-CB 3.12Å; L435-L439 WeakPolarHBondContact O-CG 3.46Å; L435-L439 PolarHBondContact O-N 3.03Å; L435-L439 VanDerWaalsContact O-N 3.1Å; I436-L439 PolarHBondContact O-N 3.08Å; L439-K441 PolarHBondContact O-N 3.24Å; L439-K442 PolarHBondContact O-N 3.22Å; L439-K442 VanDerWaalsContact O-N 3.16Å; L439-K443 PolarHBondContact O-N 2.92Å; L439-V447 HydrophobicContact CB-CG1 4.48Å; L439-V447 HydrophobicContact CB-CG2 4.37Å; L439-L452 HydrophobicContact CD1-CD1 3.49Å; L439-L452 VanDerWaalsContact CD1-CD1 3.49Å; L439-Y455 HydrophobicContact CD1-CD1 4.1Å; L439-Y455 HydrophobicContact CD1-CG 3.92Å; L439-Y455 HydrophobicContact CD2-CD1 4.26Å; L439-Y455 HydrophobicContact CD2-CD2 3.26Å; L439-Y455 HydrophobicContact CD2-CE2 3.78Å; L439-Y455 HydrophobicContact CD2-CG 3.52Å; L439-Y455 HydrophobicContact CG-CD1 4.25Å; L439-Y455 HydrophobicContact CG-CD2 4.09Å; L439-Y455 HydrophobicContact CG-CE2 4.42Å; L439-Y455 HydrophobicContact CG-CG 3.97Å |
| 440 | R | 78.4 | Confident | 77.4 | Confident | 153 Ų | 153 | 96.4 Ų | 96.4 | 58% | 0.577 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -61 | -44.3 | 177.6 | -171.4 | -179.7 | -66.6 | -177.7 | -1.5 | 111.6 | I436 S437 K442 K443 G444 V447 | I436-R440 WeakPolarHBondContact O-CB 3.48Å; I436-R440 PolarHBondContact O-N 3.33Å; S437-R440 PolarHBondContact O-N 3.36Å; R440-K442 VanDerWaalsContact C-N 3.3Å; R440-K442 PolarHBondContact O-N 3.22Å; R440-K443 PolarHBondContact O-N 3.41Å; R440-G444 PolarHBondContact O-N 3.14Å; R440-V447 HydrophobicContact CB-CG2 3.85Å; R440-V447 HydrophobicContact CG-CG2 4.35Å |
| 441 | K | 79.2 | Confident | 77.6 | Confident | 184 Ų | 184 | 93.4 Ų | 93.4 | 80% | 0.8 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -61.1 | -37.9 | 175 | -78.9 | -176.6 | 179 | 179.8 | 0 | 112.5 | S437 T438 L439 | S437-K441 PolarHBondContact O-N 3.47Å; T438-K441 PolarHBondContact O-N 3.43Å; L439-K441 PolarHBondContact O-N 3.24Å |
| 442 | K | 79.6 | Confident | 77.7 | Confident | 173 Ų | 173 | 88.1 Ų | 88.1 | 75% | 0.752 | 46% | 0.455 | S | S | * | . | H | α-helix | trans | -73.4 | -37 | -179.2 | -162.6 | 178.9 | -178.3 | -175.2 | 0 | 112.8 | T438 L439 R440 | T438-K442 WeakPolarHBondContact O-CB 3.44Å; T438-K442 PolarHBondContact O-N 2.92Å; L439-K442 PolarHBondContact O-N 3.22Å; L439-K442 VanDerWaalsContact O-N 3.16Å; R440-K442 VanDerWaalsContact C-N 3.3Å; R440-K442 PolarHBondContact O-N 3.22Å |
| 443 | K | 78.7 | Confident | 77.8 | Confident | 113 Ų | 113 | 89.4 Ų | 89.4 | 49% | 0.491 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -87 | -25.2 | -178.4 | -167.6 | 170.9 | 178 | 175.9 | 0 | 113.4 | L439 R440 G445 D451 | L439-K443 PolarHBondContact O-N 2.92Å; R440-K443 PolarHBondContact O-N 3.41Å; K443-G445 VanDerWaalsContact C-N 3.25Å; K443-G445 PolarHBondContact O-N 3.11Å; K443-D451 WeakPolarHBondContact CD-OD2 3.37Å; K443-D451 IonicContact NZ-OD1 2.73Å; K443-D451 PolarHBondContact NZ-OD1 3.02Å; K443-D451 IonicContact NZ-OD2 2.59Å; K443-D451 PolarHBondContact NZ-OD2 3.49Å |
| 444 | G | 73 | Confident | 77.9 | Confident | 74 Ų | 74 | 93 Ų | 93 | 76% | 0.763 | 47% | 0.47 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 68.4 | 20.2 | -179.4 | 0 | 0 | 0 | 0 | 0 | 114.3 | R440 | R440-G444 PolarHBondContact O-N 3.14Š|
| 445 | G | 79 | Confident | 77.8 | Confident | 35 Ų | 35 | 93.1 Ų | 93.1 | 36% | 0.361 | 46% | 0.461 | S | S | . | . | S | Bend | trans | -160.1 | -171.2 | -175.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | K443 V447 | K443-G445 VanDerWaalsContact C-N 3.25Å; K443-G445 PolarHBondContact O-N 3.11Å; G445-V447 PolarHBondContact O-N 3.38Å |
| 446 | K | 73.2 | Confident | 77.7 | Confident | 162 Ų | 162 | 94.7 Ų | 94.7 | 70% | 0.704 | 47% | 0.469 | S | S | * | . | P | Polyproline II helix | trans | -61.4 | 125.7 | 176.4 | -68.4 | -178.2 | -179 | -178.9 | 0 | 109.6 | ||
| 447 | V | 74.4 | Confident | 77.5 | Confident | 37 Ų | 37 | 96.9 Ų | 96.9 | 22% | 0.224 | 48% | 0.479 | C | S | . | . | P | Polyproline II helix | trans | -87.3 | 118.7 | 176.7 | 179.6 | 0 | 0 | 0 | 0 | 107.4 | L439 R440 G445 D451 | L439-V447 HydrophobicContact CB-CG1 4.48Å; L439-V447 HydrophobicContact CB-CG2 4.37Å; R440-V447 HydrophobicContact CB-CG2 3.85Å; R440-V447 HydrophobicContact CG-CG2 4.35Å; G445-V447 PolarHBondContact O-N 3.38Å; V447-D451 HydrophobicContact CG1-CB 4.03Å |
| 448 | T | 78.1 | Confident | 77.5 | Confident | 69 Ų | 69 | 97 Ų | 97 | 42% | 0.423 | 48% | 0.483 | S | S | . | . | P | Polyproline II helix | trans | -85.9 | 160.4 | 174.9 | 56 | 0 | 0 | 0 | 0 | 110.5 | D450 D451 L452 | T448-D450 PolarHBondContact O-N 2.87Å; T448-D451 PolarHBondContact N-OD2 2.8Å; T448-D451 WeakPolarHBondContact O-CB 3.45Å; T448-D451 PolarHBondContact O-N 3.21Å; T448-D451 VanDerWaalsContact O-N 3.08Å; T448-D451 VanDerWaalsContact OG1-CG 3.32Å; T448-D451 PolarHBondContact OG1-OD2 2.78Å; T448-L452 PolarHBondContact O-N 3.46Å |
| 449 | W | 77.1 | Confident | 76.9 | Confident | 215 Ų | 215 | 97.3 Ų | 97.3 | 81% | 0.814 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -55.5 | -33.3 | 173.5 | -79 | 110.8 | 0 | 0 | 0 | 112.3 | L452 K453 | W449-L452 HydrophobicContact CE3-CD2 3.87Å; W449-L452 HydrophobicContact CZ3-CD2 3.71Å; W449-L452 PolarHBondContact O-N 3.31Å; W449-K453 VanDerWaalsContact O-CB 3.28Å; W449-K453 WeakPolarHBondContact O-CB 3.35Å; W449-K453 PolarHBondContact O-N 2.86Å |
| 450 | D | 79 | Confident | 76.4 | Confident | 119 Ų | 119 | 107.2 Ų | 107.2 | 64% | 0.636 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -65.5 | -39.3 | 176.6 | -61.9 | -39 | 0 | 0 | 0 | 112.2 | T448 K453 Q454 | T448-D450 PolarHBondContact O-N 2.87Å; D450-K453 PolarHBondContact O-N 2.84Å; D450-Q454 VanDerWaalsContact O-CB 3.26Å; D450-Q454 WeakPolarHBondContact O-CB 3.28Å; D450-Q454 PolarHBondContact O-N 3.29Å |
| 451 | D | 78.5 | Confident | 75.4 | Confident | 31 Ų | 31 | 107.5 Ų | 107.5 | 17% | 0.166 | 53% | 0.526 | C | S | . | . | H | α-helix | trans | -64.8 | -43.6 | 175.1 | -59.4 | -45.2 | 0 | 0 | 0 | 111.3 | K443 V447 T448 K453 Q454 Y455 | K443-D451 WeakPolarHBondContact CD-OD2 3.37Å; K443-D451 IonicContact NZ-OD1 2.73Å; K443-D451 PolarHBondContact NZ-OD1 3.02Å; K443-D451 IonicContact NZ-OD2 2.59Å; K443-D451 PolarHBondContact NZ-OD2 3.49Å; V447-D451 HydrophobicContact CG1-CB 4.03Å; T448-D451 PolarHBondContact N-OD2 2.8Å; T448-D451 WeakPolarHBondContact O-CB 3.45Å; T448-D451 PolarHBondContact O-N 3.21Å; T448-D451 VanDerWaalsContact O-N 3.08Å; T448-D451 VanDerWaalsContact OG1-CG 3.32Å; T448-D451 PolarHBondContact OG1-OD2 2.78Å; D451-K453 VanDerWaalsContact C-N 3.34Å; D451-Q454 PolarHBondContact O-N 3.4Å; D451-Y455 WeakPolarHBondContact O-CB 3.29Å; D451-Y455 PolarHBondContact O-N 3.33Å |
| 452 | L | 78.9 | Confident | 74.5 | Confident | 21 Ų | 21 | 106.2 Ų | 106.2 | 11% | 0.11 | 52% | 0.516 | C | S | . | . | H | α-helix | trans | -64 | -43.8 | 179.1 | -172 | 72.6 | 0 | 0 | 0 | 110.2 | I436 L439 T448 W449 Y455 L456 | I436-L452 HydrophobicContact CG1-CD1 3.84Å; L439-L452 HydrophobicContact CD1-CD1 3.49Å; L439-L452 VanDerWaalsContact CD1-CD1 3.49Å; T448-L452 PolarHBondContact O-N 3.46Å; W449-L452 HydrophobicContact CE3-CD2 3.87Å; W449-L452 HydrophobicContact CZ3-CD2 3.71Å; W449-L452 PolarHBondContact O-N 3.31Å; L452-Y455 PolarHBondContact O-N 2.86Å; L452-L456 HydrophobicContact CG-CD1 4.1Å; L452-L456 WeakPolarHBondContact O-CB 3.4Å; L452-L456 WeakPolarHBondContact O-CG 3.43Å; L452-L456 PolarHBondContact O-N 2.84Å |
| 453 | K | 79.8 | Confident | 73.8 | Confident | 121 Ų | 121 | 103 Ų | 103 | 53% | 0.526 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -61 | -46.6 | 174.6 | -176 | 177.7 | 173.7 | -175.8 | 0 | 110.7 | W449 D450 D451 Y455 L456 E457 | W449-K453 VanDerWaalsContact O-CB 3.28Å; W449-K453 WeakPolarHBondContact O-CB 3.35Å; W449-K453 PolarHBondContact O-N 2.86Å; D450-K453 PolarHBondContact O-N 2.84Å; D451-K453 VanDerWaalsContact C-N 3.34Å; K453-Y455 VanDerWaalsContact C-N 3.31Å; K453-Y455 PolarHBondContact O-N 2.81Å; K453-L456 PolarHBondContact O-N 3.36Å; K453-E457 WeakPolarHBondContact CE-OE1 3.47Å; K453-E457 HydrophobicContact CG-CG 4.38Å; K453-E457 VanDerWaalsContact O-CB 3.29Å; K453-E457 WeakPolarHBondContact O-CB 3.15Å; K453-E457 VanDerWaalsContact O-CG 3.28Å; K453-E457 WeakPolarHBondContact O-CG 3.37Å; K453-E457 PolarHBondContact O-N 2.94Å |
| 454 | Q | 78.8 | Confident | 73 | Confident | 136 Ų | 136 | 106.4 Ų | 106.4 | 64% | 0.636 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -62.3 | -38.5 | 178 | -170.6 | 177 | 35.6 | 0 | 0 | 111.9 | D450 D451 A458 | D450-Q454 VanDerWaalsContact O-CB 3.26Å; D450-Q454 WeakPolarHBondContact O-CB 3.28Å; D450-Q454 PolarHBondContact O-N 3.29Å; D451-Q454 PolarHBondContact O-N 3.4Å; Q454-A458 VanDerWaalsContact O-CB 3.27Å; Q454-A458 WeakPolarHBondContact O-CB 3.32Å; Q454-A458 PolarHBondContact O-N 3.14Å |
| 455 | Y | 76.2 | Confident | 72.7 | Confident | 62 Ų | 62 | 108.4 Ų | 108.4 | 24% | 0.243 | 52% | 0.52 | C | S | . | . | H | α-helix | trans | -70.3 | -44.2 | 176.3 | -166.2 | -92.4 | 0 | 0 | 0 | 112.1 | L435 L439 D451 L452 K453 E457 A458 E459 | L435-Y455 HydrophobicContact CD2-CD1 3.59Å; L435-Y455 HydrophobicContact CD2-CE1 3.63Å; L435-Y455 HydrophobicContact CG-CE1 4.23Å; L439-Y455 HydrophobicContact CD1-CD1 4.1Å; L439-Y455 HydrophobicContact CD1-CG 3.92Å; L439-Y455 HydrophobicContact CD2-CD1 4.26Å; L439-Y455 HydrophobicContact CD2-CD2 3.26Å; L439-Y455 HydrophobicContact CD2-CE2 3.78Å; L439-Y455 HydrophobicContact CD2-CG 3.52Å; L439-Y455 HydrophobicContact CG-CD1 4.25Å; L439-Y455 HydrophobicContact CG-CD2 4.09Å; L439-Y455 HydrophobicContact CG-CE2 4.42Å; L439-Y455 HydrophobicContact CG-CG 3.97Å; D451-Y455 WeakPolarHBondContact O-CB 3.29Å; D451-Y455 PolarHBondContact O-N 3.33Å; L452-Y455 PolarHBondContact O-N 2.86Å; K453-Y455 VanDerWaalsContact C-N 3.31Å; K453-Y455 PolarHBondContact O-N 2.81Å; Y455-E457 VanDerWaalsContact C-N 3.32Å; Y455-E457 PolarHBondContact O-N 3.16Å; Y455-A458 PolarHBondContact O-N 3.33Å; Y455-E459 WeakPolarHBondContact O-CB 3.27Å; Y455-E459 PolarHBondContact O-N 3.43Å |
| 456 | L | 76.7 | Confident | 72 | Confident | 91 Ų | 91 | 109.3 Ų | 109.3 | 48% | 0.476 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.7 | -37.8 | 174.9 | -77 | 167.4 | 0 | 0 | 0 | 111.9 | L452 K453 E459 R460 | L452-L456 HydrophobicContact CG-CD1 4.1Å; L452-L456 WeakPolarHBondContact O-CB 3.4Å; L452-L456 WeakPolarHBondContact O-CG 3.43Å; L452-L456 PolarHBondContact O-N 2.84Å; K453-L456 PolarHBondContact O-N 3.36Å; L456-E459 PolarHBondContact O-N 3.19Å; L456-R460 WeakPolarHBondContact O-CB 3.28Å; L456-R460 PolarHBondContact O-N 3.31Å |
| 457 | E | 77.4 | Confident | 71.5 | Confident | 99 Ų | 99 | 112.8 Ų | 112.8 | 46% | 0.463 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -66.4 | -44.9 | 173.4 | -77.6 | 175.8 | 179.9 | 0 | 0 | 111 | K453 Y455 E459 R460 M461 | K453-E457 WeakPolarHBondContact CE-OE1 3.47Å; K453-E457 HydrophobicContact CG-CG 4.38Å; K453-E457 VanDerWaalsContact O-CB 3.29Å; K453-E457 WeakPolarHBondContact O-CB 3.15Å; K453-E457 VanDerWaalsContact O-CG 3.28Å; K453-E457 WeakPolarHBondContact O-CG 3.37Å; K453-E457 PolarHBondContact O-N 2.94Å; Y455-E457 VanDerWaalsContact C-N 3.32Å; Y455-E457 PolarHBondContact O-N 3.16Å; E457-E459 VanDerWaalsContact C-N 3.3Å; E457-E459 PolarHBondContact O-N 2.59Å; E457-R460 PolarHBondContact O-N 3Å; E457-M461 VanDerWaalsContact O-CB 3.26Å; E457-M461 WeakPolarHBondContact O-CB 3.4Å; E457-M461 WeakPolarHBondContact O-CG 3.33Å; E457-M461 PolarHBondContact O-N 2.88Å |
| 458 | A | 74.7 | Confident | 70.8 | Confident | 57 Ų | 57 | 115.8 Ų | 115.8 | 47% | 0.471 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -60.9 | -39.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | Q454 Y455 M461 R462 | Q454-A458 VanDerWaalsContact O-CB 3.27Å; Q454-A458 WeakPolarHBondContact O-CB 3.32Å; Q454-A458 PolarHBondContact O-N 3.14Å; Y455-A458 PolarHBondContact O-N 3.33Å; A458-M461 PolarHBondContact O-N 2.98Å; A458-R462 PolarHBondContact O-N 3.46Å |
| 459 | E | 66.5 | Low | 70.3 | Confident | 74 Ų | 74 | 115.8 Ų | 115.8 | 35% | 0.346 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -72.1 | -40.8 | 177.8 | -148.2 | 67.8 | -165.8 | 0 | 0 | 111.7 | Y455 L456 E457 M461 R462 | Y455-E459 WeakPolarHBondContact O-CB 3.27Å; Y455-E459 PolarHBondContact O-N 3.43Å; L456-E459 PolarHBondContact O-N 3.19Å; E457-E459 VanDerWaalsContact C-N 3.3Å; E457-E459 PolarHBondContact O-N 2.59Å; E459-M461 PolarHBondContact O-N 3.35Å; E459-R462 WeakPolarHBondContact O-CB 3.04Å; E459-R462 WeakPolarHBondContact O-CG 3.26Å; E459-R462 PolarHBondContact O-N 2.87Å; E459-R462 VanDerWaalsContact O-N 3.1Å; E459-R462 IonicContact OE1-CZ 3.27Å; E459-R462 VanDerWaalsContact OE1-CZ 3.27Å; E459-R462 IonicContact OE1-NE 3.02Å; E459-R462 PolarHBondContact OE1-NE 2.73Å; E459-R462 IonicContact OE1-NH2 3.21Å; E459-R462 PolarHBondContact OE1-NH2 2.91Å; E459-R462 IonicContact OE2-CZ 3.26Å; E459-R462 VanDerWaalsContact OE2-CZ 3.26Å; E459-R462 IonicContact OE2-NE 2.87Å; E459-R462 PolarHBondContact OE2-NE 3Å; E459-R462 IonicContact OE2-NH2 2.8Å; E459-R462 PolarHBondContact OE2-NH2 3.11Å |
| 460 | R | 67.5 | Low | 69.5 | Low | 226 Ų | 226 | 112.4 Ų | 112.4 | 85% | 0.853 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -64.1 | -30.4 | 173.7 | -176.2 | 177.4 | 176.5 | 177.3 | -0 | 112.2 | L456 E457 R462 | L456-R460 WeakPolarHBondContact O-CB 3.28Å; L456-R460 PolarHBondContact O-N 3.31Å; E457-R460 PolarHBondContact O-N 3Å; R460-R462 VanDerWaalsContact C-N 3.26Å |
| 461 | M | 58.1 | Low | 68.9 | Low | 159 Ų | 159 | 112.2 Ų | 112.2 | 78% | 0.783 | 53% | 0.531 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.9 | -4 | 176.4 | -70 | -76.2 | -78.7 | 0 | 0 | 112.9 | E457 A458 E459 P463 | E457-M461 VanDerWaalsContact O-CB 3.26Å; E457-M461 WeakPolarHBondContact O-CB 3.4Å; E457-M461 WeakPolarHBondContact O-CG 3.33Å; E457-M461 PolarHBondContact O-N 2.88Å; A458-M461 PolarHBondContact O-N 2.98Å; E459-M461 PolarHBondContact O-N 3.35Å; M461-P463 WeakPolarHBondContact O-CD 2.95Å |
| 462 | R | 60.2 | Low | 67.8 | Low | 156 Ų | 156 | 119.3 Ų | 119.3 | 59% | 0.589 | 56% | 0.555 | S | S | * | * | S | Bend | trans | -67.5 | 125.7 | 167.6 | -63.1 | -172.9 | -170.9 | -136.3 | 18.1 | 108.2 | A458 E459 R460 F464 | A458-R462 PolarHBondContact O-N 3.46Å; E459-R462 WeakPolarHBondContact O-CB 3.04Å; E459-R462 WeakPolarHBondContact O-CG 3.26Å; E459-R462 PolarHBondContact O-N 2.87Å; E459-R462 VanDerWaalsContact O-N 3.1Å; E459-R462 IonicContact OE1-CZ 3.27Å; E459-R462 VanDerWaalsContact OE1-CZ 3.27Å; E459-R462 IonicContact OE1-NE 3.02Å; E459-R462 PolarHBondContact OE1-NE 2.73Å; E459-R462 IonicContact OE1-NH2 3.21Å; E459-R462 PolarHBondContact OE1-NH2 2.91Å; E459-R462 IonicContact OE2-CZ 3.26Å; E459-R462 VanDerWaalsContact OE2-CZ 3.26Å; E459-R462 IonicContact OE2-NE 2.87Å; E459-R462 PolarHBondContact OE2-NE 3Å; E459-R462 IonicContact OE2-NH2 2.8Å; E459-R462 PolarHBondContact OE2-NH2 3.11Å; R460-R462 VanDerWaalsContact C-N 3.26Å; R462-F464 PolarHBondContact O-N 3.38Å |
| 463 | P | 63 | Low | 66.7 | Low | 106 Ų | 106 | 126.5 Ų | 126.5 | 69% | 0.688 | 59% | 0.586 | S | S | * | * | trans | -54.2 | 136.4 | 174.6 | -21 | 30.1 | 0 | 0 | 0 | 109.7 | M461 I465 | M461-P463 WeakPolarHBondContact O-CD 2.95Å; P463-I465 PolarHBondContact O-N 3.1Å | ||
| 464 | F | 62.3 | Low | 65.6 | Low | 185 Ų | 185 | 127.9 Ų | 127.9 | 81% | 0.811 | 59% | 0.589 | S | S | * | * | trans | -60.6 | 108.3 | 171.9 | 175.4 | -97.1 | 0 | 0 | 0 | 108.9 | R462 P466 | R462-F464 PolarHBondContact O-N 3.38Å; F464-P466 HydrophobicContact CE1-CB 4.03Å; F464-P466 WeakPolarHBondContact O-CD 3.26Å | ||
| 465 | I | 66.5 | Low | 64.6 | Low | 116 Ų | 116 | 124.6 Ų | 124.6 | 60% | 0.595 | 58% | 0.578 | S | S | * | * | trans | -95.8 | 107.1 | 175.3 | -63.3 | 161.1 | 0 | 0 | 0 | 107.1 | P463 I469 | P463-I465 PolarHBondContact O-N 3.1Å; I465-I469 HydrophobicContact CG2-CB 4.05Å; I465-I469 HydrophobicContact CG2-CD1 3.85Å; I465-I469 HydrophobicContact CG2-CG2 3.62Å | ||
| 466 | P | 64.6 | Low | 63.6 | Low | 53 Ų | 53 | 128.8 Ų | 128.8 | 34% | 0.344 | 61% | 0.605 | S | S | . | * | trans | -61.6 | 141.3 | 175.5 | 23.8 | -31.7 | 0 | 0 | 0 | 110.3 | F464 N468 I469 | F464-P466 HydrophobicContact CE1-CB 4.03Å; F464-P466 WeakPolarHBondContact O-CD 3.26Å; P466-N468 PolarHBondContact O-N 3.41Å; P466-I469 PolarHBondContact O-N 3.41Å | ||
| 467 | R | 62.7 | Low | 62.2 | Low | 236 Ų | 236 | 131.4 Ų | 131.4 | 89% | 0.891 | 61% | 0.614 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -52.6 | -21.9 | -177.5 | -72.9 | -175.8 | 177.7 | -167.5 | -0.1 | 114.1 | H470 | R467-H470 PolarHBondContact O-ND1 2.88Š|
| 468 | N | 59.9 | Low | 60.6 | Low | 100 Ų | 100 | 131.9 Ų | 131.9 | 54% | 0.535 | 62% | 0.624 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -97.7 | 13.1 | -177 | -64.4 | -16.9 | 0 | 0 | 0 | 114.3 | P466 H470 L471 | P466-N468 PolarHBondContact O-N 3.41Å; N468-H470 PolarHBondContact O-N 3.35Å; N468-H470 VanDerWaalsContact O-N 3.11Å; N468-L471 HydrophobicContact CB-CD1 3.84Å; N468-L471 WeakPolarHBondContact O-CB 3.46Å; N468-L471 PolarHBondContact O-N 2.8Å |
| 469 | I | 67 | Low | 59.4 | Low | 68 Ų | 68 | 134.1 Ų | 134.1 | 35% | 0.349 | 64% | 0.636 | S | S | . | * | G | 310 helix | trans | -58.2 | -28.9 | -177.3 | -159.3 | 158.3 | 0 | 0 | 0 | 113.5 | I465 P466 L471 W472 V475 | I465-I469 HydrophobicContact CG2-CB 4.05Å; I465-I469 HydrophobicContact CG2-CD1 3.85Å; I465-I469 HydrophobicContact CG2-CG2 3.62Å; P466-I469 PolarHBondContact O-N 3.41Å; I469-L471 PolarHBondContact O-N 3.1Å; I469-W472 PolarHBondContact O-N 3.31Å; I469-W472 VanDerWaalsContact O-N 3.1Å; I469-V475 HydrophobicContact CD1-CG1 4.26Å; I469-V475 HydrophobicContact CG1-CG1 4.43Å |
| 470 | H | 62 | Low | 58.3 | Low | 144 Ų | 144 | 134.5 Ų | 134.5 | 67% | 0.667 | 65% | 0.647 | S | S | * | * | G | 310 helix | trans | -68.5 | -19.3 | 177.7 | 66.8 | -84.8 | 0 | 0 | 0 | 113.9 | R467 N468 W472 | R467-H470 PolarHBondContact O-ND1 2.88Å; N468-H470 PolarHBondContact O-N 3.35Å; N468-H470 VanDerWaalsContact O-N 3.11Å; H470-W472 VanDerWaalsContact C-N 3.26Å |
| 471 | L | 64.9 | Low | 57 | Low | 116 Ų | 116 | 127.9 Ų | 127.9 | 61% | 0.607 | 64% | 0.641 | S | S | * | * | G | 310 helix | trans | -75.4 | -18.9 | 173.5 | -78.1 | 141.3 | 0 | 0 | 0 | 111.7 | N468 I469 K473 | N468-L471 HydrophobicContact CB-CD1 3.84Å; N468-L471 WeakPolarHBondContact O-CB 3.46Å; N468-L471 PolarHBondContact O-N 2.8Å; I469-L471 PolarHBondContact O-N 3.1Å; L471-K473 PolarHBondContact O-N 3.41Å |
| 472 | W | 55.4 | Low | 56 | Low | 180 Ų | 180 | 126.7 Ų | 126.7 | 68% | 0.682 | 64% | 0.642 | S | S | * | * | trans | -100.7 | 82.4 | -177.8 | -63 | 1.9 | 0 | 0 | 0 | 109.4 | I469 H470 Y474 V475 | I469-W472 PolarHBondContact O-N 3.31Å; I469-W472 VanDerWaalsContact O-N 3.1Å; H470-W472 VanDerWaalsContact C-N 3.26Å; W472-Y474 PolarHBondContact O-N 3.31Å; W472-V475 HydrophobicContact CB-CG2 3.64Å; W472-V475 HydrophobicContact CE3-CG2 3.88Å; W472-V475 PolarHBondContact O-N 2.88Å | ||
| 473 | K | 56 | Low | 54.8 | Low | 171 Ų | 171 | 124.1 Ų | 124.1 | 74% | 0.743 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -51.3 | -18.1 | -176.7 | -173.5 | 176.7 | 177.3 | -172.6 | 0 | 115.2 | L471 | L471-K473 PolarHBondContact O-N 3.41Š|
| 474 | Y | 57.8 | Low | 53.2 | Low | 150 Ų | 150 | 124.6 Ų | 124.6 | 59% | 0.588 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -117.9 | 15.5 | -169.7 | -62.7 | -79.5 | 0 | 0 | 0 | 114.8 | W472 D476 E477 | W472-Y474 PolarHBondContact O-N 3.31Å; Y474-D476 VanDerWaalsContact C-N 3.28Å; Y474-D476 PolarHBondContact O-N 3.35Å; Y474-E477 PolarHBondContact O-N 3.27Å |
| 475 | V | 58 | Low | 51.7 | Low | 68 Ų | 68 | 126.7 Ų | 126.7 | 41% | 0.412 | 65% | 0.653 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -64.6 | -30 | -179.4 | 161.9 | 0 | 0 | 0 | 0 | 113.4 | I469 W472 | I469-V475 HydrophobicContact CD1-CG1 4.26Å; I469-V475 HydrophobicContact CG1-CG1 4.43Å; W472-V475 HydrophobicContact CB-CG2 3.64Å; W472-V475 HydrophobicContact CE3-CG2 3.88Å; W472-V475 PolarHBondContact O-N 2.88Å |
| 476 | D | 55.4 | Low | 49.9 | Very low | 150 Ų | 150 | 132.8 Ų | 132.8 | 80% | 0.802 | 67% | 0.669 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.1 | 2.5 | -177.1 | -65.3 | -25.9 | 0 | 0 | 0 | 114.2 | Y474 T478 | Y474-D476 VanDerWaalsContact C-N 3.28Å; Y474-D476 PolarHBondContact O-N 3.35Å; D476-T478 PolarHBondContact O-N 3.42Å |
| 477 | E | 46.5 | Very low | 48.3 | Very low | 146 Ų | 146 | 138.9 Ų | 138.9 | 68% | 0.682 | 69% | 0.692 | S | S | * | * | trans | -77.9 | 79.7 | 169.2 | -81 | -171.2 | 173.3 | 0 | 0 | 109.5 | Y474 S479 | Y474-E477 PolarHBondContact O-N 3.27Å; E477-S479 PolarHBondContact O-N 2.94Å | ||
| 478 | T | 44 | Very low | 46.7 | Very low | 108 Ų | 108 | 132.3 Ų | 132.3 | 66% | 0.663 | 68% | 0.682 | S | S | * | * | trans | -62.9 | 122.5 | 167.8 | 46.9 | 0 | 0 | 0 | 0 | 109.2 | D476 S480 | D476-T478 PolarHBondContact O-N 3.42Å; T478-S480 PolarHBondContact O-N 3.05Å; T478-S480 PolarHBondContact O-OG 3.23Å; T478-S480 PolarHBondContact OG1-OG 3.26Å | ||
| 479 | S | 48.3 | Very low | 45.2 | Very low | 104 Ų | 104 | 132.3 Ų | 132.3 | 73% | 0.727 | 69% | 0.69 | S | S | * | * | S | Bend | trans | -60.3 | 17 | 178.1 | -30.1 | 0 | 0 | 0 | 0 | 115 | E477 A481 V482 | E477-S479 PolarHBondContact O-N 2.94Å; S479-A481 PolarHBondContact O-N 2.74Å; S479-V482 PolarHBondContact O-N 3.36Å |
| 480 | S | 44.6 | Very low | 43.5 | Very low | 82 Ų | 82 | 137 Ų | 137 | 57% | 0.573 | 72% | 0.715 | S | S | * | * | G | 310 helix | trans | -65.7 | 0.1 | 175 | 26.8 | 0 | 0 | 0 | 0 | 114.4 | T478 V482 | T478-S480 PolarHBondContact O-N 3.05Å; T478-S480 PolarHBondContact O-OG 3.23Å; T478-S480 PolarHBondContact OG1-OG 3.26Å; S480-V482 PolarHBondContact O-N 3.18Å |
| 481 | A | 40 | Very low | 42 | Very low | 87 Ų | 87 | 138.2 Ų | 138.2 | 72% | 0.719 | 72% | 0.723 | S | S | * | * | G | 310 helix | trans | -70.9 | -7.6 | 165.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | S479 | S479-A481 PolarHBondContact O-N 2.74Š|
| 482 | V | 37.5 | Very low | 40.3 | Very low | 135 Ų | 135 | 137.5 Ų | 137.5 | 82% | 0.818 | 73% | 0.728 | S | S | * | * | G | 310 helix | trans | -101.3 | 42.2 | 176.7 | -170.5 | 0 | 0 | 0 | 0 | 112 | S479 S480 | S479-V482 PolarHBondContact O-N 3.36Å; S480-V482 PolarHBondContact O-N 3.18Å |
| 483 | S | 33.4 | Very low | 38.9 | Very low | 102 Ų | 102 | 133.8 Ų | 133.8 | 71% | 0.713 | 73% | 0.73 | S | S | * | * | trans | -146.3 | 58.8 | 159.8 | 71.9 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 484 | T | 30.7 | Very low | 37.7 | Very low | 115 Ų | 115 | 130.8 Ų | 130.8 | 71% | 0.706 | 73% | 0.73 | S | S | * | * | trans | -116.1 | 72.7 | 167.2 | -47.2 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 485 | Y | 30.4 | Very low | 36.2 | Very low | 230 Ų | 230 | 128.6 Ų | 128.6 | 90% | 0.902 | 74% | 0.736 | S | S | * | * | trans | -160.7 | 82.6 | 156.9 | -90.5 | -68.5 | 0 | 0 | 0 | 110.6 | ||||
| 486 | R | 28.9 | Very low | 34.9 | Very low | 243 Ų | 243 | 131.8 Ų | 131.8 | 92% | 0.917 | 76% | 0.757 | S | S | * | * | trans | -176.2 | 106.3 | 139.8 | -102.2 | 170.2 | -175.2 | 166.4 | 2.8 | 109.8 | ||||
| 487 | H | 30.7 | Very low | 33.5 | Very low | 182 Ų | 182 | 132 Ų | 132 | 84% | 0.843 | 76% | 0.757 | S | S | * | * | trans | 5.2 | 139.1 | 139.3 | -79.3 | -105 | 0 | 0 | 0 | 116.5 | ||||
| 488 | S | 28.7 | Very low | 32.6 | Very low | 97 Ų | 97 | 129.7 Ų | 129.7 | 68% | 0.678 | 76% | 0.757 | S | S | * | * | cis | -176 | 137.2 | 23.3 | 39.7 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 489 | S | 30 | Very low | 32 | Very low | 101 Ų | 101 | 136.2 Ų | 136.2 | 71% | 0.706 | 77% | 0.77 | S | S | * | * | trans | 41.4 | 116 | 139.7 | 63.6 | 0 | 0 | 0 | 0 | 121 | ||||
| 490 | L | 29.8 | Very low | 30.9 | Very low | 165 Ų | 165 | 142.4 Ų | 142.4 | 86% | 0.864 | 78% | 0.778 | S | S | * | * | -169.5 | 133.3 | 103.5 | -98.3 | 160.1 | 0 | 0 | 0 | 111.6 | |||||
| 491 | M | 31.7 | Very low | 30.4 | Very low | 170 Ų | 170 | 144.9 Ų | 144.9 | 84% | 0.837 | 79% | 0.791 | S | S | * | * | trans | 97.9 | 84.5 | 165.5 | -50.3 | -132 | 88.4 | 0 | 0 | 118.8 | ||||
| 492 | S | 27.9 | Very low | 29.8 | Very low | 101 Ų | 101 | 145.2 Ų | 145.2 | 71% | 0.706 | 79% | 0.788 | S | S | * | * | trans | -37 | 158.1 | 134.9 | 53.1 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 493 | S | 27.4 | Very low | 29.3 | Very low | 103 Ų | 103 | 144.8 Ų | 144.8 | 72% | 0.72 | 79% | 0.787 | S | S | * | * | cis | 180 | 140.6 | 15 | 35.1 | 0 | 0 | 0 | 0 | 103.8 | ||||
| 494 | S | 30.2 | Very low | 29.5 | Very low | 108 Ų | 108 | 147.7 Ų | 147.7 | 76% | 0.755 | 79% | 0.793 | S | S | * | * | 168.7 | 129.5 | 87.4 | 44.2 | 0 | 0 | 0 | 0 | 110.7 | |||||
| 495 | S | 27.1 | Very low | 29.3 | Very low | 103 Ų | 103 | 152.7 Ų | 152.7 | 72% | 0.72 | 80% | 0.799 | S | S | * | * | trans | 25.7 | 128.8 | 145 | 60.8 | 0 | 0 | 0 | 0 | 122.4 | ||||
| 496 | T | 30.4 | Very low | 29.7 | Very low | 136 Ų | 136 | 151.9 Ų | 151.9 | 83% | 0.834 | 80% | 0.801 | S | S | * | * | 178.5 | 119 | 102.7 | 31.9 | 0 | 0 | 0 | 0 | 114.4 | |||||
| 497 | N | 25.6 | Very low | 29.7 | Very low | 153 Ų | 153 | 146.7 Ų | 146.7 | 82% | 0.818 | 79% | 0.787 | S | S | * | * | trans | 28.7 | 125.7 | 139.1 | -90.3 | -11.6 | 0 | 0 | 0 | 125.3 | ||||
| 498 | S | 27.5 | Very low | 29.7 | Very low | 98 Ų | 98 | 144.8 Ų | 144.8 | 69% | 0.685 | 78% | 0.776 | S | S | * | * | 71.1 | 117.8 | 124 | 78.5 | 0 | 0 | 0 | 0 | 121.8 | |||||
| 499 | R | 31.2 | Very low | 29.8 | Very low | 245 Ų | 245 | 146.7 Ų | 146.7 | 93% | 0.925 | 77% | 0.774 | S | S | * | * | 174.6 | 136.8 | 109.6 | -99 | 176.1 | 168.6 | 175.9 | -3.4 | 112.6 | |||||
| 500 | R | 26.2 | Very low | 30.2 | Very low | 235 Ų | 235 | 150.2 Ų | 150.2 | 89% | 0.887 | 78% | 0.783 | S | S | * | * | trans | -65.7 | 164.9 | 165.6 | -67.9 | 177.6 | 169.2 | -179.2 | -3.6 | 111.6 | ||||
| 501 | P | 33.6 | Very low | 30.4 | Very low | 133 Ų | 133 | 148.4 Ų | 148.4 | 86% | 0.864 | 77% | 0.774 | S | S | * | * | -144 | 174.2 | 98.7 | 36.3 | -18.9 | 0 | 0 | 0 | 115.4 | |||||
| 502 | S | 26.8 | Very low | 30.5 | Very low | 94 Ų | 94 | 147.2 Ų | 147.2 | 66% | 0.657 | 77% | 0.771 | S | S | * | * | trans | -117.5 | 167.3 | -160.5 | 49.8 | 0 | 0 | 0 | 0 | 113.3 | ||||
| 503 | T | 27.8 | Very low | 30.6 | Very low | 127 Ų | 127 | 148.2 Ų | 148.2 | 78% | 0.779 | 77% | 0.773 | S | S | * | * | trans | 80.1 | 130.1 | 152.1 | 54.9 | 0 | 0 | 0 | 0 | 122 | ||||
| 504 | L | 37.7 | Very low | 30.9 | Very low | 163 Ų | 163 | 146.9 Ų | 146.9 | 85% | 0.853 | 78% | 0.775 | S | S | * | * | trans | 145.1 | 92.9 | 135.6 | -75.2 | 173.1 | 0 | 0 | 0 | 109.5 | ||||
| 505 | R | 26.5 | Very low | 31.2 | Very low | 219 Ų | 219 | 155 Ų | 155 | 83% | 0.826 | 80% | 0.801 | S | S | * | * | 53.6 | 92 | 74.5 | -157.5 | -171.2 | -110.5 | -158.9 | -0.7 | 114.7 | |||||
| 506 | F | 37.4 | Very low | 31.4 | Very low | 213 Ų | 213 | 157.6 Ų | 157.6 | 93% | 0.934 | 81% | 0.805 | S | S | * | * | trans | -146.1 | 93.2 | 150.9 | -102 | -82.8 | 0 | 0 | 0 | 109.6 | ||||
| 507 | E | 29.6 | Very low | 31.5 | Very low | 135 Ų | 135 | 158.7 Ų | 158.7 | 63% | 0.631 | 80% | 0.803 | S | S | * | * | trans | -51.8 | 162.6 | 143.8 | -97.3 | -174.3 | 137.1 | 0 | 0 | 109.5 | ||||
| 508 | K | 30.7 | Very low | 31.8 | Very low | 141 Ų | 141 | 159 Ų | 159 | 61% | 0.613 | 80% | 0.803 | S | S | * | * | cis | -175 | 167.5 | 6.9 | -131.7 | 170.9 | 175.4 | 150.3 | 0 | 106.4 | ||||
| 509 | E | 31.1 | Very low | 32 | Very low | 137 Ų | 137 | 162.6 Ų | 162.6 | 64% | 0.64 | 81% | 0.81 | S | S | * | * | trans | 61.2 | 87.9 | 146.2 | -75.7 | 159.3 | -168.8 | 0 | 0 | 118.6 | ||||
| 510 | I | 39 | Very low | 32.1 | Very low | 176 Ų | 176 | 157.4 Ų | 157.4 | 90% | 0.903 | 80% | 0.802 | S | S | * | * | trans | -124.1 | 96.2 | 133.1 | -61.5 | 179.8 | 0 | 0 | 0 | 106.6 | ||||
| 511 | L | 32.6 | Very low | 32.5 | Very low | 126 Ų | 126 | 152.3 Ų | 152.3 | 66% | 0.66 | 80% | 0.797 | S | S | * | * | trans | -61.4 | 140.4 | 154.5 | -85.7 | 129.2 | 0 | 0 | 0 | 109.4 | ||||
| 512 | D | 35 | Very low | 32.4 | Very low | 146 Ų | 146 | 153.6 Ų | 153.6 | 78% | 0.781 | 79% | 0.792 | S | S | * | * | trans | -179.7 | 100.6 | 134.2 | -93.3 | -10.1 | 0 | 0 | 0 | 106.6 | ||||
| 513 | T | 30.3 | Very low | 32.8 | Very low | 122 Ų | 122 | 158.2 Ų | 158.2 | 75% | 0.748 | 80% | 0.802 | S | S | * | * | 52.8 | 115.6 | 87.3 | 63.9 | 0 | 0 | 0 | 0 | 114.1 | |||||
| 514 | G | 33.3 | Very low | 33.3 | Very low | 74 Ų | 74 | 160.8 Ų | 160.8 | 76% | 0.763 | 80% | 0.804 | S | S | * | * | trans | 170.7 | 78.8 | 166.1 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 515 | Q | 36 | Very low | 32.8 | Very low | 278 Ų | 278 | 160.6 Ų | 160.6 | 100% | 1.299 | 80% | 0.8 | S | S | * | * | trans | 77.3 | 0 | 163.8 | -65.5 | -169.9 | -17.1 | 0 | 0 | 119.4 |
Retrieved 515 of 515 residues in 952 ms
(Link to these results)