| 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 | 74.4 | Confident | 89.6 | Confident | 194 Ų | 194 | 110.8 Ų | 110.8 | 96% | 0.956 | 59% | 0.593 | S | S | * | * | 0 | -51.3 | 0 | -160.5 | 171.4 | -81.8 | 0 | 0 | 112.1 | L3 L4 L5 | M1-L3 PolarHBondContact O-N 2.74Å; M1-L4 PolarHBondContact O-N 2.86Å; M1-L5 PolarHBondContact O-N 3.04Å | |||
| 2 | S | 87.2 | Confident | 89.9 | Confident | 94 Ų | 94 | 114.8 Ų | 114.8 | 66% | 0.657 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -57.2 | -42.8 | -179.7 | 172.5 | 0 | 0 | 0 | 0 | 115.1 | L4 L5 Q6 | S2-L4 VanDerWaalsContact C-N 3.35Å; S2-L4 PolarHBondContact O-N 3.07Å; S2-L5 PolarHBondContact O-N 3.47Å; S2-Q6 PolarHBondContact O-N 3.03Å; S2-Q6 VanDerWaalsContact O-N 3.12Å |
| 3 | L | 89.3 | Confident | 90.2 | Very high | 136 Ų | 136 | 110.2 Ų | 110.2 | 71% | 0.712 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -62 | -39.7 | 177.2 | -72.2 | 172.3 | 0 | 0 | 0 | 112.9 | M1 L5 Q6 E7 | M1-L3 PolarHBondContact O-N 2.74Å; L3-L5 VanDerWaalsContact C-N 3.35Å; L3-L5 PolarHBondContact O-N 2.73Å; L3-Q6 PolarHBondContact O-N 3.3Å; L3-E7 PolarHBondContact O-N 3.24Å |
| 4 | L | 90.1 | Very high | 90.5 | Very high | 119 Ų | 119 | 108.2 Ų | 108.2 | 62% | 0.623 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -64.7 | -38.9 | 177.6 | -68.5 | 172.2 | 0 | 0 | 0 | 111.8 | M1 S2 Q6 E7 E8 | M1-L4 PolarHBondContact O-N 2.86Å; S2-L4 VanDerWaalsContact C-N 3.35Å; S2-L4 PolarHBondContact O-N 3.07Å; L4-Q6 VanDerWaalsContact C-N 3.33Å; L4-E7 PolarHBondContact O-N 2.92Å; L4-E8 WeakPolarHBondContact O-CB 3.35Å; L4-E8 PolarHBondContact O-N 2.85Å |
| 5 | L | 91 | Very high | 90.9 | Very high | 106 Ų | 106 | 106.9 Ų | 106.9 | 56% | 0.555 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -66.3 | -35.8 | 176 | -69.3 | 172.8 | 0 | 0 | 0 | 112.3 | M1 S2 L3 S9 | M1-L5 PolarHBondContact O-N 3.04Å; S2-L5 PolarHBondContact O-N 3.47Å; L3-L5 VanDerWaalsContact C-N 3.35Å; L3-L5 PolarHBondContact O-N 2.73Å; L5-S9 WeakPolarHBondContact O-CB 3.47Å; L5-S9 PolarHBondContact O-N 2.91Å |
| 6 | Q | 91.5 | Very high | 91.2 | Very high | 110 Ų | 110 | 106.6 Ų | 106.6 | 51% | 0.514 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -70.6 | -40.8 | 176.1 | -176.5 | 177.6 | 3.8 | 0 | 0 | 111.9 | S2 L3 L4 E8 S9 L10 | S2-Q6 PolarHBondContact O-N 3.03Å; S2-Q6 VanDerWaalsContact O-N 3.12Å; L3-Q6 PolarHBondContact O-N 3.3Å; L4-Q6 VanDerWaalsContact C-N 3.33Å; Q6-E8 VanDerWaalsContact C-N 3.34Å; Q6-S9 PolarHBondContact O-N 3.5Å; Q6-S9 PolarHBondContact O-OG 2.85Å; Q6-L10 HydrophobicContact CG-CD1 4.42Å; Q6-L10 WeakPolarHBondContact O-CG 3.34Å; Q6-L10 PolarHBondContact O-N 3.33Å |
| 7 | E | 91.4 | Very high | 91.5 | Very high | 133 Ų | 133 | 105.4 Ų | 105.4 | 62% | 0.621 | 56% | 0.561 | S | S | * | * | H | α-helix | trans | -63.7 | -42.3 | 174.8 | -175 | 174.7 | -170.1 | 0 | 0 | 111.1 | L3 L4 S9 L10 S11 | L3-E7 PolarHBondContact O-N 3.24Å; L4-E7 PolarHBondContact O-N 2.92Å; E7-S9 PolarHBondContact O-N 2.99Å; E7-L10 PolarHBondContact O-N 3.18Å; E7-S11 VanDerWaalsContact O-CB 3.28Å; E7-S11 WeakPolarHBondContact O-CB 3.42Å; E7-S11 PolarHBondContact O-N 2.97Å |
| 8 | E | 92 | Very high | 91.8 | Very high | 88 Ų | 88 | 105.1 Ų | 105.1 | 41% | 0.411 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -62.6 | -40.5 | 175.4 | -169.3 | -175.6 | 167.6 | 0 | 0 | 112 | L4 Q6 S11 R12 | L4-E8 WeakPolarHBondContact O-CB 3.35Å; L4-E8 PolarHBondContact O-N 2.85Å; Q6-E8 VanDerWaalsContact C-N 3.34Å; E8-S11 PolarHBondContact O-N 3.46Å; E8-R12 WeakPolarHBondContact O-CB 3.34Å; E8-R12 VanDerWaalsContact O-CG 3.26Å; E8-R12 WeakPolarHBondContact O-CG 3.45Å; E8-R12 PolarHBondContact O-N 2.81Å; E8-R12 IonicContact OE1-CZ 3.51Å; E8-R12 VanDerWaalsContact OE1-CZ 3.28Å; E8-R12 IonicContact OE1-NE 3.28Å; E8-R12 PolarHBondContact OE1-NE 3.47Å; E8-R12 IonicContact OE1-NH2 2.99Å; E8-R12 PolarHBondContact OE1-NH2 3Å |
| 9 | S | 92.3 | Very high | 92.1 | Very high | 64 Ų | 64 | 106.4 Ų | 106.4 | 45% | 0.448 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -68.4 | -41.6 | 179.3 | 71.8 | 0 | 0 | 0 | 0 | 112.6 | L5 Q6 E7 R12 A13 | L5-S9 WeakPolarHBondContact O-CB 3.47Å; L5-S9 PolarHBondContact O-N 2.91Å; Q6-S9 PolarHBondContact O-N 3.5Å; Q6-S9 PolarHBondContact O-OG 2.85Å; E7-S9 PolarHBondContact O-N 2.99Å; S9-R12 PolarHBondContact O-N 2.89Å; S9-A13 WeakPolarHBondContact O-CB 3.38Å; S9-A13 PolarHBondContact O-N 3.37Å |
| 10 | L | 93.6 | Very high | 92.3 | Very high | 113 Ų | 113 | 109.3 Ų | 109.3 | 59% | 0.592 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -64.5 | -42.3 | 174.5 | -73.5 | 172.6 | 0 | 0 | 0 | 111.6 | Q6 E7 A13 S14 | Q6-L10 HydrophobicContact CG-CD1 4.42Å; Q6-L10 WeakPolarHBondContact O-CG 3.34Å; Q6-L10 PolarHBondContact O-N 3.33Å; E7-L10 PolarHBondContact O-N 3.18Å; L10-A13 PolarHBondContact O-N 3.28Å; L10-S14 WeakPolarHBondContact O-CB 3.45Å; L10-S14 PolarHBondContact O-N 2.88Å |
| 11 | S | 93.2 | Very high | 92.5 | Very high | 62 Ų | 62 | 110.2 Ų | 110.2 | 43% | 0.434 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -61.2 | -46.7 | 175.1 | -177.8 | 0 | 0 | 0 | 0 | 111.4 | E7 E8 A13 S14 I15 | E7-S11 VanDerWaalsContact O-CB 3.28Å; E7-S11 WeakPolarHBondContact O-CB 3.42Å; E7-S11 PolarHBondContact O-N 2.97Å; E8-S11 PolarHBondContact O-N 3.46Å; S11-A13 PolarHBondContact O-N 2.99Å; S11-S14 PolarHBondContact O-N 2.99Å; S11-I15 WeakPolarHBondContact O-CD1 3.45Å; S11-I15 VanDerWaalsContact O-CG1 3.25Å; S11-I15 WeakPolarHBondContact O-CG1 3.38Å; S11-I15 PolarHBondContact O-N 3.41Å |
| 12 | R | 93.2 | Very high | 93.6 | Very high | 158 Ų | 158 | 107.2 Ų | 107.2 | 60% | 0.596 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -59.2 | -44.3 | 175.1 | -75.8 | 173.4 | -177.8 | -90.7 | 1.9 | 112.3 | E8 S9 I15 E16 | E8-R12 WeakPolarHBondContact O-CB 3.34Å; E8-R12 VanDerWaalsContact O-CG 3.26Å; E8-R12 WeakPolarHBondContact O-CG 3.45Å; E8-R12 PolarHBondContact O-N 2.81Å; E8-R12 IonicContact OE1-CZ 3.51Å; E8-R12 VanDerWaalsContact OE1-CZ 3.28Å; E8-R12 IonicContact OE1-NE 3.28Å; E8-R12 PolarHBondContact OE1-NE 3.47Å; E8-R12 IonicContact OE1-NH2 2.99Å; E8-R12 PolarHBondContact OE1-NH2 3Å; S9-R12 PolarHBondContact O-N 2.89Å; R12-I15 PolarHBondContact O-N 3.48Å; R12-E16 WeakPolarHBondContact O-CB 3.32Å; R12-E16 PolarHBondContact O-N 2.96Å |
| 13 | A | 94 | Very high | 94.1 | Very high | 56 Ų | 56 | 106.5 Ų | 106.5 | 46% | 0.463 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.7 | -42 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | S9 L10 S11 E16 D17 | S9-A13 WeakPolarHBondContact O-CB 3.38Å; S9-A13 PolarHBondContact O-N 3.37Å; L10-A13 PolarHBondContact O-N 3.28Å; S11-A13 PolarHBondContact O-N 2.99Å; A13-E16 PolarHBondContact O-N 3.33Å; A13-D17 PolarHBondContact O-N 2.97Å |
| 14 | S | 94.6 | Very high | 94.5 | Very high | 82 Ų | 82 | 103.3 Ų | 103.3 | 57% | 0.573 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -63.8 | -41 | 175.6 | -172.5 | 0 | 0 | 0 | 0 | 112.1 | L10 S11 E16 D17 E18 | L10-S14 WeakPolarHBondContact O-CB 3.45Å; L10-S14 PolarHBondContact O-N 2.88Å; S11-S14 PolarHBondContact O-N 2.99Å; S14-E16 VanDerWaalsContact C-N 3.34Å; S14-D17 PolarHBondContact O-N 3.45Å; S14-E18 PolarHBondContact O-N 2.96Å |
| 15 | I | 95.4 | Very high | 94.8 | Very high | 88 Ų | 88 | 102 Ų | 102 | 45% | 0.451 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -65.9 | -38.9 | 176.4 | -68.3 | 163.6 | 0 | 0 | 0 | 110.7 | S11 R12 K19 | S11-I15 WeakPolarHBondContact O-CD1 3.45Å; S11-I15 VanDerWaalsContact O-CG1 3.25Å; S11-I15 WeakPolarHBondContact O-CG1 3.38Å; S11-I15 PolarHBondContact O-N 3.41Å; R12-I15 PolarHBondContact O-N 3.48Å; I15-K19 WeakPolarHBondContact O-CG 3.33Å; I15-K19 PolarHBondContact O-N 3.28Å |
| 16 | E | 96.5 | Very high | 95.2 | Very high | 102 Ų | 102 | 102.9 Ų | 102.9 | 48% | 0.477 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -68.5 | -40.9 | 177.6 | -167.6 | -178.1 | 167.5 | 0 | 0 | 112.1 | R12 A13 S14 E18 K19 R20 | R12-E16 WeakPolarHBondContact O-CB 3.32Å; R12-E16 PolarHBondContact O-N 2.96Å; A13-E16 PolarHBondContact O-N 3.33Å; S14-E16 VanDerWaalsContact C-N 3.34Å; E16-E18 VanDerWaalsContact C-N 3.34Å; E16-K19 PolarHBondContact O-N 3.49Å; E16-R20 WeakPolarHBondContact O-CG 3.43Å; E16-R20 PolarHBondContact O-N 2.91Å; E16-R20 IonicContact OE1-CZ 3.06Å; E16-R20 IonicContact OE1-NE 2.75Å; E16-R20 IonicContact OE1-NH2 3.51Å; E16-R20 PolarHBondContact OE1-NH2 3.47Å |
| 17 | D | 96.4 | Very high | 95.5 | Very high | 86 Ų | 86 | 103.8 Ų | 103.8 | 46% | 0.46 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.8 | -43.1 | 175 | -168.3 | 64.2 | 0 | 0 | 0 | 111.4 | A13 S14 K19 R20 R21 | A13-D17 PolarHBondContact O-N 2.97Å; S14-D17 PolarHBondContact O-N 3.45Å; D17-K19 PolarHBondContact O-N 2.97Å; D17-R20 PolarHBondContact O-N 3.23Å; D17-R21 PolarHBondContact O-N 3Å; D17-R21 IonicContact OD2-NH2 2.7Å; D17-R21 PolarHBondContact OD2-NH2 2.91Å |
| 18 | E | 96.4 | Very high | 95.8 | Very high | 101 Ų | 101 | 102.5 Ų | 102.5 | 47% | 0.472 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.9 | -42.6 | 176.7 | -170.5 | 59.6 | -157.6 | 0 | 0 | 111.7 | S14 E16 R20 R21 E22 | S14-E18 PolarHBondContact O-N 2.96Å; E16-E18 VanDerWaalsContact C-N 3.34Å; E18-R20 VanDerWaalsContact C-N 3.32Å; E18-R20 PolarHBondContact O-N 3.36Å; E18-R21 WeakPolarHBondContact O-CB 3.35Å; E18-R21 PolarHBondContact O-N 3.44Å; E18-R21 IonicContact OE2-NH1 3.69Å; E18-E22 WeakPolarHBondContact O-CB 3.46Å; E18-E22 PolarHBondContact O-N 3.45Å |
| 19 | K | 96.7 | Very high | 96.1 | Very high | 130 Ų | 130 | 103 Ų | 103 | 57% | 0.565 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -61.2 | -40 | 174 | -76.5 | 179.7 | 179.7 | -177.1 | 0 | 112.5 | I15 E16 D17 R21 V23 | I15-K19 WeakPolarHBondContact O-CG 3.33Å; I15-K19 PolarHBondContact O-N 3.28Å; E16-K19 PolarHBondContact O-N 3.49Å; D17-K19 PolarHBondContact O-N 2.97Å; K19-R21 VanDerWaalsContact C-N 3.33Å; K19-V23 WeakPolarHBondContact O-CB 3.12Å; K19-V23 VanDerWaalsContact O-CG2 3.23Å; K19-V23 WeakPolarHBondContact O-CG2 3.47Å; K19-V23 PolarHBondContact O-N 3.16Å |
| 20 | R | 96.7 | Very high | 96.4 | Very high | 164 Ų | 164 | 102 Ų | 102 | 62% | 0.619 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -65.7 | -39.4 | 176.2 | -72.6 | 178.4 | -172.8 | -165.1 | 4.6 | 111.1 | E16 D17 E18 S24 | E16-R20 WeakPolarHBondContact O-CG 3.43Å; E16-R20 PolarHBondContact O-N 2.91Å; E16-R20 IonicContact OE1-CZ 3.06Å; E16-R20 IonicContact OE1-NE 2.75Å; E16-R20 IonicContact OE1-NH2 3.51Å; E16-R20 PolarHBondContact OE1-NH2 3.47Å; D17-R20 PolarHBondContact O-N 3.23Å; E18-R20 VanDerWaalsContact C-N 3.32Å; E18-R20 PolarHBondContact O-N 3.36Å; R20-S24 WeakPolarHBondContact O-CB 3.48Å; R20-S24 PolarHBondContact O-N 3.47Å |
| 21 | R | 96.8 | Very high | 96.6 | Very high | 128 Ų | 128 | 100.5 Ų | 100.5 | 48% | 0.483 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.3 | -49.9 | 175.6 | -169.2 | 178.5 | -59.6 | 165.1 | 8.9 | 111.4 | D17 E18 K19 V23 S24 D25 | D17-R21 PolarHBondContact O-N 3Å; D17-R21 IonicContact OD2-NH2 2.7Å; D17-R21 PolarHBondContact OD2-NH2 2.91Å; E18-R21 WeakPolarHBondContact O-CB 3.35Å; E18-R21 PolarHBondContact O-N 3.44Å; E18-R21 IonicContact OE2-NH1 3.69Å; K19-R21 VanDerWaalsContact C-N 3.33Å; R21-V23 VanDerWaalsContact C-N 3.33Å; R21-V23 PolarHBondContact O-N 2.94Å; R21-S24 WeakPolarHBondContact O-CB 3.48Å; R21-S24 PolarHBondContact O-N 2.92Å; R21-S24 VanDerWaalsContact O-N 3.1Å; R21-D25 WeakPolarHBondContact O-CB 3.34Å; R21-D25 VanDerWaalsContact O-CG 3.31Å; R21-D25 PolarHBondContact O-N 3.46Å |
| 22 | E | 97.5 | Very high | 96.8 | Very high | 132 Ų | 132 | 100 Ų | 100 | 62% | 0.617 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -57.1 | -45.8 | 177.3 | -175.2 | -177.3 | -173.5 | 0 | 0 | 111.8 | E18 S24 D25 H26 | E18-E22 WeakPolarHBondContact O-CB 3.46Å; E18-E22 PolarHBondContact O-N 3.45Å; E22-S24 PolarHBondContact O-N 3.17Å; E22-D25 PolarHBondContact O-N 3.27Å; E22-H26 WeakPolarHBondContact O-CB 3.37Å; E22-H26 PolarHBondContact O-N 2.97Å |
| 23 | V | 97.4 | Very high | 97.1 | Very high | 79 Ų | 79 | 95.2 Ų | 95.2 | 48% | 0.479 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -62.9 | -42.9 | 176.4 | 170 | 0 | 0 | 0 | 0 | 111.3 | K19 R21 H26 F27 | K19-V23 WeakPolarHBondContact O-CB 3.12Å; K19-V23 VanDerWaalsContact O-CG2 3.23Å; K19-V23 WeakPolarHBondContact O-CG2 3.47Å; K19-V23 PolarHBondContact O-N 3.16Å; R21-V23 VanDerWaalsContact C-N 3.33Å; R21-V23 PolarHBondContact O-N 2.94Å; V23-H26 PolarHBondContact O-N 3.29Å; V23-F27 HydrophobicContact CG1-CD2 3.62Å; V23-F27 HydrophobicContact CG1-CE2 3.36Å; V23-F27 WeakPolarHBondContact O-CD2 3.33Å; V23-F27 PolarHBondContact O-N 2.93Å |
| 24 | S | 97.5 | Very high | 97.3 | Very high | 69 Ų | 69 | 98 Ų | 98 | 48% | 0.483 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.9 | -44.5 | 176.7 | -172.6 | 0 | 0 | 0 | 0 | 111.9 | R20 R21 E22 H26 F27 Q28 | R20-S24 WeakPolarHBondContact O-CB 3.48Å; R20-S24 PolarHBondContact O-N 3.47Å; R21-S24 WeakPolarHBondContact O-CB 3.48Å; R21-S24 PolarHBondContact O-N 2.92Å; R21-S24 VanDerWaalsContact O-N 3.1Å; E22-S24 PolarHBondContact O-N 3.17Å; S24-H26 VanDerWaalsContact C-N 3.33Å; S24-H26 PolarHBondContact O-N 3.02Å; S24-F27 PolarHBondContact O-N 3.33Å; S24-Q28 WeakPolarHBondContact O-CB 3.41Å; S24-Q28 PolarHBondContact O-N 3.32Å |
| 25 | D | 97.9 | Very high | 97.4 | Very high | 90 Ų | 90 | 99.1 Ų | 99.1 | 48% | 0.481 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65.9 | -37.4 | 178.8 | -70.3 | -15.1 | 0 | 0 | 0 | 111.2 | R21 E22 Q28 T29 | R21-D25 WeakPolarHBondContact O-CB 3.34Å; R21-D25 VanDerWaalsContact O-CG 3.31Å; R21-D25 PolarHBondContact O-N 3.46Å; E22-D25 PolarHBondContact O-N 3.27Å; D25-Q28 PolarHBondContact O-N 2.96Å; D25-T29 WeakPolarHBondContact O-CB 3.47Å; D25-T29 PolarHBondContact O-N 3.38Å; D25-T29 PolarHBondContact O-OG1 3.39Å |
| 26 | H | 97.5 | Very high | 97.6 | Very high | 126 Ų | 126 | 99.3 Ų | 99.3 | 58% | 0.583 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -63.2 | -46.8 | 172.6 | 179.3 | -81.5 | 0 | 0 | 0 | 111.8 | E22 V23 S24 T29 S30 | E22-H26 WeakPolarHBondContact O-CB 3.37Å; E22-H26 PolarHBondContact O-N 2.97Å; V23-H26 PolarHBondContact O-N 3.29Å; S24-H26 VanDerWaalsContact C-N 3.33Å; S24-H26 PolarHBondContact O-N 3.02Å; H26-T29 PolarHBondContact O-N 3.02Å; H26-S30 WeakPolarHBondContact O-CB 3.4Å; H26-S30 PolarHBondContact O-N 2.96Å; H26-S30 PolarHBondContact O-OG 3.07Å |
| 27 | F | 98.1 | Very high | 97.7 | Very high | 128 Ų | 128 | 98.8 Ų | 98.8 | 56% | 0.561 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -62.7 | -42.8 | 175.4 | -79.9 | -60.9 | 0 | 0 | 0 | 111.8 | V23 S24 S30 I31 | V23-F27 HydrophobicContact CG1-CD2 3.62Å; V23-F27 HydrophobicContact CG1-CE2 3.36Å; V23-F27 WeakPolarHBondContact O-CD2 3.33Å; V23-F27 PolarHBondContact O-N 2.93Å; S24-F27 PolarHBondContact O-N 3.33Å; F27-S30 PolarHBondContact O-N 3.43Å; F27-I31 WeakPolarHBondContact O-CB 3.45Å; F27-I31 VanDerWaalsContact O-CG1 3.27Å; F27-I31 WeakPolarHBondContact O-CG1 3.44Å; F27-I31 PolarHBondContact O-N 3.04Å |
| 28 | Q | 98.2 | Very high | 97.7 | Very high | 106 Ų | 106 | 99.3 Ų | 99.3 | 50% | 0.495 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -63.4 | -43.9 | 179 | -173.6 | 57.8 | 41.2 | 0 | 0 | 111.5 | S24 D25 S30 I31 T32 | S24-Q28 WeakPolarHBondContact O-CB 3.41Å; S24-Q28 PolarHBondContact O-N 3.32Å; D25-Q28 PolarHBondContact O-N 2.96Å; Q28-S30 VanDerWaalsContact C-N 3.34Å; Q28-S30 PolarHBondContact O-N 2.91Å; Q28-I31 PolarHBondContact O-N 3.44Å; Q28-T32 WeakPolarHBondContact O-CB 3.39Å; Q28-T32 PolarHBondContact O-N 3.17Å; Q28-T32 PolarHBondContact O-OG1 3.45Å |
| 29 | T | 98.1 | Very high | 97.8 | Very high | 99 Ų | 99 | 98.1 Ų | 98.1 | 61% | 0.607 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -61.9 | -43.3 | 175.1 | -58.1 | 0 | 0 | 0 | 0 | 111 | D25 H26 T32 S33 | D25-T29 WeakPolarHBondContact O-CB 3.47Å; D25-T29 PolarHBondContact O-N 3.38Å; D25-T29 PolarHBondContact O-OG1 3.39Å; H26-T29 PolarHBondContact O-N 3.02Å; T29-T32 PolarHBondContact O-N 3.41Å; T29-S33 WeakPolarHBondContact O-CB 3.49Å; T29-S33 PolarHBondContact O-N 3.18Å |
| 30 | S | 98.1 | Very high | 97.9 | Very high | 43 Ų | 43 | 98.2 Ų | 98.2 | 30% | 0.301 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.5 | -46.4 | 178.3 | -60.8 | 0 | 0 | 0 | 0 | 112.2 | H26 F27 Q28 T32 S33 I34 | H26-S30 WeakPolarHBondContact O-CB 3.4Å; H26-S30 PolarHBondContact O-N 2.96Å; H26-S30 PolarHBondContact O-OG 3.07Å; F27-S30 PolarHBondContact O-N 3.43Å; Q28-S30 VanDerWaalsContact C-N 3.34Å; Q28-S30 PolarHBondContact O-N 2.91Å; S30-T32 VanDerWaalsContact C-N 3.35Å; S30-T32 PolarHBondContact O-N 3.37Å; S30-S33 PolarHBondContact O-N 3.44Å; S30-I34 WeakPolarHBondContact O-CG1 3.4Å; S30-I34 PolarHBondContact O-N 3.38Å |
| 31 | I | 98.6 | Very high | 98 | Very high | 81 Ų | 81 | 98 Ų | 98 | 42% | 0.415 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.1 | -45.9 | 176.9 | -70.5 | 165.4 | 0 | 0 | 0 | 110.3 | F27 Q28 S33 I34 Q35 | F27-I31 WeakPolarHBondContact O-CB 3.45Å; F27-I31 VanDerWaalsContact O-CG1 3.27Å; F27-I31 WeakPolarHBondContact O-CG1 3.44Å; F27-I31 PolarHBondContact O-N 3.04Å; Q28-I31 PolarHBondContact O-N 3.44Å; I31-S33 VanDerWaalsContact C-N 3.32Å; I31-S33 PolarHBondContact O-N 3.36Å; I31-I34 PolarHBondContact O-N 3.26Å; I31-Q35 HydrophobicContact CG2-CG 4.33Å; I31-Q35 WeakPolarHBondContact O-CB 3.41Å; I31-Q35 VanDerWaalsContact O-CG 3.3Å; I31-Q35 WeakPolarHBondContact O-CG 3.37Å; I31-Q35 PolarHBondContact O-N 3.48Å |
| 32 | T | 98 | Very high | 98 | Very high | 53 Ų | 53 | 97.2 Ų | 97.2 | 33% | 0.325 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.2 | -42.7 | 179.2 | -54.1 | 0 | 0 | 0 | 0 | 111.1 | Q28 T29 S30 Q35 N36 | Q28-T32 WeakPolarHBondContact O-CB 3.39Å; Q28-T32 PolarHBondContact O-N 3.17Å; Q28-T32 PolarHBondContact O-OG1 3.45Å; T29-T32 PolarHBondContact O-N 3.41Å; S30-T32 VanDerWaalsContact C-N 3.35Å; S30-T32 PolarHBondContact O-N 3.37Å; T32-Q35 PolarHBondContact O-N 2.91Å; T32-N36 VanDerWaalsContact O-CG 3.25Å; T32-N36 PolarHBondContact O-N 2.99Å; T32-N36 PolarHBondContact O-ND2 3.26Å |
| 33 | S | 98.2 | Very high | 98 | Very high | 56 Ų | 56 | 95 Ų | 95 | 39% | 0.392 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -61.1 | -46.2 | 175.7 | -179.5 | 0 | 0 | 0 | 0 | 112.4 | T29 S30 I31 Q35 N36 Q37 | T29-S33 WeakPolarHBondContact O-CB 3.49Å; T29-S33 PolarHBondContact O-N 3.18Å; S30-S33 PolarHBondContact O-N 3.44Å; I31-S33 VanDerWaalsContact C-N 3.32Å; I31-S33 PolarHBondContact O-N 3.36Å; S33-Q35 VanDerWaalsContact C-N 3.34Å; S33-Q35 PolarHBondContact O-N 3.11Å; S33-N36 PolarHBondContact O-N 3Å; S33-Q37 WeakPolarHBondContact O-CG 3.46Å; S33-Q37 PolarHBondContact O-N 3Å; S33-Q37 PolarHBondContact OG-NE2 2.99Å |
| 34 | I | 98 | Very high | 98.1 | Very high | 114 Ų | 114 | 97.8 Ų | 97.8 | 59% | 0.585 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -63.4 | -40.8 | 177.5 | -67.5 | 166.8 | 0 | 0 | 0 | 111 | S30 I31 Q37 L38 | S30-I34 WeakPolarHBondContact O-CG1 3.4Å; S30-I34 PolarHBondContact O-N 3.38Å; I31-I34 PolarHBondContact O-N 3.26Å; I34-Q37 PolarHBondContact O-N 3.13Å; I34-L38 WeakPolarHBondContact O-CB 3.42Å; I34-L38 PolarHBondContact O-N 2.94Å |
| 35 | Q | 98.3 | Very high | 98.1 | Very high | 107 Ų | 107 | 98 Ų | 98 | 50% | 0.5 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -62.8 | -44.2 | 176.9 | -74.9 | 173.7 | -31.5 | 0 | 0 | 111.9 | I31 T32 S33 L38 C39 | I31-Q35 HydrophobicContact CG2-CG 4.33Å; I31-Q35 WeakPolarHBondContact O-CB 3.41Å; I31-Q35 VanDerWaalsContact O-CG 3.3Å; I31-Q35 WeakPolarHBondContact O-CG 3.37Å; I31-Q35 PolarHBondContact O-N 3.48Å; T32-Q35 PolarHBondContact O-N 2.91Å; S33-Q35 VanDerWaalsContact C-N 3.34Å; S33-Q35 PolarHBondContact O-N 3.11Å; Q35-L38 PolarHBondContact O-N 3.03Å; Q35-C39 PolarHBondContact O-N 2.9Å; Q35-C39 PolarHBondContact O-SG 3.35Å |
| 36 | N | 98.2 | Very high | 98.2 | Very high | 92 Ų | 92 | 98.1 Ų | 98.1 | 49% | 0.492 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.2 | -46.9 | 177 | -70.4 | -14.1 | 0 | 0 | 0 | 111.4 | T32 S33 L38 C39 E40 | T32-N36 VanDerWaalsContact O-CG 3.25Å; T32-N36 PolarHBondContact O-N 2.99Å; T32-N36 PolarHBondContact O-ND2 3.26Å; S33-N36 PolarHBondContact O-N 3Å; N36-L38 VanDerWaalsContact C-N 3.33Å; N36-L38 PolarHBondContact O-N 3.43Å; N36-C39 WeakPolarHBondContact O-CB 3.35Å; N36-C39 PolarHBondContact O-N 3.39Å; N36-E40 WeakPolarHBondContact O-CG 3.46Å; N36-E40 PolarHBondContact O-N 2.99Å |
| 37 | Q | 98.4 | Very high | 98.2 | Very high | 90 Ų | 90 | 96 Ų | 96 | 42% | 0.421 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -60.1 | -43.5 | 176.1 | -71.6 | 178.1 | 46.4 | 0 | 0 | 111.7 | S33 I34 C39 E40 Y41 | S33-Q37 WeakPolarHBondContact O-CG 3.46Å; S33-Q37 PolarHBondContact O-N 3Å; S33-Q37 PolarHBondContact OG-NE2 2.99Å; I34-Q37 PolarHBondContact O-N 3.13Å; Q37-C39 VanDerWaalsContact C-N 3.32Å; Q37-C39 PolarHBondContact O-N 2.98Å; Q37-E40 PolarHBondContact O-N 3.46Å; Q37-Y41 HydrophobicContact CB-CD2 4.4Å; Q37-Y41 HydrophobicContact CB-CE2 4.33Å; Q37-Y41 WeakPolarHBondContact O-CD2 3.41Å; Q37-Y41 PolarHBondContact O-N 2.94Å |
| 38 | L | 98.2 | Very high | 98.2 | Very high | 97 Ų | 97 | 93.3 Ų | 93.3 | 51% | 0.508 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -60.2 | -43.3 | 177.7 | -178.2 | 61.4 | 0 | 0 | 0 | 111.6 | I34 Q35 N36 Y41 Q42 | I34-L38 WeakPolarHBondContact O-CB 3.42Å; I34-L38 PolarHBondContact O-N 2.94Å; Q35-L38 PolarHBondContact O-N 3.03Å; N36-L38 VanDerWaalsContact C-N 3.33Å; N36-L38 PolarHBondContact O-N 3.43Å; L38-Y41 PolarHBondContact O-N 3.15Å; L38-Q42 HydrophobicContact CD1-CG 4.48Å; L38-Q42 WeakPolarHBondContact O-CB 3.43Å; L38-Q42 VanDerWaalsContact O-CG 3.25Å; L38-Q42 WeakPolarHBondContact O-CG 3.35Å; L38-Q42 PolarHBondContact O-N 2.98Å |
| 39 | C | 97.9 | Very high | 98.2 | Very high | 76 Ų | 76 | 95.3 Ų | 95.3 | 51% | 0.514 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62 | -43.8 | 175.5 | -70 | 0 | 0 | 0 | 0 | 112 | Q35 N36 Q37 Q42 S43 | Q35-C39 PolarHBondContact O-N 2.9Å; Q35-C39 PolarHBondContact O-SG 3.35Å; N36-C39 WeakPolarHBondContact O-CB 3.35Å; N36-C39 PolarHBondContact O-N 3.39Å; Q37-C39 VanDerWaalsContact C-N 3.32Å; Q37-C39 PolarHBondContact O-N 2.98Å; C39-Q42 PolarHBondContact O-N 3.32Å; C39-S43 WeakPolarHBondContact O-CB 3.4Å; C39-S43 PolarHBondContact O-N 2.93Å |
| 40 | E | 98 | Very high | 98.2 | Very high | 133 Ų | 133 | 95.6 Ų | 95.6 | 62% | 0.621 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -61.8 | -46.7 | 176 | -72.9 | 173.8 | -168.8 | 0 | 0 | 111.7 | N36 Q37 Q42 S43 K44 | N36-E40 WeakPolarHBondContact O-CG 3.46Å; N36-E40 PolarHBondContact O-N 2.99Å; Q37-E40 PolarHBondContact O-N 3.46Å; E40-Q42 VanDerWaalsContact C-N 3.33Å; E40-Q42 PolarHBondContact O-N 3.4Å; E40-S43 PolarHBondContact O-N 3.41Å; E40-K44 PolarHBondContact O-N 2.98Å |
| 41 | Y | 98.3 | Very high | 98.2 | Very high | 160 Ų | 160 | 97.7 Ų | 97.7 | 63% | 0.627 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -60.7 | -41.9 | 176.2 | -81 | -62.8 | 0 | 0 | 0 | 112 | Q37 L38 N45 | Q37-Y41 HydrophobicContact CB-CD2 4.4Å; Q37-Y41 HydrophobicContact CB-CE2 4.33Å; Q37-Y41 WeakPolarHBondContact O-CD2 3.41Å; Q37-Y41 PolarHBondContact O-N 2.94Å; L38-Y41 PolarHBondContact O-N 3.15Å; Y41-N45 WeakPolarHBondContact O-CB 3.4Å; Y41-N45 PolarHBondContact O-N 2.86Å |
| 42 | Q | 98.2 | Very high | 98.2 | Very high | 111 Ų | 111 | 98.8 Ų | 98.8 | 52% | 0.519 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -62.2 | -45.7 | 176 | -76.2 | 174.7 | -13.1 | 0 | 0 | 111.3 | L38 C39 E40 N45 V46 | L38-Q42 HydrophobicContact CD1-CG 4.48Å; L38-Q42 WeakPolarHBondContact O-CB 3.43Å; L38-Q42 VanDerWaalsContact O-CG 3.25Å; L38-Q42 WeakPolarHBondContact O-CG 3.35Å; L38-Q42 PolarHBondContact O-N 2.98Å; C39-Q42 PolarHBondContact O-N 3.32Å; E40-Q42 VanDerWaalsContact C-N 3.33Å; E40-Q42 PolarHBondContact O-N 3.4Å; Q42-N45 PolarHBondContact O-N 3.15Å; Q42-V46 WeakPolarHBondContact O-CG2 3.38Å; Q42-V46 PolarHBondContact O-N 2.88Å |
| 43 | S | 97.9 | Very high | 98.2 | Very high | 85 Ų | 85 | 101.4 Ų | 101.4 | 59% | 0.594 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -58.9 | -51.6 | 176.7 | -174 | 0 | 0 | 0 | 0 | 111.7 | C39 E40 N45 V46 E47 | C39-S43 WeakPolarHBondContact O-CB 3.4Å; C39-S43 PolarHBondContact O-N 2.93Å; E40-S43 PolarHBondContact O-N 3.41Å; S43-N45 VanDerWaalsContact C-N 3.27Å; S43-N45 PolarHBondContact O-N 3.36Å; S43-V46 WeakPolarHBondContact O-CB 3.45Å; S43-V46 PolarHBondContact O-N 3.24Å; S43-V46 VanDerWaalsContact O-N 3.09Å; S43-E47 PolarHBondContact O-N 2.85Å; S43-E47 VanDerWaalsContact O-N 3.1Å |
| 44 | K | 98.3 | Very high | 98.2 | Very high | 138 Ų | 138 | 102.5 Ų | 102.5 | 60% | 0.6 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -59 | -39.4 | 176.9 | -176.9 | 172.3 | -177.4 | 171.7 | 0 | 112.2 | E40 V46 E47 L48 | E40-K44 PolarHBondContact O-N 2.98Å; K44-V46 VanDerWaalsContact C-N 3.31Å; K44-V46 PolarHBondContact O-N 2.99Å; K44-E47 PolarHBondContact O-N 3.32Å; K44-L48 HydrophobicContact CG-CD1 4.14Å; K44-L48 HydrophobicContact CG-CG 4.47Å; K44-L48 WeakPolarHBondContact O-CB 3.4Å; K44-L48 WeakPolarHBondContact O-CG 3.24Å; K44-L48 PolarHBondContact O-N 2.92Å |
| 45 | N | 98.5 | Very high | 98.2 | Very high | 72 Ų | 72 | 101.6 Ų | 101.6 | 39% | 0.385 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -71.9 | -25.5 | -179.9 | -171.3 | -121.4 | 0 | 0 | 0 | 112.6 | Y41 Q42 S43 R49 | Y41-N45 WeakPolarHBondContact O-CB 3.4Å; Y41-N45 PolarHBondContact O-N 2.86Å; Q42-N45 PolarHBondContact O-N 3.15Å; S43-N45 VanDerWaalsContact C-N 3.27Å; S43-N45 PolarHBondContact O-N 3.36Å; N45-R49 WeakPolarHBondContact O-CG 3.29Å; N45-R49 PolarHBondContact O-N 2.97Å; N45-R49 PolarHBondContact O-NH1 2.87Å; N45-R49 PolarHBondContact OD1-NH1 2.97Å; N45-R49 PolarHBondContact OD1-NH2 3.4Å |
| 46 | V | 98.3 | Very high | 98.2 | Very high | 94 Ų | 94 | 99 Ų | 99 | 57% | 0.57 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -70.2 | -47.7 | 168.7 | 170.1 | 0 | 0 | 0 | 0 | 110.4 | Q42 S43 K44 L48 R49 K50 | Q42-V46 WeakPolarHBondContact O-CG2 3.38Å; Q42-V46 PolarHBondContact O-N 2.88Å; S43-V46 WeakPolarHBondContact O-CB 3.45Å; S43-V46 PolarHBondContact O-N 3.24Å; S43-V46 VanDerWaalsContact O-N 3.09Å; K44-V46 VanDerWaalsContact C-N 3.31Å; K44-V46 PolarHBondContact O-N 2.99Å; V46-L48 PolarHBondContact O-N 3.47Å; V46-R49 PolarHBondContact O-N 3.31Å; V46-R49 VanDerWaalsContact O-N 3.15Å; V46-K50 PolarHBondContact O-N 3.22Å; V46-K50 VanDerWaalsContact O-N 3.07Å |
| 47 | E | 98.2 | Very high | 98.2 | Very high | 80 Ų | 80 | 99.7 Ų | 99.7 | 37% | 0.374 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -62 | -45.2 | 179.2 | -164.1 | 62.1 | -138.9 | 0 | 0 | 111.5 | S43 K44 R49 K50 E51 | S43-E47 PolarHBondContact O-N 2.85Å; S43-E47 VanDerWaalsContact O-N 3.1Å; K44-E47 PolarHBondContact O-N 3.32Å; E47-R49 VanDerWaalsContact C-N 3.25Å; E47-R49 PolarHBondContact O-N 3.08Å; E47-K50 WeakPolarHBondContact O-CA 3.48Å; E47-K50 WeakPolarHBondContact O-CB 3.49Å; E47-K50 PolarHBondContact O-N 3.43Å; E47-K50 IonicContact OE1-NZ 2.83Å; E47-K50 PolarHBondContact OE1-NZ 3.49Å; E47-K50 IonicContact OE2-NZ 3.95Å; E47-E51 PolarHBondContact O-N 2.95Å |
| 48 | L | 98.4 | Very high | 98.2 | Very high | 73 Ų | 73 | 101.6 Ų | 101.6 | 38% | 0.382 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -59 | -34.3 | 175.8 | -76.3 | 171.9 | 0 | 0 | 0 | 113 | K44 V46 N52 | K44-L48 HydrophobicContact CG-CD1 4.14Å; K44-L48 HydrophobicContact CG-CG 4.47Å; K44-L48 WeakPolarHBondContact O-CB 3.4Å; K44-L48 WeakPolarHBondContact O-CG 3.24Å; K44-L48 PolarHBondContact O-N 2.92Å; V46-L48 PolarHBondContact O-N 3.47Å; L48-N52 WeakPolarHBondContact O-CB 3.49Å; L48-N52 VanDerWaalsContact O-CG 3.27Å; L48-N52 PolarHBondContact O-N 3.31Å; L48-N52 VanDerWaalsContact O-N 3.07Å; L48-N52 PolarHBondContact O-ND2 3.2Å |
| 49 | R | 98.6 | Very high | 98.1 | Very high | 147 Ų | 147 | 102.2 Ų | 102.2 | 56% | 0.555 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -69.9 | -38.1 | 174.8 | -78.8 | -169.2 | -166.9 | 82.5 | 1.7 | 111.6 | N45 V46 E47 Q53 | N45-R49 WeakPolarHBondContact O-CG 3.29Å; N45-R49 PolarHBondContact O-N 2.97Å; N45-R49 PolarHBondContact O-NH1 2.87Å; N45-R49 PolarHBondContact OD1-NH1 2.97Å; N45-R49 PolarHBondContact OD1-NH2 3.4Å; V46-R49 PolarHBondContact O-N 3.31Å; V46-R49 VanDerWaalsContact O-N 3.15Å; E47-R49 VanDerWaalsContact C-N 3.25Å; E47-R49 PolarHBondContact O-N 3.08Å; R49-Q53 WeakPolarHBondContact O-CB 3.38Å; R49-Q53 PolarHBondContact O-N 2.97Å |
| 50 | K | 98.3 | Very high | 98.1 | Very high | 105 Ų | 105 | 100.6 Ų | 100.6 | 46% | 0.457 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -65.6 | -48.4 | 177.1 | 179.6 | 175.6 | 152.6 | -112.3 | 0 | 111.1 | V46 E47 N52 Q53 E54 | V46-K50 PolarHBondContact O-N 3.22Å; V46-K50 VanDerWaalsContact O-N 3.07Å; E47-K50 WeakPolarHBondContact O-CA 3.48Å; E47-K50 WeakPolarHBondContact O-CB 3.49Å; E47-K50 PolarHBondContact O-N 3.43Å; E47-K50 IonicContact OE1-NZ 2.83Å; E47-K50 PolarHBondContact OE1-NZ 3.49Å; E47-K50 IonicContact OE2-NZ 3.95Å; K50-N52 VanDerWaalsContact C-N 3.33Å; K50-N52 PolarHBondContact O-N 3.5Å; K50-Q53 WeakPolarHBondContact O-CB 3.46Å; K50-Q53 PolarHBondContact O-N 3.46Å; K50-Q53 VanDerWaalsContact O-N 3.1Å; K50-E54 VanDerWaalsContact CE-OE1 3.28Å; K50-E54 WeakPolarHBondContact CE-OE1 3.37Å; K50-E54 IonicContact NZ-OE1 3.85Å; K50-E54 WeakPolarHBondContact O-CG 3.4Å; K50-E54 PolarHBondContact O-N 3.22Å |
| 51 | E | 97.9 | Very high | 98.1 | Very high | 88 Ų | 88 | 101 Ų | 101 | 41% | 0.411 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -57.8 | -44.9 | 174.9 | -70.8 | 173.6 | -170.9 | 0 | 0 | 111.9 | E47 Q53 E54 L55 | E47-E51 PolarHBondContact O-N 2.95Å; E51-Q53 VanDerWaalsContact C-N 3.3Å; E51-Q53 PolarHBondContact O-N 3.48Å; E51-E54 PolarHBondContact O-N 3.09Å; E51-L55 WeakPolarHBondContact O-CB 3.49Å; E51-L55 WeakPolarHBondContact O-CD1 3.38Å; E51-L55 WeakPolarHBondContact O-CG 3.24Å; E51-L55 PolarHBondContact O-N 2.9Å |
| 52 | N | 97.9 | Very high | 98 | Very high | 103 Ų | 103 | 98.3 Ų | 98.3 | 55% | 0.551 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -62.5 | -37.3 | 176.3 | -80.6 | -46.9 | 0 | 0 | 0 | 112.6 | L48 K50 A56 | L48-N52 WeakPolarHBondContact O-CB 3.49Å; L48-N52 VanDerWaalsContact O-CG 3.27Å; L48-N52 PolarHBondContact O-N 3.31Å; L48-N52 VanDerWaalsContact O-N 3.07Å; L48-N52 PolarHBondContact O-ND2 3.2Å; K50-N52 VanDerWaalsContact C-N 3.33Å; K50-N52 PolarHBondContact O-N 3.5Å; N52-A56 WeakPolarHBondContact O-CB 3.33Å; N52-A56 PolarHBondContact O-N 3.2Å |
| 53 | Q | 97.9 | Very high | 97.9 | Very high | 108 Ų | 108 | 97.6 Ų | 97.6 | 51% | 0.505 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -65.9 | -45.9 | 175.3 | -179.3 | 60.8 | 33.8 | 0 | 0 | 111.1 | R49 K50 E51 L55 A56 E57 | R49-Q53 WeakPolarHBondContact O-CB 3.38Å; R49-Q53 PolarHBondContact O-N 2.97Å; K50-Q53 WeakPolarHBondContact O-CB 3.46Å; K50-Q53 PolarHBondContact O-N 3.46Å; K50-Q53 VanDerWaalsContact O-N 3.1Å; E51-Q53 VanDerWaalsContact C-N 3.3Å; E51-Q53 PolarHBondContact O-N 3.48Å; Q53-L55 VanDerWaalsContact C-N 3.34Å; Q53-L55 PolarHBondContact O-N 2.86Å; Q53-A56 PolarHBondContact O-N 3.02Å; Q53-E57 PolarHBondContact NE2-OE1 2.92Å; Q53-E57 WeakPolarHBondContact O-CG 3.41Å; Q53-E57 PolarHBondContact O-N 3.11Å |
| 54 | E | 98.1 | Very high | 97.9 | Very high | 80 Ų | 80 | 101 Ų | 101 | 37% | 0.374 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -62.1 | -40.8 | 176.5 | -69.9 | 177.1 | -165.3 | 0 | 0 | 112 | K50 E51 E57 K58 | K50-E54 VanDerWaalsContact CE-OE1 3.28Å; K50-E54 WeakPolarHBondContact CE-OE1 3.37Å; K50-E54 IonicContact NZ-OE1 3.85Å; K50-E54 WeakPolarHBondContact O-CG 3.4Å; K50-E54 PolarHBondContact O-N 3.22Å; E51-E54 PolarHBondContact O-N 3.09Å; E54-E57 PolarHBondContact O-N 2.96Å; E54-K58 WeakPolarHBondContact O-CG 3.49Å; E54-K58 PolarHBondContact O-N 3.44Å |
| 55 | L | 98.4 | Very high | 97.7 | Very high | 95 Ų | 95 | 99.4 Ų | 99.4 | 50% | 0.497 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.9 | -43.4 | 174.8 | -77.6 | 160.9 | 0 | 0 | 0 | 111.6 | E51 Q53 E57 K58 L59 | E51-L55 WeakPolarHBondContact O-CB 3.49Å; E51-L55 WeakPolarHBondContact O-CD1 3.38Å; E51-L55 WeakPolarHBondContact O-CG 3.24Å; E51-L55 PolarHBondContact O-N 2.9Å; Q53-L55 VanDerWaalsContact C-N 3.34Å; Q53-L55 PolarHBondContact O-N 2.86Å; L55-E57 VanDerWaalsContact C-N 3.32Å; L55-E57 PolarHBondContact O-N 2.98Å; L55-K58 PolarHBondContact O-N 3.24Å; L55-L59 WeakPolarHBondContact O-CB 3.28Å; L55-L59 VanDerWaalsContact O-CG 3.32Å; L55-L59 WeakPolarHBondContact O-CG 3.37Å; L55-L59 PolarHBondContact O-N 2.89Å |
| 56 | A | 98 | Very high | 97.6 | Very high | 53 Ų | 53 | 99.2 Ų | 99.2 | 44% | 0.438 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.7 | -39.6 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | N52 Q53 L59 G60 | N52-A56 WeakPolarHBondContact O-CB 3.33Å; N52-A56 PolarHBondContact O-N 3.2Å; Q53-A56 PolarHBondContact O-N 3.02Å; A56-L59 PolarHBondContact O-N 3.49Å; A56-G60 PolarHBondContact O-N 3.45Å |
| 57 | E | 98.3 | Very high | 97.5 | Very high | 106 Ų | 106 | 100.2 Ų | 100.2 | 50% | 0.495 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -64 | -48.7 | 175 | -74.3 | 170.7 | -165 | 0 | 0 | 111.6 | Q53 E54 L55 L59 G60 E61 | Q53-E57 PolarHBondContact NE2-OE1 2.92Å; Q53-E57 WeakPolarHBondContact O-CG 3.41Å; Q53-E57 PolarHBondContact O-N 3.11Å; E54-E57 PolarHBondContact O-N 2.96Å; L55-E57 VanDerWaalsContact C-N 3.32Å; L55-E57 PolarHBondContact O-N 2.98Å; E57-L59 VanDerWaalsContact C-N 3.31Å; E57-L59 PolarHBondContact O-N 3.3Å; E57-G60 WeakPolarHBondContact O-CA 3.27Å; E57-G60 PolarHBondContact O-N 3.38Å; E57-G60 VanDerWaalsContact O-N 3.09Å; E57-E61 PolarHBondContact O-N 3.03Å |
| 58 | K | 97.8 | Very high | 97.4 | Very high | 130 Ų | 130 | 103.8 Ų | 103.8 | 57% | 0.565 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -57.8 | -42.4 | 175.5 | -74 | 173.6 | -176.7 | 173.3 | 0 | 112.1 | E54 L55 E61 F62 | E54-K58 WeakPolarHBondContact O-CG 3.49Å; E54-K58 PolarHBondContact O-N 3.44Å; L55-K58 PolarHBondContact O-N 3.24Å; K58-E61 PolarHBondContact O-N 3.41Å; K58-F62 WeakPolarHBondContact O-CB 3.43Å; K58-F62 PolarHBondContact O-N 2.84Å |
| 59 | L | 97.9 | Very high | 97.2 | Very high | 110 Ų | 110 | 103.6 Ų | 103.6 | 58% | 0.576 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -63.4 | -41.5 | 175.3 | -74.3 | 171.4 | 0 | 0 | 0 | 111.7 | L55 A56 E57 F62 I63 | L55-L59 WeakPolarHBondContact O-CB 3.28Å; L55-L59 VanDerWaalsContact O-CG 3.32Å; L55-L59 WeakPolarHBondContact O-CG 3.37Å; L55-L59 PolarHBondContact O-N 2.89Å; A56-L59 PolarHBondContact O-N 3.49Å; E57-L59 VanDerWaalsContact C-N 3.31Å; E57-L59 PolarHBondContact O-N 3.3Å; L59-F62 PolarHBondContact O-N 2.89Å; L59-I63 VanDerWaalsContact O-CG1 3.3Å; L59-I63 WeakPolarHBondContact O-CG1 3.42Å; L59-I63 PolarHBondContact O-N 2.74Å |
| 60 | G | 97.2 | Very high | 97 | Very high | 41 Ų | 41 | 102.8 Ų | 102.8 | 42% | 0.423 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -61.9 | -44 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | A56 E57 I63 K64 | A56-G60 PolarHBondContact O-N 3.45Å; E57-G60 WeakPolarHBondContact O-CA 3.27Å; E57-G60 PolarHBondContact O-N 3.38Å; E57-G60 VanDerWaalsContact O-N 3.09Å; G60-I63 PolarHBondContact O-N 2.89Å; G60-K64 PolarHBondContact O-N 3.17Å; G60-K64 VanDerWaalsContact O-N 3.13Å |
| 61 | E | 97.3 | Very high | 96.9 | Very high | 141 Ų | 141 | 104.5 Ų | 104.5 | 66% | 0.659 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -63.6 | -42.2 | 175.2 | -71 | -175.1 | 168.6 | 0 | 0 | 112.2 | E57 K58 K64 Q65 | E57-E61 PolarHBondContact O-N 3.03Å; K58-E61 PolarHBondContact O-N 3.41Å; E61-K64 PolarHBondContact O-N 3.4Å; E61-Q65 WeakPolarHBondContact O-CB 3.48Å; E61-Q65 PolarHBondContact O-N 2.82Å |
| 62 | F | 96.3 | Very high | 96.7 | Very high | 105 Ų | 105 | 104.3 Ų | 104.3 | 46% | 0.461 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.8 | -47.7 | 177.6 | -175.8 | -98.9 | 0 | 0 | 0 | 111.5 | K58 L59 K64 Q65 H66 | K58-F62 WeakPolarHBondContact O-CB 3.43Å; K58-F62 PolarHBondContact O-N 2.84Å; L59-F62 PolarHBondContact O-N 2.89Å; F62-K64 VanDerWaalsContact C-N 3.35Å; F62-K64 PolarHBondContact O-N 3.02Å; F62-Q65 WeakPolarHBondContact O-CB 3.35Å; F62-Q65 PolarHBondContact O-N 3.33Å; F62-H66 AromaticContact CD1-CD2 3.61Å; F62-H66 AromaticContact CD2-CD2 3.99Å; F62-H66 AromaticContact CE1-CD2 3.31Å; F62-H66 WeakPolarHBondContact CE1-CD2 3.29Å; F62-H66 AromaticContact CE1-NE2 3.35Å; F62-H66 VanDerWaalsContact CE1-NE2 3.35Å; F62-H66 WeakPolarHBondContact CE1-NE2 3.48Å; F62-H66 AromaticContact CE2-CD2 3.72Å; F62-H66 AromaticContact CE2-NE2 3.35Å; F62-H66 WeakPolarHBondContact CE2-NE2 3.25Å; F62-H66 AromaticContact CG-CD2 3.95Å; F62-H66 AromaticContact CZ-CD2 3.39Å; F62-H66 WeakPolarHBondContact CZ-CD2 3.45Å; F62-H66 AromaticContact CZ-CE1 3.98Å; F62-H66 AromaticContact CZ-NE2 2.94Å; F62-H66 WeakPolarHBondContact CZ-NE2 3.36Å; F62-H66 PolarHBondContact O-CD2 3.42Å; F62-H66 VanDerWaalsContact O-CD2 3.28Å; F62-H66 PolarHBondContact O-N 2.93Å |
| 63 | I | 97.2 | Very high | 96.5 | Very high | 96 Ų | 96 | 103.6 Ų | 103.6 | 49% | 0.492 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -57.3 | -49 | 176.3 | -69.4 | 165.6 | 0 | 0 | 0 | 110.4 | L59 G60 Q65 H66 E67 | L59-I63 VanDerWaalsContact O-CG1 3.3Å; L59-I63 WeakPolarHBondContact O-CG1 3.42Å; L59-I63 PolarHBondContact O-N 2.74Å; G60-I63 PolarHBondContact O-N 2.89Å; I63-Q65 VanDerWaalsContact C-N 3.29Å; I63-Q65 PolarHBondContact O-N 3.06Å; I63-H66 WeakPolarHBondContact O-CA 3.32Å; I63-H66 WeakPolarHBondContact O-CB 3.49Å; I63-H66 PolarHBondContact O-N 3.17Å; I63-E67 HydrophobicContact CG2-CG 4.4Å; I63-E67 WeakPolarHBondContact O-CG 3.45Å; I63-E67 PolarHBondContact O-N 3.47Å |
| 64 | K | 97.2 | Very high | 96.5 | Very high | 155 Ų | 155 | 103 Ų | 103 | 67% | 0.674 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -60.1 | -38.4 | 178.5 | -175.6 | 178.9 | -179 | 179.6 | 0 | 112.6 | G60 E61 F62 H66 K68 | G60-K64 PolarHBondContact O-N 3.17Å; G60-K64 VanDerWaalsContact O-N 3.13Å; E61-K64 PolarHBondContact O-N 3.4Å; F62-K64 VanDerWaalsContact C-N 3.35Å; F62-K64 PolarHBondContact O-N 3.02Å; K64-H66 VanDerWaalsContact C-N 3.33Å; K64-K68 PolarHBondContact O-N 3.03Å; K64-K68 VanDerWaalsContact O-N 3.12Å |
| 65 | Q | 94.9 | Very high | 96.4 | Very high | 105 Ų | 105 | 105 Ų | 105 | 49% | 0.491 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -66 | -38.6 | 175.3 | -170.6 | -174.5 | 14.1 | 0 | 0 | 111.5 | E61 F62 I63 R69 | E61-Q65 WeakPolarHBondContact O-CB 3.48Å; E61-Q65 PolarHBondContact O-N 2.82Å; F62-Q65 WeakPolarHBondContact O-CB 3.35Å; F62-Q65 PolarHBondContact O-N 3.33Å; I63-Q65 VanDerWaalsContact C-N 3.29Å; I63-Q65 PolarHBondContact O-N 3.06Å; Q65-R69 WeakPolarHBondContact O-CB 3.48Å; Q65-R69 PolarHBondContact O-N 2.88Å |
| 66 | H | 95.4 | Very high | 96.2 | Very high | 68 Ų | 68 | 102.3 Ų | 102.3 | 32% | 0.315 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -66.5 | -45.5 | 176.4 | -90.5 | -85.6 | 0 | 0 | 0 | 112.3 | F62 I63 K64 K68 R69 E70 | F62-H66 AromaticContact CD1-CD2 3.61Å; F62-H66 AromaticContact CD2-CD2 3.99Å; F62-H66 AromaticContact CE1-CD2 3.31Å; F62-H66 WeakPolarHBondContact CE1-CD2 3.29Å; F62-H66 AromaticContact CE1-NE2 3.35Å; F62-H66 VanDerWaalsContact CE1-NE2 3.35Å; F62-H66 WeakPolarHBondContact CE1-NE2 3.48Å; F62-H66 AromaticContact CE2-CD2 3.72Å; F62-H66 AromaticContact CE2-NE2 3.35Å; F62-H66 WeakPolarHBondContact CE2-NE2 3.25Å; F62-H66 AromaticContact CG-CD2 3.95Å; F62-H66 AromaticContact CZ-CD2 3.39Å; F62-H66 WeakPolarHBondContact CZ-CD2 3.45Å; F62-H66 AromaticContact CZ-CE1 3.98Å; F62-H66 AromaticContact CZ-NE2 2.94Å; F62-H66 WeakPolarHBondContact CZ-NE2 3.36Å; F62-H66 PolarHBondContact O-CD2 3.42Å; F62-H66 VanDerWaalsContact O-CD2 3.28Å; F62-H66 PolarHBondContact O-N 2.93Å; I63-H66 WeakPolarHBondContact O-CA 3.32Å; I63-H66 WeakPolarHBondContact O-CB 3.49Å; I63-H66 PolarHBondContact O-N 3.17Å; K64-H66 VanDerWaalsContact C-N 3.33Å; H66-K68 VanDerWaalsContact C-N 3.31Å; H66-K68 PolarHBondContact O-N 3Å; H66-R69 WeakPolarHBondContact O-CB 3.43Å; H66-R69 PolarHBondContact O-N 3.45Å; H66-E70 WeakPolarHBondContact O-CB 3.37Å; H66-E70 PolarHBondContact O-N 3.5Å |
| 67 | E | 96.8 | Very high | 96 | Very high | 116 Ų | 116 | 101.6 Ų | 101.6 | 54% | 0.542 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -56.9 | -45.4 | 174.4 | -69.8 | 172.7 | 165.8 | 0 | 0 | 111.4 | I63 R69 E70 E71 | I63-E67 HydrophobicContact CG2-CG 4.4Å; I63-E67 WeakPolarHBondContact O-CG 3.45Å; I63-E67 PolarHBondContact O-N 3.47Å; E67-R69 VanDerWaalsContact C-N 3.3Å; E67-R69 PolarHBondContact O-N 3.28Å; E67-E70 PolarHBondContact O-N 3.24Å; E67-E71 PolarHBondContact O-N 2.99Å |
| 68 | K | 95.4 | Very high | 95.9 | Very high | 154 Ų | 154 | 102.9 Ų | 102.9 | 67% | 0.67 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -62.8 | -37.3 | 176.1 | -175.8 | 178.6 | 179.4 | -179.3 | 0 | 112.5 | K64 H66 H72 | K64-K68 PolarHBondContact O-N 3.03Å; K64-K68 VanDerWaalsContact O-N 3.12Å; H66-K68 VanDerWaalsContact C-N 3.31Å; H66-K68 PolarHBondContact O-N 3Å; K68-H72 PolarHBondContact O-N 3.38Å |
| 69 | R | 95 | Very high | 95.8 | Very high | 70 Ų | 70 | 102.3 Ų | 102.3 | 26% | 0.264 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -68.2 | -42.9 | 177.6 | -170.7 | -171.8 | -55.1 | 171.5 | 5 | 110.7 | Q65 H66 E67 H72 V73 | Q65-R69 WeakPolarHBondContact O-CB 3.48Å; Q65-R69 PolarHBondContact O-N 2.88Å; H66-R69 WeakPolarHBondContact O-CB 3.43Å; H66-R69 PolarHBondContact O-N 3.45Å; E67-R69 VanDerWaalsContact C-N 3.3Å; E67-R69 PolarHBondContact O-N 3.28Å; R69-H72 PolarHBondContact O-N 2.95Å; R69-V73 WeakPolarHBondContact O-CG2 3.37Å; R69-V73 PolarHBondContact O-N 2.93Å |
| 70 | E | 94.9 | Very high | 95.6 | Very high | 130 Ų | 130 | 100.9 Ų | 100.9 | 61% | 0.607 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -60 | -46.8 | 176.5 | -172.3 | 171.7 | -159.1 | 0 | 0 | 111 | H66 E67 H72 V73 D74 | H66-E70 WeakPolarHBondContact O-CB 3.37Å; H66-E70 PolarHBondContact O-N 3.5Å; E67-E70 PolarHBondContact O-N 3.24Å; E70-H72 VanDerWaalsContact C-N 3.28Å; E70-H72 PolarHBondContact O-N 3.47Å; E70-V73 PolarHBondContact O-N 3.06Å; E70-V73 VanDerWaalsContact O-N 3.14Å; E70-D74 PolarHBondContact O-N 3.45Å |
| 71 | E | 95.8 | Very high | 95.5 | Very high | 140 Ų | 140 | 105.3 Ų | 105.3 | 65% | 0.654 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -57 | -41.1 | 174.2 | -171.8 | -168.6 | 172 | 0 | 0 | 112.2 | E67 D74 K75 | E67-E71 PolarHBondContact O-N 2.99Å; E71-D74 PolarHBondContact O-N 2.92Å; E71-K75 WeakPolarHBondContact O-CB 3.39Å; E71-K75 PolarHBondContact O-N 3.46Å |
| 72 | H | 93.8 | Very high | 95.4 | Very high | 84 Ų | 84 | 103.9 Ų | 103.9 | 39% | 0.389 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -67.6 | -39.5 | 178.5 | -172.6 | -117.7 | 0 | 0 | 0 | 112.5 | K68 R69 E70 K75 L76 | K68-H72 PolarHBondContact O-N 3.38Å; R69-H72 PolarHBondContact O-N 2.95Å; E70-H72 VanDerWaalsContact C-N 3.28Å; E70-H72 PolarHBondContact O-N 3.47Å; H72-K75 PolarHBondContact O-N 3.33Å; H72-L76 PolarHBondContact O-N 2.95Å |
| 73 | V | 94.1 | Very high | 95.2 | Very high | 88 Ų | 88 | 101.2 Ų | 101.2 | 53% | 0.533 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.2 | -44.2 | 175.3 | 170.6 | 0 | 0 | 0 | 0 | 110.6 | R69 E70 K75 L76 G77 | R69-V73 WeakPolarHBondContact O-CG2 3.37Å; R69-V73 PolarHBondContact O-N 2.93Å; E70-V73 PolarHBondContact O-N 3.06Å; E70-V73 VanDerWaalsContact O-N 3.14Å; V73-K75 VanDerWaalsContact C-N 3.31Å; V73-K75 PolarHBondContact O-N 3.4Å; V73-L76 WeakPolarHBondContact O-CB 3.39Å; V73-L76 PolarHBondContact O-N 2.91Å; V73-G77 PolarHBondContact O-N 2.99Å |
| 74 | D | 96.6 | Very high | 95.1 | Very high | 96 Ų | 96 | 102.3 Ų | 102.3 | 51% | 0.513 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -60 | -42 | 175.2 | -85.8 | 1.3 | 0 | 0 | 0 | 112.1 | E70 E71 G77 K78 | E70-D74 PolarHBondContact O-N 3.45Å; E71-D74 PolarHBondContact O-N 2.92Å; D74-G77 PolarHBondContact O-N 2.86Å; D74-K78 WeakPolarHBondContact O-CG 3.4Å; D74-K78 PolarHBondContact O-N 3.12Å |
| 75 | K | 95.4 | Very high | 94.9 | Very high | 123 Ų | 123 | 98.7 Ų | 98.7 | 54% | 0.535 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64.9 | -40.5 | 176.4 | -171.8 | 175.9 | -177.5 | 176.3 | 0 | 111.8 | E71 H72 V73 R79 | E71-K75 WeakPolarHBondContact O-CB 3.39Å; E71-K75 PolarHBondContact O-N 3.46Å; H72-K75 PolarHBondContact O-N 3.33Å; V73-K75 VanDerWaalsContact C-N 3.31Å; V73-K75 PolarHBondContact O-N 3.4Å; K75-R79 PolarHBondContact O-N 2.98Å |
| 76 | L | 94.9 | Very high | 94.9 | Very high | 38 Ų | 38 | 100.1 Ų | 100.1 | 20% | 0.199 | 49% | 0.492 | C | S | . | . | H | α-helix | trans | -62.1 | -47.4 | 173.5 | -84.2 | 164.4 | 0 | 0 | 0 | 111.3 | H72 V73 K78 R79 I80 | H72-L76 PolarHBondContact O-N 2.95Å; V73-L76 WeakPolarHBondContact O-CB 3.39Å; V73-L76 PolarHBondContact O-N 2.91Å; L76-K78 VanDerWaalsContact C-N 3.32Å; L76-K78 PolarHBondContact O-N 3.03Å; L76-R79 VanDerWaalsContact CG-NH2 3.29Å; L76-R79 PolarHBondContact O-N 2.84Å; L76-R79 VanDerWaalsContact O-N 3.08Å; L76-I80 WeakPolarHBondContact O-CG1 3.48Å; L76-I80 PolarHBondContact O-N 3.15Å |
| 77 | G | 93.5 | Very high | 94.8 | Very high | 37 Ų | 37 | 99.5 Ų | 99.5 | 38% | 0.381 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -56.7 | -44.4 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | V73 D74 R79 I80 Q81 | V73-G77 PolarHBondContact O-N 2.99Å; D74-G77 PolarHBondContact O-N 2.86Å; G77-R79 PolarHBondContact O-N 2.81Å; G77-I80 PolarHBondContact O-N 3.2Å; G77-Q81 WeakPolarHBondContact O-CB 3.43Å; G77-Q81 PolarHBondContact O-N 3.46Å |
| 78 | K | 97.1 | Very high | 94.8 | Very high | 134 Ų | 134 | 98.8 Ų | 98.8 | 58% | 0.583 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -61.3 | -40.7 | 174.9 | -71.4 | 170.7 | -174.6 | 170 | 0 | 112.9 | D74 L76 L82 | D74-K78 WeakPolarHBondContact O-CG 3.4Å; D74-K78 PolarHBondContact O-N 3.12Å; L76-K78 VanDerWaalsContact C-N 3.32Å; L76-K78 PolarHBondContact O-N 3.03Å; K78-L82 VanDerWaalsContact O-CG 3.32Å; K78-L82 WeakPolarHBondContact O-CG 3.48Å; K78-L82 PolarHBondContact O-N 3.29Å |
| 79 | R | 95.6 | Very high | 94.7 | Very high | 117 Ų | 117 | 94 Ų | 94 | 44% | 0.442 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -66.1 | -43.2 | 177 | -74.3 | -169.3 | -63.3 | -121.8 | -0.8 | 112 | K75 L76 G77 L82 S83 | K75-R79 PolarHBondContact O-N 2.98Å; L76-R79 VanDerWaalsContact CG-NH2 3.29Å; L76-R79 PolarHBondContact O-N 2.84Å; L76-R79 VanDerWaalsContact O-N 3.08Å; G77-R79 PolarHBondContact O-N 2.81Å; R79-L82 PolarHBondContact O-N 2.88Å; R79-S83 WeakPolarHBondContact O-CB 3.45Å; R79-S83 PolarHBondContact O-N 3.5Å |
| 80 | I | 94.1 | Very high | 94.8 | Very high | 80 Ų | 80 | 98 Ų | 98 | 41% | 0.41 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -60.5 | -49.2 | 177.3 | -68.6 | 166.5 | 0 | 0 | 0 | 109.7 | L76 G77 L82 S83 E84 | L76-I80 WeakPolarHBondContact O-CG1 3.48Å; L76-I80 PolarHBondContact O-N 3.15Å; G77-I80 PolarHBondContact O-N 3.2Å; I80-L82 VanDerWaalsContact C-N 3.31Å; I80-L82 PolarHBondContact O-N 3.43Å; I80-S83 WeakPolarHBondContact O-CB 3.48Å; I80-S83 PolarHBondContact O-N 3.31Å; I80-S83 VanDerWaalsContact O-N 3.12Å; I80-E84 HydrophobicContact CG2-CG 4.33Å; I80-E84 WeakPolarHBondContact O-CG 3.44Å; I80-E84 PolarHBondContact O-N 2.85Å |
| 81 | Q | 94.1 | Very high | 94.7 | Very high | 135 Ų | 135 | 96.6 Ų | 96.6 | 63% | 0.631 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -59.4 | -41 | 178.9 | -173.7 | -178.3 | -2.4 | 0 | 0 | 112.7 | G77 S85 | G77-Q81 WeakPolarHBondContact O-CB 3.43Å; G77-Q81 PolarHBondContact O-N 3.46Å; Q81-S85 WeakPolarHBondContact O-CB 3.49Å; Q81-S85 PolarHBondContact O-N 3.43Å |
| 82 | L | 94.4 | Very high | 94.7 | Very high | 111 Ų | 111 | 91.4 Ų | 91.4 | 58% | 0.581 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -63.4 | -47.3 | 174.5 | -74.1 | 171 | 0 | 0 | 0 | 111.3 | K78 R79 I80 E84 S85 E86 | K78-L82 VanDerWaalsContact O-CG 3.32Å; K78-L82 WeakPolarHBondContact O-CG 3.48Å; K78-L82 PolarHBondContact O-N 3.29Å; R79-L82 PolarHBondContact O-N 2.88Å; I80-L82 VanDerWaalsContact C-N 3.31Å; I80-L82 PolarHBondContact O-N 3.43Å; L82-E84 VanDerWaalsContact C-N 3.34Å; L82-E84 PolarHBondContact O-N 2.89Å; L82-S85 WeakPolarHBondContact O-CB 3.46Å; L82-S85 PolarHBondContact O-N 3.47Å; L82-E86 WeakPolarHBondContact O-CG 3.4Å; L82-E86 PolarHBondContact O-N 3.07Å |
| 83 | S | 93.8 | Very high | 94.8 | Very high | 48 Ų | 48 | 95 Ų | 95 | 34% | 0.336 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -60.2 | -41.6 | 177.8 | 178.6 | 0 | 0 | 0 | 0 | 112.5 | R79 I80 E86 A87 | R79-S83 WeakPolarHBondContact O-CB 3.45Å; R79-S83 PolarHBondContact O-N 3.5Å; I80-S83 WeakPolarHBondContact O-CB 3.48Å; I80-S83 PolarHBondContact O-N 3.31Å; I80-S83 VanDerWaalsContact O-N 3.12Å; S83-E86 PolarHBondContact O-N 3.48Å; S83-A87 WeakPolarHBondContact O-CB 3.45Å; S83-A87 PolarHBondContact O-N 2.94Å |
| 84 | E | 93.4 | Very high | 95 | Very high | 120 Ų | 120 | 97.5 Ų | 97.5 | 56% | 0.561 | 50% | 0.498 | S | S | * | . | H | α-helix | trans | -62.8 | -44.1 | 174.9 | -73.1 | 175 | 171.4 | 0 | 0 | 111.4 | I80 L82 E86 A87 V88 | I80-E84 HydrophobicContact CG2-CG 4.33Å; I80-E84 WeakPolarHBondContact O-CG 3.44Å; I80-E84 PolarHBondContact O-N 2.85Å; L82-E84 VanDerWaalsContact C-N 3.34Å; L82-E84 PolarHBondContact O-N 2.89Å; E84-E86 VanDerWaalsContact C-N 3.32Å; E84-E86 PolarHBondContact O-N 3.39Å; E84-A87 PolarHBondContact O-N 3.38Å; E84-V88 WeakPolarHBondContact O-CG2 3.41Å; E84-V88 PolarHBondContact O-N 3.41Å |
| 85 | S | 94.1 | Very high | 95 | Very high | 79 Ų | 79 | 96.8 Ų | 96.8 | 55% | 0.552 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -61.5 | -40.6 | 176 | -175.9 | 0 | 0 | 0 | 0 | 112 | Q81 L82 A89 | Q81-S85 WeakPolarHBondContact O-CB 3.49Å; Q81-S85 PolarHBondContact O-N 3.43Å; L82-S85 WeakPolarHBondContact O-CB 3.46Å; L82-S85 PolarHBondContact O-N 3.47Å; S85-A89 WeakPolarHBondContact O-CB 3.32Å; S85-A89 PolarHBondContact O-N 3Å |
| 86 | E | 94.2 | Very high | 95 | Very high | 134 Ų | 134 | 95.5 Ų | 95.5 | 63% | 0.626 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -66.3 | -41.4 | 175.9 | -73 | 176.4 | 175.7 | 0 | 0 | 111.6 | L82 S83 E84 A89 W90 | L82-E86 WeakPolarHBondContact O-CG 3.4Å; L82-E86 PolarHBondContact O-N 3.07Å; S83-E86 PolarHBondContact O-N 3.48Å; E84-E86 VanDerWaalsContact C-N 3.32Å; E84-E86 PolarHBondContact O-N 3.39Å; E86-A89 PolarHBondContact O-N 2.92Å; E86-W90 WeakPolarHBondContact O-CB 3.47Å; E86-W90 PolarHBondContact O-N 3.14Å |
| 87 | A | 94.6 | Very high | 95 | Very high | 56 Ų | 56 | 97.5 Ų | 97.5 | 46% | 0.463 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -62.3 | -44.9 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | S83 E84 W90 Q91 | S83-A87 WeakPolarHBondContact O-CB 3.45Å; S83-A87 PolarHBondContact O-N 2.94Å; E84-A87 PolarHBondContact O-N 3.38Å; A87-W90 PolarHBondContact O-N 3.06Å; A87-Q91 WeakPolarHBondContact O-CB 3.38Å; A87-Q91 PolarHBondContact O-N 3.19Å |
| 88 | V | 95.5 | Very high | 95 | Very high | 101 Ų | 101 | 99.4 Ų | 99.4 | 61% | 0.612 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -63.2 | -44.2 | 175.6 | 171.7 | 0 | 0 | 0 | 0 | 111.1 | E84 W90 Q91 G92 | E84-V88 WeakPolarHBondContact O-CG2 3.41Å; E84-V88 PolarHBondContact O-N 3.41Å; V88-W90 VanDerWaalsContact C-N 3.31Å; V88-W90 PolarHBondContact O-N 3.43Å; V88-Q91 PolarHBondContact O-N 3.02Å; V88-G92 PolarHBondContact O-N 2.91Å |
| 89 | A | 94.9 | Very high | 94.9 | Very high | 53 Ų | 53 | 99 Ų | 99 | 44% | 0.438 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62 | -40.8 | 177 | 0 | 0 | 0 | 0 | 0 | 111.7 | S85 E86 G92 K93 | S85-A89 WeakPolarHBondContact O-CB 3.32Å; S85-A89 PolarHBondContact O-N 3Å; E86-A89 PolarHBondContact O-N 2.92Å; A89-G92 PolarHBondContact O-N 3.14Å; A89-K93 WeakPolarHBondContact O-CG 3.4Å; A89-K93 PolarHBondContact O-N 3.43Å |
| 90 | W | 95.5 | Very high | 94.9 | Very high | 155 Ų | 155 | 98.5 Ų | 98.5 | 59% | 0.587 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64.6 | -45.6 | 175.8 | -179.3 | 87.6 | 0 | 0 | 0 | 111.8 | E86 A87 V88 G92 K93 W94 | E86-W90 WeakPolarHBondContact O-CB 3.47Å; E86-W90 PolarHBondContact O-N 3.14Å; A87-W90 PolarHBondContact O-N 3.06Å; V88-W90 VanDerWaalsContact C-N 3.31Å; V88-W90 PolarHBondContact O-N 3.43Å; W90-G92 VanDerWaalsContact C-N 3.34Å; W90-G92 PolarHBondContact O-N 3.5Å; W90-K93 PolarHBondContact O-N 3.04Å; W90-W94 WeakPolarHBondContact O-CB 3.39Å; W90-W94 PolarHBondContact O-N 3.43Å |
| 91 | Q | 93.1 | Very high | 94.9 | Very high | 99 Ų | 99 | 98 Ų | 98 | 46% | 0.463 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -57.7 | -47.1 | 176 | -178.8 | 176.9 | -4.4 | 0 | 0 | 111.1 | A87 V88 K93 W94 E95 | A87-Q91 WeakPolarHBondContact O-CB 3.38Å; A87-Q91 PolarHBondContact O-N 3.19Å; V88-Q91 PolarHBondContact O-N 3.02Å; Q91-K93 VanDerWaalsContact C-N 3.34Å; Q91-K93 PolarHBondContact O-N 3.32Å; Q91-W94 WeakPolarHBondContact O-CB 3.44Å; Q91-W94 PolarHBondContact O-N 3.19Å; Q91-W94 VanDerWaalsContact O-N 3.15Å; Q91-E95 HydrophobicContact CG-CG 4.44Å; Q91-E95 WeakPolarHBondContact CG-OE1 3.28Å; Q91-E95 PolarHBondContact NE2-OE1 3.26Å; Q91-E95 WeakPolarHBondContact O-CG 3.44Å; Q91-E95 PolarHBondContact O-N 2.96Å |
| 92 | G | 96.5 | Very high | 95 | Very high | 32 Ų | 32 | 96.8 Ų | 96.8 | 33% | 0.33 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -59.7 | -42.3 | 177 | 0 | 0 | 0 | 0 | 0 | 112.8 | V88 A89 W90 W94 E95 V96 | V88-G92 PolarHBondContact O-N 2.91Å; A89-G92 PolarHBondContact O-N 3.14Å; W90-G92 VanDerWaalsContact C-N 3.34Å; W90-G92 PolarHBondContact O-N 3.5Å; G92-W94 VanDerWaalsContact C-N 3.35Å; G92-W94 PolarHBondContact O-N 3.33Å; G92-E95 PolarHBondContact O-N 2.87Å; G92-V96 WeakPolarHBondContact O-CG2 3.24Å; G92-V96 PolarHBondContact O-N 2.88Å |
| 93 | K | 96.5 | Very high | 95 | Very high | 159 Ų | 159 | 95 Ų | 95 | 69% | 0.691 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -64.1 | -40.2 | 175.2 | -71.6 | -178.7 | -174.1 | -158.6 | 0 | 112.3 | A89 W90 Q91 S97 | A89-K93 WeakPolarHBondContact O-CG 3.4Å; A89-K93 PolarHBondContact O-N 3.43Å; W90-K93 PolarHBondContact O-N 3.04Å; Q91-K93 VanDerWaalsContact C-N 3.34Å; Q91-K93 PolarHBondContact O-N 3.32Å; K93-S97 WeakPolarHBondContact O-CB 3.28Å; K93-S97 PolarHBondContact O-N 3.43Å |
| 94 | W | 97.4 | Very high | 95.1 | Very high | 141 Ų | 141 | 96.4 Ų | 96.4 | 53% | 0.534 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -64.5 | -46 | 177.9 | -178.7 | 85.6 | 0 | 0 | 0 | 111.4 | W90 Q91 G92 V96 S97 Q98 | W90-W94 WeakPolarHBondContact O-CB 3.39Å; W90-W94 PolarHBondContact O-N 3.43Å; Q91-W94 WeakPolarHBondContact O-CB 3.44Å; Q91-W94 PolarHBondContact O-N 3.19Å; Q91-W94 VanDerWaalsContact O-N 3.15Å; G92-W94 VanDerWaalsContact C-N 3.35Å; G92-W94 PolarHBondContact O-N 3.33Å; W94-V96 PolarHBondContact O-N 3.02Å; W94-S97 PolarHBondContact O-N 3.32Å; W94-Q98 WeakPolarHBondContact O-CB 3.48Å; W94-Q98 PolarHBondContact O-N 3.3Å |
| 95 | E | 96.6 | Very high | 95.2 | Very high | 80 Ų | 80 | 95 Ų | 95 | 37% | 0.374 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.2 | -44 | 177.3 | -71.8 | 174.6 | -174.8 | 0 | 0 | 112 | Q91 G92 Q98 Q99 | Q91-E95 HydrophobicContact CG-CG 4.44Å; Q91-E95 WeakPolarHBondContact CG-OE1 3.28Å; Q91-E95 PolarHBondContact NE2-OE1 3.26Å; Q91-E95 WeakPolarHBondContact O-CG 3.44Å; Q91-E95 PolarHBondContact O-N 2.96Å; G92-E95 PolarHBondContact O-N 2.87Å; E95-Q98 PolarHBondContact O-N 3.48Å; E95-Q99 WeakPolarHBondContact O-CG 3.48Å; E95-Q99 PolarHBondContact O-N 3.04Å |
| 96 | V | 95.9 | Very high | 95.3 | Very high | 97 Ų | 97 | 93.9 Ų | 93.9 | 59% | 0.588 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -61.9 | -44.1 | 175.3 | 170.6 | 0 | 0 | 0 | 0 | 111.3 | G92 W94 Q98 Q99 M100 | G92-V96 WeakPolarHBondContact O-CG2 3.24Å; G92-V96 PolarHBondContact O-N 2.88Å; W94-V96 PolarHBondContact O-N 3.02Å; V96-Q98 VanDerWaalsContact C-N 3.31Å; V96-Q98 PolarHBondContact O-N 3.01Å; V96-Q99 PolarHBondContact O-N 3.14Å; V96-M100 WeakPolarHBondContact O-CB 3.41Å; V96-M100 PolarHBondContact O-N 3.17Å |
| 97 | S | 94.5 | Very high | 95.4 | Very high | 80 Ų | 80 | 94.4 Ų | 94.4 | 56% | 0.559 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -62.2 | -40.2 | 176.7 | -175.3 | 0 | 0 | 0 | 0 | 111.8 | K93 W94 M100 S101 | K93-S97 WeakPolarHBondContact O-CB 3.28Å; K93-S97 PolarHBondContact O-N 3.43Å; W94-S97 PolarHBondContact O-N 3.32Å; S97-M100 PolarHBondContact O-N 2.97Å; S97-S101 WeakPolarHBondContact O-CB 3.29Å; S97-S101 PolarHBondContact O-N 2.97Å |
| 98 | Q | 94 | Very high | 95.4 | Very high | 77 Ų | 77 | 97.7 Ų | 97.7 | 36% | 0.36 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -66 | -48.8 | 178.8 | -176.1 | 57.3 | 27.5 | 0 | 0 | 111.3 | W94 E95 V96 M100 S101 E102 | W94-Q98 WeakPolarHBondContact O-CB 3.48Å; W94-Q98 PolarHBondContact O-N 3.3Å; E95-Q98 PolarHBondContact O-N 3.48Å; V96-Q98 VanDerWaalsContact C-N 3.31Å; V96-Q98 PolarHBondContact O-N 3.01Å; Q98-M100 VanDerWaalsContact C-N 3.31Å; Q98-M100 PolarHBondContact O-N 3.43Å; Q98-S101 WeakPolarHBondContact O-CB 3.34Å; Q98-S101 PolarHBondContact O-N 3.34Å; Q98-E102 PolarHBondContact NE2-OE1 3.41Å; Q98-E102 WeakPolarHBondContact O-CG 3.41Å; Q98-E102 PolarHBondContact O-N 3.12Å |
| 99 | Q | 95.1 | Very high | 95.4 | Very high | 126 Ų | 126 | 97.4 Ų | 97.4 | 59% | 0.589 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -60.5 | -40.2 | 176.5 | -71.4 | 178 | 35.3 | 0 | 0 | 112.1 | E95 V96 E102 S103 | E95-Q99 WeakPolarHBondContact O-CG 3.48Å; E95-Q99 PolarHBondContact O-N 3.04Å; V96-Q99 PolarHBondContact O-N 3.14Å; Q99-E102 PolarHBondContact O-N 2.93Å; Q99-S103 VanDerWaalsContact O-CB 3.27Å; Q99-S103 WeakPolarHBondContact O-CB 3.47Å; Q99-S103 PolarHBondContact O-N 3.33Å |
| 100 | M | 94.5 | Very high | 95.5 | Very high | 106 Ų | 106 | 99.7 Ų | 99.7 | 52% | 0.522 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.2 | -42.8 | 176.5 | -171.1 | 67.1 | -160.5 | 0 | 0 | 111.4 | V96 S97 Q98 S103 L104 | V96-M100 WeakPolarHBondContact O-CB 3.41Å; V96-M100 PolarHBondContact O-N 3.17Å; S97-M100 PolarHBondContact O-N 2.97Å; Q98-M100 VanDerWaalsContact C-N 3.31Å; Q98-M100 PolarHBondContact O-N 3.43Å; M100-S103 PolarHBondContact O-N 3.44Å; M100-L104 HydrophobicContact CE-CD1 3.99Å; M100-L104 HydrophobicContact CE-CD2 3.8Å; M100-L104 HydrophobicContact CE-CG 3.76Å; M100-L104 HydrophobicContact CG-CD1 4.24Å; M100-L104 WeakPolarHBondContact O-CB 3.5Å; M100-L104 VanDerWaalsContact O-CG 3.24Å; M100-L104 WeakPolarHBondContact O-CG 3.38Å; M100-L104 PolarHBondContact O-N 3.17Å |
| 101 | S | 94.8 | Very high | 95.5 | Very high | 70 Ų | 70 | 98.2 Ų | 98.2 | 49% | 0.49 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.4 | -46.1 | 176.7 | -174 | 0 | 0 | 0 | 0 | 111.9 | S97 Q98 L104 N105 | S97-S101 WeakPolarHBondContact O-CB 3.29Å; S97-S101 PolarHBondContact O-N 2.97Å; Q98-S101 WeakPolarHBondContact O-CB 3.34Å; Q98-S101 PolarHBondContact O-N 3.34Å; S101-L104 PolarHBondContact O-N 2.92Å; S101-N105 WeakPolarHBondContact O-CB 3.33Å; S101-N105 PolarHBondContact O-N 2.85Å |
| 102 | E | 95.4 | Very high | 95.7 | Very high | 109 Ų | 109 | 100 Ų | 100 | 51% | 0.509 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.2 | -45.3 | 177.4 | -72.3 | 173.7 | -169.9 | 0 | 0 | 112 | Q98 Q99 L104 N105 A106 | Q98-E102 PolarHBondContact NE2-OE1 3.41Å; Q98-E102 WeakPolarHBondContact O-CG 3.41Å; Q98-E102 PolarHBondContact O-N 3.12Å; Q99-E102 PolarHBondContact O-N 2.93Å; E102-L104 PolarHBondContact O-N 3.07Å; E102-N105 PolarHBondContact O-N 2.96Å; E102-A106 WeakPolarHBondContact O-CB 3.39Å; E102-A106 PolarHBondContact O-N 3.31Å |
| 103 | S | 95.4 | Very high | 95.7 | Very high | 72 Ų | 72 | 103.5 Ų | 103.5 | 50% | 0.503 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -61.5 | -43 | 176 | -178.3 | 0 | 0 | 0 | 0 | 112.1 | Q99 M100 A106 K107 | Q99-S103 VanDerWaalsContact O-CB 3.27Å; Q99-S103 WeakPolarHBondContact O-CB 3.47Å; Q99-S103 PolarHBondContact O-N 3.33Å; M100-S103 PolarHBondContact O-N 3.44Å; S103-A106 PolarHBondContact O-N 3.5Å; S103-K107 WeakPolarHBondContact O-CB 3.42Å; S103-K107 PolarHBondContact O-N 3.3Å |
| 104 | L | 95.6 | Very high | 95.6 | Very high | 78 Ų | 78 | 98.3 Ų | 98.3 | 41% | 0.408 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.3 | -41.7 | 174.7 | -75 | 174.7 | 0 | 0 | 0 | 112 | M100 S101 E102 K107 K108 | M100-L104 HydrophobicContact CE-CD1 3.99Å; M100-L104 HydrophobicContact CE-CD2 3.8Å; M100-L104 HydrophobicContact CE-CG 3.76Å; M100-L104 HydrophobicContact CG-CD1 4.24Å; M100-L104 WeakPolarHBondContact O-CB 3.5Å; M100-L104 VanDerWaalsContact O-CG 3.24Å; M100-L104 WeakPolarHBondContact O-CG 3.38Å; M100-L104 PolarHBondContact O-N 3.17Å; S101-L104 PolarHBondContact O-N 2.92Å; E102-L104 PolarHBondContact O-N 3.07Å; L104-K107 PolarHBondContact O-N 3.03Å; L104-K108 WeakPolarHBondContact O-CB 3.44Å; L104-K108 VanDerWaalsContact O-CG 3.29Å; L104-K108 WeakPolarHBondContact O-CG 3.47Å; L104-K108 PolarHBondContact O-N 2.95Å |
| 105 | N | 95 | Very high | 95.6 | Very high | 92 Ų | 92 | 93 Ų | 93 | 49% | 0.492 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -65.4 | -45.9 | 176.8 | -172.4 | 33.6 | 0 | 0 | 0 | 111.1 | S101 E102 K107 K108 Q109 | S101-N105 WeakPolarHBondContact O-CB 3.33Å; S101-N105 PolarHBondContact O-N 2.85Å; E102-N105 PolarHBondContact O-N 2.96Å; N105-K107 PolarHBondContact O-N 2.95Å; N105-K108 WeakPolarHBondContact O-CB 3.38Å; N105-K108 PolarHBondContact O-N 3.24Å; N105-Q109 WeakPolarHBondContact O-CG 3.44Å; N105-Q109 PolarHBondContact O-N 3.45Å |
| 106 | A | 96.1 | Very high | 95.6 | Very high | 55 Ų | 55 | 93.6 Ų | 93.6 | 46% | 0.455 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -58.6 | -46.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | E102 S103 K108 Q109 V110 | E102-A106 WeakPolarHBondContact O-CB 3.39Å; E102-A106 PolarHBondContact O-N 3.31Å; S103-A106 PolarHBondContact O-N 3.5Å; A106-K108 PolarHBondContact O-N 3.48Å; A106-Q109 PolarHBondContact O-N 3.13Å; A106-V110 WeakPolarHBondContact O-CG2 3.35Å; A106-V110 PolarHBondContact O-N 3.01Å |
| 107 | K | 95.8 | Very high | 95.6 | Very high | 144 Ų | 144 | 93 Ų | 93 | 63% | 0.626 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -58.5 | -45.1 | 175.7 | -174 | 178.4 | 178.4 | -178.4 | 0 | 111.9 | S103 L104 N105 Q109 V110 E111 | S103-K107 WeakPolarHBondContact O-CB 3.42Å; S103-K107 PolarHBondContact O-N 3.3Å; L104-K107 PolarHBondContact O-N 3.03Å; N105-K107 PolarHBondContact O-N 2.95Å; K107-Q109 PolarHBondContact O-N 3.41Å; K107-V110 PolarHBondContact O-N 2.94Å; K107-E111 WeakPolarHBondContact O-CB 3.39Å; K107-E111 PolarHBondContact O-N 3.33Å |
| 108 | K | 95.8 | Very high | 95.7 | Very high | 126 Ų | 126 | 96.2 Ų | 96.2 | 55% | 0.548 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60.4 | -42 | 175.9 | -75.9 | 173.9 | -179.1 | 179.6 | 0 | 112.2 | L104 N105 A106 E111 K112 | L104-K108 WeakPolarHBondContact O-CB 3.44Å; L104-K108 VanDerWaalsContact O-CG 3.29Å; L104-K108 WeakPolarHBondContact O-CG 3.47Å; L104-K108 PolarHBondContact O-N 2.95Å; N105-K108 WeakPolarHBondContact O-CB 3.38Å; N105-K108 PolarHBondContact O-N 3.24Å; A106-K108 PolarHBondContact O-N 3.48Å; K108-E111 PolarHBondContact O-N 2.94Å; K108-K112 WeakPolarHBondContact O-CB 3.31Å; K108-K112 PolarHBondContact O-N 2.94Å |
| 109 | Q | 95.2 | Very high | 95.7 | Very high | 95 Ų | 95 | 94.7 Ų | 94.7 | 44% | 0.444 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -65.7 | -43.2 | 177 | -65.4 | -59.1 | -25.6 | 0 | 0 | 111.8 | N105 A106 K107 E111 K112 L113 | N105-Q109 WeakPolarHBondContact O-CG 3.44Å; N105-Q109 PolarHBondContact O-N 3.45Å; A106-Q109 PolarHBondContact O-N 3.13Å; K107-Q109 PolarHBondContact O-N 3.41Å; Q109-E111 PolarHBondContact O-N 3.13Å; Q109-K112 PolarHBondContact O-N 3.17Å; Q109-L113 WeakPolarHBondContact O-CB 3.47Å; Q109-L113 WeakPolarHBondContact O-CG 2.94Å; Q109-L113 PolarHBondContact O-N 3.37Å |
| 110 | V | 96.9 | Very high | 95.8 | Very high | 100 Ų | 100 | 93.5 Ų | 93.5 | 61% | 0.606 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -61.1 | -44.7 | 176.1 | 171.1 | 0 | 0 | 0 | 0 | 111.1 | A106 K107 L113 S114 | A106-V110 WeakPolarHBondContact O-CG2 3.35Å; A106-V110 PolarHBondContact O-N 3.01Å; K107-V110 PolarHBondContact O-N 2.94Å; V110-L113 PolarHBondContact O-N 3Å; V110-S114 VanDerWaalsContact O-CB 3.24Å; V110-S114 WeakPolarHBondContact O-CB 3.35Å; V110-S114 PolarHBondContact O-N 3.03Å |
| 111 | E | 95.8 | Very high | 95.8 | Very high | 125 Ų | 125 | 95 Ų | 95 | 58% | 0.584 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -63.7 | -42.6 | 178.1 | -174.7 | 170.4 | -167.2 | 0 | 0 | 112 | K107 K108 Q109 S114 G115 | K107-E111 WeakPolarHBondContact O-CB 3.39Å; K107-E111 PolarHBondContact O-N 3.33Å; K108-E111 PolarHBondContact O-N 2.94Å; Q109-E111 PolarHBondContact O-N 3.13Å; E111-S114 PolarHBondContact O-N 3.37Å; E111-G115 PolarHBondContact O-N 3.08Å |
| 112 | K | 96.1 | Very high | 95.8 | Very high | 136 Ų | 136 | 96.6 Ų | 96.6 | 59% | 0.591 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -60.4 | -49.3 | 174.9 | -176.2 | 179.2 | 180 | -178.7 | 0 | 111.7 | K108 Q109 G115 L116 | K108-K112 WeakPolarHBondContact O-CB 3.31Å; K108-K112 PolarHBondContact O-N 2.94Å; Q109-K112 PolarHBondContact O-N 3.17Å; K112-G115 PolarHBondContact O-N 2.84Å; K112-L116 HydrophobicContact CG-CD1 4.48Å; K112-L116 WeakPolarHBondContact O-CG 3.4Å; K112-L116 PolarHBondContact O-N 2.95Å |
| 113 | L | 96.8 | Very high | 95.8 | Very high | 105 Ų | 105 | 97.2 Ų | 97.2 | 55% | 0.55 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63.6 | -42.2 | 178.2 | -72.1 | 173.5 | 0 | 0 | 0 | 111.6 | Q109 V110 G115 L116 C117 | Q109-L113 WeakPolarHBondContact O-CB 3.47Å; Q109-L113 WeakPolarHBondContact O-CG 2.94Å; Q109-L113 PolarHBondContact O-N 3.37Å; V110-L113 PolarHBondContact O-N 3Å; L113-G115 VanDerWaalsContact C-N 3.34Å; L113-G115 PolarHBondContact O-N 3.2Å; L113-L116 PolarHBondContact O-N 3.45Å; L113-C117 WeakPolarHBondContact O-CB 3.46Å; L113-C117 PolarHBondContact O-N 3.41Å; L113-C117 PolarHBondContact O-SG 3.39Å; L113-C117 VanDerWaalsContact O-SG 3.32Å |
| 114 | S | 95.8 | Very high | 95.8 | Very high | 51 Ų | 51 | 98.8 Ų | 98.8 | 36% | 0.357 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61 | -42.2 | 175.3 | -178.4 | 0 | 0 | 0 | 0 | 112 | V110 E111 C117 R118 | V110-S114 VanDerWaalsContact O-CB 3.24Å; V110-S114 WeakPolarHBondContact O-CB 3.35Å; V110-S114 PolarHBondContact O-N 3.03Å; E111-S114 PolarHBondContact O-N 3.37Å; S114-C117 PolarHBondContact O-N 3.38Å; S114-R118 WeakPolarHBondContact O-CG 3.3Å; S114-R118 PolarHBondContact O-N 3.04Å |
| 115 | G | 96.3 | Very high | 95.8 | Very high | 28 Ų | 28 | 98 Ų | 98 | 29% | 0.289 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -58.4 | -47.2 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | E111 K112 L113 R118 A119 | E111-G115 PolarHBondContact O-N 3.08Å; K112-G115 PolarHBondContact O-N 2.84Å; L113-G115 VanDerWaalsContact C-N 3.34Å; L113-G115 PolarHBondContact O-N 3.2Å; G115-R118 PolarHBondContact O-N 3.42Å; G115-A119 PolarHBondContact O-N 2.89Å |
| 116 | L | 96.9 | Very high | 95.7 | Very high | 94 Ų | 94 | 98.8 Ų | 98.8 | 49% | 0.492 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.9 | -42.7 | 177.2 | -69 | 172.4 | 0 | 0 | 0 | 112.2 | K112 L113 R118 A119 L120 | K112-L116 HydrophobicContact CG-CD1 4.48Å; K112-L116 WeakPolarHBondContact O-CG 3.4Å; K112-L116 PolarHBondContact O-N 2.95Å; L113-L116 PolarHBondContact O-N 3.45Å; L116-R118 VanDerWaalsContact C-N 3.34Å; L116-R118 PolarHBondContact O-N 2.99Å; L116-A119 PolarHBondContact O-N 3.11Å; L116-L120 WeakPolarHBondContact O-CB 3.28Å; L116-L120 WeakPolarHBondContact O-CG 3.46Å; L116-L120 PolarHBondContact O-N 3.2Å |
| 117 | C | 95.6 | Very high | 95.6 | Very high | 84 Ų | 84 | 101.3 Ų | 101.3 | 57% | 0.568 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -61.5 | -41.2 | 176.2 | -72.9 | 0 | 0 | 0 | 0 | 112.2 | L113 S114 K121 | L113-C117 WeakPolarHBondContact O-CB 3.46Å; L113-C117 PolarHBondContact O-N 3.41Å; L113-C117 PolarHBondContact O-SG 3.39Å; L113-C117 VanDerWaalsContact O-SG 3.32Å; S114-C117 PolarHBondContact O-N 3.38Å; C117-K121 WeakPolarHBondContact O-CB 3.3Å; C117-K121 PolarHBondContact O-N 2.97Å |
| 118 | R | 96 | Very high | 95.5 | Very high | 148 Ų | 148 | 101.3 Ų | 101.3 | 56% | 0.558 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -63.1 | -48.7 | 174.3 | -74.5 | -176.3 | -68.9 | -149.3 | 1.4 | 111.4 | S114 G115 L116 L120 K121 D122 | S114-R118 WeakPolarHBondContact O-CG 3.3Å; S114-R118 PolarHBondContact O-N 3.04Å; G115-R118 PolarHBondContact O-N 3.42Å; L116-R118 VanDerWaalsContact C-N 3.34Å; L116-R118 PolarHBondContact O-N 2.99Å; R118-L120 PolarHBondContact O-N 3.28Å; R118-K121 WeakPolarHBondContact O-CB 3.3Å; R118-K121 PolarHBondContact O-N 3.48Å; R118-K121 VanDerWaalsContact O-N 3.11Å; R118-D122 PolarHBondContact O-N 3.47Å |
| 119 | A | 95.7 | Very high | 95.5 | Very high | 45 Ų | 45 | 101.4 Ų | 101.4 | 37% | 0.372 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -60.1 | -42.4 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | G115 L116 D122 Q123 | G115-A119 PolarHBondContact O-N 2.89Å; L116-A119 PolarHBondContact O-N 3.11Å; A119-D122 PolarHBondContact O-N 3.17Å; A119-Q123 WeakPolarHBondContact O-CG 3.5Å; A119-Q123 PolarHBondContact O-N 2.96Å |
| 120 | L | 95.8 | Very high | 95.3 | Very high | 101 Ų | 101 | 99.9 Ų | 99.9 | 53% | 0.529 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65.1 | -39.2 | 175.2 | -73 | 172.7 | 0 | 0 | 0 | 111.9 | L116 R118 D122 Q123 L124 | L116-L120 WeakPolarHBondContact O-CB 3.28Å; L116-L120 WeakPolarHBondContact O-CG 3.46Å; L116-L120 PolarHBondContact O-N 3.2Å; R118-L120 PolarHBondContact O-N 3.28Å; L120-D122 VanDerWaalsContact C-N 3.35Å; L120-Q123 PolarHBondContact O-N 3.5Å; L120-L124 WeakPolarHBondContact O-CG 3.32Å; L120-L124 PolarHBondContact O-N 2.96Å |
| 121 | K | 95.3 | Very high | 95 | Very high | 138 Ų | 138 | 100.8 Ų | 100.8 | 60% | 0.6 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -62.9 | -41.9 | 175.3 | -174.4 | 173.4 | -178.3 | 177.1 | 0 | 111.5 | C117 R118 L124 N125 | C117-K121 WeakPolarHBondContact O-CB 3.3Å; C117-K121 PolarHBondContact O-N 2.97Å; R118-K121 WeakPolarHBondContact O-CB 3.3Å; R118-K121 PolarHBondContact O-N 3.48Å; R118-K121 VanDerWaalsContact O-N 3.11Å; K121-L124 PolarHBondContact O-N 3.34Å; K121-N125 VanDerWaalsContact O-CG 3.23Å; K121-N125 PolarHBondContact O-N 3.45Å; K121-N125 PolarHBondContact O-ND2 3.34Å |
| 122 | D | 95.5 | Very high | 94.8 | Very high | 103 Ų | 103 | 100 Ų | 100 | 55% | 0.551 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -66.1 | -43.4 | 178 | -66.3 | -23.3 | 0 | 0 | 0 | 111.5 | R118 A119 L120 L124 N125 E126 | R118-D122 PolarHBondContact O-N 3.47Å; A119-D122 PolarHBondContact O-N 3.17Å; L120-D122 VanDerWaalsContact C-N 3.35Å; D122-L124 PolarHBondContact O-N 2.92Å; D122-N125 PolarHBondContact O-N 3.14Å; D122-E126 PolarHBondContact O-N 3.36Å |
| 123 | Q | 95.3 | Very high | 94.4 | Very high | 121 Ų | 121 | 96.9 Ų | 96.9 | 57% | 0.565 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -59.8 | -42.8 | 173.9 | -73.2 | 179 | 15.8 | 0 | 0 | 112.4 | A119 L120 N125 E126 L127 | A119-Q123 WeakPolarHBondContact O-CG 3.5Å; A119-Q123 PolarHBondContact O-N 2.96Å; L120-Q123 PolarHBondContact O-N 3.5Å; Q123-N125 VanDerWaalsContact C-N 3.33Å; Q123-N125 PolarHBondContact O-N 3.25Å; Q123-E126 PolarHBondContact O-N 2.96Å; Q123-L127 WeakPolarHBondContact O-CG 3.35Å; Q123-L127 PolarHBondContact O-N 3.29Å |
| 124 | L | 94.7 | Very high | 93.8 | Very high | 105 Ų | 105 | 97.5 Ų | 97.5 | 55% | 0.55 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.6 | -38.7 | 175.6 | -76.8 | 174.4 | 0 | 0 | 0 | 112.3 | L120 K121 D122 R128 | L120-L124 WeakPolarHBondContact O-CG 3.32Å; L120-L124 PolarHBondContact O-N 2.96Å; K121-L124 PolarHBondContact O-N 3.34Å; D122-L124 PolarHBondContact O-N 2.92Å; L124-R128 WeakPolarHBondContact O-CB 3.46Å; L124-R128 PolarHBondContact O-N 2.86Å |
| 125 | N | 94.6 | Very high | 93.5 | Very high | 61 Ų | 61 | 102 Ų | 102 | 33% | 0.326 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -65.7 | -39.8 | 176.4 | -70.9 | -25.4 | 0 | 0 | 0 | 111.6 | K121 D122 Q123 R128 K129 | K121-N125 VanDerWaalsContact O-CG 3.23Å; K121-N125 PolarHBondContact O-N 3.45Å; K121-N125 PolarHBondContact O-ND2 3.34Å; D122-N125 PolarHBondContact O-N 3.14Å; Q123-N125 VanDerWaalsContact C-N 3.33Å; Q123-N125 PolarHBondContact O-N 3.25Å; N125-R128 PolarHBondContact O-N 3.39Å; N125-R128 PolarHBondContact OD1-NH1 2.91Å; N125-K129 WeakPolarHBondContact O-CG 3.41Å; N125-K129 PolarHBondContact O-N 2.98Å |
| 126 | E | 94.4 | Very high | 93 | Very high | 109 Ų | 109 | 105.3 Ų | 105.3 | 51% | 0.509 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -68.1 | -42.7 | 177.9 | -165.4 | 56.9 | -144 | 0 | 0 | 112.4 | D122 Q123 R128 K129 S130 | D122-E126 PolarHBondContact O-N 3.36Å; Q123-E126 PolarHBondContact O-N 2.96Å; E126-R128 VanDerWaalsContact C-N 3.31Å; E126-R128 PolarHBondContact O-N 3.03Å; E126-K129 PolarHBondContact O-N 3.29Å; E126-S130 PolarHBondContact O-N 2.98Å; E126-S130 PolarHBondContact O-OG 3.12Å; E126-S130 VanDerWaalsContact O-OG 3.07Å |
| 127 | L | 94 | Very high | 92.2 | Very high | 109 Ų | 109 | 104.4 Ų | 104.4 | 57% | 0.571 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -60.9 | -40.8 | 173.4 | -74.3 | 172.8 | 0 | 0 | 0 | 111.6 | Q123 S130 Q131 | Q123-L127 WeakPolarHBondContact O-CG 3.35Å; Q123-L127 PolarHBondContact O-N 3.29Å; L127-S130 PolarHBondContact O-N 3Å; L127-Q131 WeakPolarHBondContact O-CB 3.39Å; L127-Q131 WeakPolarHBondContact O-CG 3.46Å; L127-Q131 PolarHBondContact O-N 3.4Å |
| 128 | R | 94.2 | Very high | 91.7 | Very high | 144 Ų | 144 | 105.5 Ų | 105.5 | 54% | 0.543 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.9 | -44.2 | 176.6 | -172.6 | -177 | -66.6 | 106.6 | -1 | 111.6 | L124 N125 E126 Q131 Q132 | L124-R128 WeakPolarHBondContact O-CB 3.46Å; L124-R128 PolarHBondContact O-N 2.86Å; N125-R128 PolarHBondContact O-N 3.39Å; N125-R128 PolarHBondContact OD1-NH1 2.91Å; E126-R128 VanDerWaalsContact C-N 3.31Å; E126-R128 PolarHBondContact O-N 3.03Å; R128-Q131 PolarHBondContact O-N 2.9Å; R128-Q132 WeakPolarHBondContact O-CB 3.34Å; R128-Q132 PolarHBondContact O-N 3.47Å |
| 129 | K | 94 | Very high | 91 | Very high | 127 Ų | 127 | 102.5 Ų | 102.5 | 55% | 0.552 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -60.8 | -47 | 175 | -73.9 | 176.7 | -177.3 | 175.1 | 0 | 111.5 | N125 E126 Q131 Q132 S133 | N125-K129 WeakPolarHBondContact O-CG 3.41Å; N125-K129 PolarHBondContact O-N 2.98Å; E126-K129 PolarHBondContact O-N 3.29Å; K129-Q131 PolarHBondContact O-N 3.07Å; K129-Q132 WeakPolarHBondContact O-CB 3.34Å; K129-Q132 PolarHBondContact O-N 3.02Å; K129-Q132 VanDerWaalsContact O-N 3.16Å; K129-S133 PolarHBondContact O-N 3.38Å; K129-S133 PolarHBondContact O-OG 3.43Å |
| 130 | S | 91.3 | Very high | 90.1 | Very high | 64 Ų | 64 | 105.3 Ų | 105.3 | 45% | 0.448 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -60.2 | -44.4 | 178.2 | -63 | 0 | 0 | 0 | 0 | 112.2 | E126 L127 Q132 S133 Q134 | E126-S130 PolarHBondContact O-N 2.98Å; E126-S130 PolarHBondContact O-OG 3.12Å; E126-S130 VanDerWaalsContact O-OG 3.07Å; L127-S130 PolarHBondContact O-N 3Å; S130-Q132 VanDerWaalsContact C-N 3.34Å; S130-Q132 PolarHBondContact O-N 2.89Å; S130-S133 PolarHBondContact O-N 2.99Å; S130-Q134 WeakPolarHBondContact O-CB 3.35Å; S130-Q134 PolarHBondContact O-N 3.22Å |
| 131 | Q | 90.7 | Very high | 89.2 | Confident | 118 Ų | 118 | 106.6 Ų | 106.6 | 55% | 0.551 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -62.9 | -38.8 | 174.8 | -77.9 | -176.3 | -22.3 | 0 | 0 | 112.5 | L127 R128 K129 Q134 K135 | L127-Q131 WeakPolarHBondContact O-CB 3.39Å; L127-Q131 WeakPolarHBondContact O-CG 3.46Å; L127-Q131 PolarHBondContact O-N 3.4Å; R128-Q131 PolarHBondContact O-N 2.9Å; K129-Q131 PolarHBondContact O-N 3.07Å; Q131-Q134 PolarHBondContact O-N 3.18Å; Q131-K135 WeakPolarHBondContact O-CG 3.42Å; Q131-K135 PolarHBondContact O-N 2.94Å |
| 132 | Q | 91.3 | Very high | 88.3 | Confident | 108 Ų | 108 | 102.6 Ų | 102.6 | 51% | 0.505 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -64.7 | -48.6 | 177.1 | -179.7 | 173.5 | -14.4 | 0 | 0 | 111.1 | R128 K129 S130 Q134 K135 E136 | R128-Q132 WeakPolarHBondContact O-CB 3.34Å; R128-Q132 PolarHBondContact O-N 3.47Å; K129-Q132 WeakPolarHBondContact O-CB 3.34Å; K129-Q132 PolarHBondContact O-N 3.02Å; K129-Q132 VanDerWaalsContact O-N 3.16Å; S130-Q132 VanDerWaalsContact C-N 3.34Å; S130-Q132 PolarHBondContact O-N 2.89Å; Q132-Q134 VanDerWaalsContact C-N 3.27Å; Q132-Q134 PolarHBondContact O-N 2.99Å; Q132-K135 PolarHBondContact O-N 3.44Å; Q132-K135 VanDerWaalsContact O-N 3.17Å; Q132-E136 WeakPolarHBondContact CG-OE1 3.28Å; Q132-E136 PolarHBondContact NE2-OE1 2.92Å; Q132-E136 WeakPolarHBondContact O-CG 3.32Å; Q132-E136 PolarHBondContact O-N 3.04Å |
| 133 | S | 87.4 | Confident | 87.4 | Confident | 72 Ų | 72 | 103.7 Ų | 103.7 | 50% | 0.503 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -60.6 | -36.5 | 176.4 | -59.7 | 0 | 0 | 0 | 0 | 112.5 | K129 S130 E136 S137 | K129-S133 PolarHBondContact O-N 3.38Å; K129-S133 PolarHBondContact O-OG 3.43Å; S130-S133 PolarHBondContact O-N 2.99Å; S133-E136 PolarHBondContact O-N 3.18Å; S133-S137 WeakPolarHBondContact O-CB 3.38Å; S133-S137 PolarHBondContact O-N 3.31Å |
| 134 | Q | 86.2 | Confident | 86.3 | Confident | 118 Ų | 118 | 103.8 Ų | 103.8 | 55% | 0.551 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -65.4 | -43.9 | 175 | -171.7 | 179.6 | -2.1 | 0 | 0 | 112.1 | S130 Q131 Q132 S137 Q138 | S130-Q134 WeakPolarHBondContact O-CB 3.35Å; S130-Q134 PolarHBondContact O-N 3.22Å; Q131-Q134 PolarHBondContact O-N 3.18Å; Q132-Q134 VanDerWaalsContact C-N 3.27Å; Q132-Q134 PolarHBondContact O-N 2.99Å; Q134-S137 PolarHBondContact O-N 3.36Å; Q134-Q138 WeakPolarHBondContact O-CG 3.48Å; Q134-Q138 PolarHBondContact O-N 2.93Å |
| 135 | K | 87.8 | Confident | 84.8 | Confident | 145 Ų | 145 | 103 Ų | 103 | 63% | 0.63 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -63.7 | -40.8 | 175.9 | -75.2 | 178.8 | -179.7 | -179.4 | 0 | 112.1 | Q131 Q132 Q138 N139 | Q131-K135 WeakPolarHBondContact O-CG 3.42Å; Q131-K135 PolarHBondContact O-N 2.94Å; Q132-K135 PolarHBondContact O-N 3.44Å; Q132-K135 VanDerWaalsContact O-N 3.17Å; K135-Q138 PolarHBondContact O-N 3.34Å; K135-N139 WeakPolarHBondContact O-CB 3.48Å; K135-N139 PolarHBondContact O-N 3.13Å |
| 136 | E | 85.8 | Confident | 83.2 | Confident | 98 Ų | 98 | 106.4 Ų | 106.4 | 46% | 0.458 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.3 | -46.2 | 175.5 | -73.2 | 169.3 | -173 | 0 | 0 | 110.6 | Q132 S133 Q138 N139 L140 | Q132-E136 WeakPolarHBondContact CG-OE1 3.28Å; Q132-E136 PolarHBondContact NE2-OE1 2.92Å; Q132-E136 WeakPolarHBondContact O-CG 3.32Å; Q132-E136 PolarHBondContact O-N 3.04Å; S133-E136 PolarHBondContact O-N 3.18Å; E136-Q138 PolarHBondContact O-N 3.03Å; E136-N139 PolarHBondContact O-N 3.5Å; E136-L140 WeakPolarHBondContact O-CD1 3.34Å; E136-L140 PolarHBondContact O-N 2.99Å |
| 137 | S | 81.4 | Confident | 81.5 | Confident | 74 Ų | 74 | 107.7 Ų | 107.7 | 52% | 0.517 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -60.4 | -44.4 | 175.6 | -168.1 | 0 | 0 | 0 | 0 | 112.8 | S133 Q134 N139 L140 E141 | S133-S137 WeakPolarHBondContact O-CB 3.38Å; S133-S137 PolarHBondContact O-N 3.31Å; Q134-S137 PolarHBondContact O-N 3.36Å; S137-N139 VanDerWaalsContact C-N 3.33Å; S137-N139 PolarHBondContact O-N 3.43Å; S137-L140 WeakPolarHBondContact O-CB 3.37Å; S137-L140 PolarHBondContact O-N 3.28Å; S137-E141 PolarHBondContact O-N 3.15Å |
| 138 | Q | 83.9 | Confident | 79.6 | Confident | 108 Ų | 108 | 108.5 Ų | 108.5 | 51% | 0.505 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -65 | -36.5 | 176.5 | -74.3 | 178.8 | -11.1 | 0 | 0 | 112.2 | Q134 K135 E136 E141 A142 | Q134-Q138 WeakPolarHBondContact O-CG 3.48Å; Q134-Q138 PolarHBondContact O-N 2.93Å; K135-Q138 PolarHBondContact O-N 3.34Å; E136-Q138 PolarHBondContact O-N 3.03Å; Q138-E141 PolarHBondContact O-N 3.38Å; Q138-A142 WeakPolarHBondContact O-CB 3.46Å; Q138-A142 PolarHBondContact O-N 3.33Å |
| 139 | N | 81.9 | Confident | 77.6 | Confident | 84 Ų | 84 | 106.4 Ų | 106.4 | 45% | 0.449 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -66.5 | -39.8 | 175.9 | -169.8 | -88.8 | 0 | 0 | 0 | 111.7 | K135 E136 S137 K143 | K135-N139 WeakPolarHBondContact O-CB 3.48Å; K135-N139 PolarHBondContact O-N 3.13Å; E136-N139 PolarHBondContact O-N 3.5Å; S137-N139 VanDerWaalsContact C-N 3.33Å; S137-N139 PolarHBondContact O-N 3.43Å; N139-K143 WeakPolarHBondContact O-CB 3.33Å; N139-K143 WeakPolarHBondContact O-CG 3.39Å; N139-K143 PolarHBondContact O-N 3.02Å; N139-K143 WeakPolarHBondContact OD1-CD 3.47Å; N139-K143 WeakPolarHBondContact OD1-CE 3.4Å; N139-K143 PolarHBondContact OD1-NZ 2.93Å |
| 140 | L | 77.6 | Confident | 75.7 | Confident | 104 Ų | 104 | 104.9 Ų | 104.9 | 55% | 0.545 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -62.1 | -46.1 | 173.8 | -91.6 | 138.9 | 0 | 0 | 0 | 111.7 | E136 S137 K143 Q144 | E136-L140 WeakPolarHBondContact O-CD1 3.34Å; E136-L140 PolarHBondContact O-N 2.99Å; S137-L140 WeakPolarHBondContact O-CB 3.37Å; S137-L140 PolarHBondContact O-N 3.28Å; L140-K143 PolarHBondContact O-N 2.92Å; L140-Q144 WeakPolarHBondContact O-CG 3.47Å; L140-Q144 PolarHBondContact O-N 3.2Å |
| 141 | E | 76.1 | Confident | 73.9 | Confident | 129 Ų | 129 | 105.8 Ų | 105.8 | 60% | 0.603 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -63.7 | -43.1 | 177.2 | -170 | 177.3 | -173.8 | 0 | 0 | 111.8 | S137 Q138 K143 Q144 N145 | S137-E141 PolarHBondContact O-N 3.15Å; Q138-E141 PolarHBondContact O-N 3.38Å; E141-K143 PolarHBondContact O-N 3.03Å; E141-Q144 PolarHBondContact O-N 2.9Å; E141-N145 WeakPolarHBondContact O-CB 3.39Å; E141-N145 PolarHBondContact O-N 2.96Å |
| 142 | A | 75.7 | Confident | 71.9 | Confident | 54 Ų | 54 | 105 Ų | 105 | 45% | 0.446 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -62.3 | -41.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q138 N145 E146 | Q138-A142 WeakPolarHBondContact O-CB 3.46Å; Q138-A142 PolarHBondContact O-N 3.33Å; A142-N145 PolarHBondContact O-N 3.38Å; A142-E146 PolarHBondContact O-N 3.09Å |
| 143 | K | 78.1 | Confident | 69.7 | Low | 125 Ų | 125 | 103.8 Ų | 103.8 | 54% | 0.543 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -65 | -39.9 | 175.1 | -78.7 | 172.5 | 173.1 | 161.9 | 0 | 112.5 | N139 L140 E141 N145 E146 Q147 | N139-K143 WeakPolarHBondContact O-CB 3.33Å; N139-K143 WeakPolarHBondContact O-CG 3.39Å; N139-K143 PolarHBondContact O-N 3.02Å; N139-K143 WeakPolarHBondContact OD1-CD 3.47Å; N139-K143 WeakPolarHBondContact OD1-CE 3.4Å; N139-K143 PolarHBondContact OD1-NZ 2.93Å; L140-K143 PolarHBondContact O-N 2.92Å; E141-K143 PolarHBondContact O-N 3.03Å; K143-N145 VanDerWaalsContact C-N 3.35Å; K143-E146 PolarHBondContact O-N 3.37Å; K143-Q147 WeakPolarHBondContact O-CB 3.46Å; K143-Q147 PolarHBondContact O-N 3.19Å |
| 144 | Q | 71.2 | Confident | 67.4 | Low | 123 Ų | 123 | 104.9 Ų | 104.9 | 58% | 0.575 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -63.4 | -43.2 | 174.3 | -75.2 | 176.7 | -7.4 | 0 | 0 | 110.9 | L140 E141 Q147 E148 | L140-Q144 WeakPolarHBondContact O-CG 3.47Å; L140-Q144 PolarHBondContact O-N 3.2Å; E141-Q144 PolarHBondContact O-N 2.9Å; Q144-Q147 CarbonylContact O-C 3.59Å; Q144-Q147 PolarHBondContact O-N 3.41Å; Q144-E148 WeakPolarHBondContact O-CB 3.25Å; Q144-E148 PolarHBondContact O-N 2.84Å |
| 145 | N | 63.2 | Low | 65 | Low | 88 Ų | 88 | 104.3 Ų | 104.3 | 47% | 0.471 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -67.1 | -37.2 | 177.8 | -167.8 | 43.3 | 0 | 0 | 0 | 112.6 | E141 A142 K143 Q147 E148 L149 | E141-N145 WeakPolarHBondContact O-CB 3.39Å; E141-N145 PolarHBondContact O-N 2.96Å; A142-N145 PolarHBondContact O-N 3.38Å; K143-N145 VanDerWaalsContact C-N 3.35Å; N145-Q147 VanDerWaalsContact C-N 3.32Å; N145-E148 PolarHBondContact O-N 2.95Å; N145-L149 WeakPolarHBondContact O-CB 3.36Å; N145-L149 WeakPolarHBondContact O-CG 3.5Å; N145-L149 PolarHBondContact O-N 3.45Å |
| 146 | E | 61.6 | Low | 62.9 | Low | 134 Ų | 134 | 103.9 Ų | 103.9 | 63% | 0.626 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -63.7 | -37.7 | 170.6 | -82.5 | -175.5 | 161.7 | 0 | 0 | 112.1 | A142 K143 E148 T150 | A142-E146 PolarHBondContact O-N 3.09Å; K143-E146 PolarHBondContact O-N 3.37Å; E146-E148 VanDerWaalsContact C-N 3.33Å; E146-T150 WeakPolarHBondContact O-CB 3.07Å; E146-T150 VanDerWaalsContact O-CG2 3.32Å; E146-T150 WeakPolarHBondContact O-CG2 3.44Å; E146-T150 PolarHBondContact O-N 3.47Å; E146-T150 PolarHBondContact O-OG1 2.95Å |
| 147 | Q | 57.6 | Low | 60.8 | Low | 135 Ų | 135 | 104.2 Ų | 104.2 | 63% | 0.631 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -69.7 | -32.4 | 175.6 | -155.6 | 172.7 | 6.5 | 0 | 0 | 112 | K143 Q144 N145 T150 S151 | K143-Q147 WeakPolarHBondContact O-CB 3.46Å; K143-Q147 PolarHBondContact O-N 3.19Å; Q144-Q147 CarbonylContact O-C 3.59Å; Q144-Q147 PolarHBondContact O-N 3.41Å; N145-Q147 VanDerWaalsContact C-N 3.32Å; Q147-T150 WeakPolarHBondContact CA-OG1 3.49Å; Q147-T150 PolarHBondContact O-OG1 2.92Å; Q147-S151 WeakPolarHBondContact O-CB 3.47Å; Q147-S151 PolarHBondContact O-N 3.37Å; Q147-S151 PolarHBondContact O-OG 3.48Å |
| 148 | E | 55 | Low | 58.7 | Low | 127 Ų | 127 | 105.8 Ų | 105.8 | 59% | 0.593 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -76.4 | -36.7 | 175.4 | -164.7 | 168.7 | -177.4 | 0 | 0 | 112.2 | Q144 N145 E146 S151 T152 | Q144-E148 WeakPolarHBondContact O-CB 3.25Å; Q144-E148 PolarHBondContact O-N 2.84Å; N145-E148 PolarHBondContact O-N 2.95Å; E146-E148 VanDerWaalsContact C-N 3.33Å; E148-S151 PolarHBondContact O-N 3.04Å; E148-T152 PolarHBondContact O-N 3.4Å; E148-T152 PolarHBondContact O-OG1 2.91Å |
| 149 | L | 52.3 | Low | 56.5 | Low | 100 Ų | 100 | 106.5 Ų | 106.5 | 52% | 0.524 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -68.4 | -36.1 | 172.6 | -79 | 161.8 | 0 | 0 | 0 | 112.2 | N145 S151 T152 A153 | N145-L149 WeakPolarHBondContact O-CB 3.36Å; N145-L149 WeakPolarHBondContact O-CG 3.5Å; N145-L149 PolarHBondContact O-N 3.45Å; L149-S151 VanDerWaalsContact C-N 3.33Å; L149-T152 WeakPolarHBondContact CA-OG1 3.06Å; L149-T152 PolarHBondContact O-N 2.79Å; L149-T152 PolarHBondContact O-OG1 3.48Å; L149-A153 WeakPolarHBondContact O-CB 3.42Å; L149-A153 PolarHBondContact O-N 2.93Å |
| 150 | T | 54.4 | Low | 54.3 | Low | 95 Ų | 95 | 107 Ų | 107 | 58% | 0.583 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -72.4 | -27.3 | 171.6 | 51.7 | 0 | 0 | 0 | 0 | 112.4 | E146 Q147 | E146-T150 WeakPolarHBondContact O-CB 3.07Å; E146-T150 VanDerWaalsContact O-CG2 3.32Å; E146-T150 WeakPolarHBondContact O-CG2 3.44Å; E146-T150 PolarHBondContact O-N 3.47Å; E146-T150 PolarHBondContact O-OG1 2.95Å; Q147-T150 WeakPolarHBondContact CA-OG1 3.49Å; Q147-T150 PolarHBondContact O-OG1 2.92Å |
| 151 | S | 52.2 | Low | 52.4 | Low | 83 Ų | 83 | 110 Ų | 110 | 58% | 0.58 | 64% | 0.639 | S | S | * | * | H | α-helix | trans | -77.5 | -30.4 | 173.3 | -59.5 | 0 | 0 | 0 | 0 | 113 | Q147 E148 L149 | Q147-S151 WeakPolarHBondContact O-CB 3.47Å; Q147-S151 PolarHBondContact O-N 3.37Å; Q147-S151 PolarHBondContact O-OG 3.48Å; E148-S151 PolarHBondContact O-N 3.04Å; L149-S151 VanDerWaalsContact C-N 3.33Å |
| 152 | T | 49 | Very low | 50.4 | Low | 100 Ų | 100 | 111 Ų | 111 | 61% | 0.613 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -88.3 | -24 | 179.1 | 43.2 | 0 | 0 | 0 | 0 | 113.9 | E148 L149 S154 | E148-T152 PolarHBondContact O-N 3.4Å; E148-T152 PolarHBondContact O-OG1 2.91Å; L149-T152 WeakPolarHBondContact CA-OG1 3.06Å; L149-T152 PolarHBondContact O-N 2.79Å; L149-T152 PolarHBondContact O-OG1 3.48Å; T152-S154 VanDerWaalsContact C-N 3.33Å |
| 153 | A | 45.6 | Very low | 48.9 | Very low | 84 Ų | 84 | 116.5 Ų | 116.5 | 69% | 0.694 | 66% | 0.659 | S | S | * | * | S | Bend | trans | -80.5 | -10.5 | 170.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | L149 S155 | L149-A153 WeakPolarHBondContact O-CB 3.42Å; L149-A153 PolarHBondContact O-N 2.93Å; A153-S155 PolarHBondContact O-N 2.97Å |
| 154 | S | 38 | Very low | 47.4 | Very low | 95 Ų | 95 | 115.9 Ų | 115.9 | 66% | 0.664 | 67% | 0.669 | S | S | * | * | S | Bend | trans | -85.4 | 41.7 | -179.6 | -158.6 | 0 | 0 | 0 | 0 | 113.8 | T152 | T152-S154 VanDerWaalsContact C-N 3.33Š|
| 155 | S | 37.4 | Very low | 45.5 | Very low | 105 Ų | 105 | 113 Ų | 113 | 73% | 0.734 | 67% | 0.671 | S | S | * | * | trans | -146.4 | 55.4 | 170.7 | -77.5 | 0 | 0 | 0 | 0 | 112.1 | A153 | A153-S155 PolarHBondContact O-N 2.97Š| ||
| 156 | T | 42.3 | Very low | 44.5 | Very low | 136 Ų | 136 | 117.1 Ų | 117.1 | 83% | 0.834 | 69% | 0.693 | S | S | * | * | S | Bend | trans | -148.6 | 98.1 | 150.8 | -52.2 | 0 | 0 | 0 | 0 | 110.6 | ||
| 157 | S | 42.9 | Very low | 43.5 | Very low | 106 Ų | 106 | 118 Ų | 118 | 74% | 0.741 | 70% | 0.703 | S | S | * | * | trans | 25.4 | 105.7 | 152 | -163.5 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 158 | C | 36.8 | Very low | 42.8 | Very low | 106 Ų | 106 | 118.4 Ų | 118.4 | 72% | 0.716 | 71% | 0.709 | S | S | * | * | trans | -30.5 | 129.3 | 146.7 | 178.7 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 159 | C | 38.3 | Very low | 42 | Very low | 123 Ų | 123 | 120.2 Ų | 120.2 | 83% | 0.831 | 72% | 0.717 | S | S | * | * | trans | -146.1 | 118.6 | 144.5 | -89.4 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 160 | C | 34.1 | Very low | 41.6 | Very low | 96 Ų | 96 | 123.6 Ų | 123.6 | 65% | 0.649 | 73% | 0.73 | S | S | * | * | trans | -37.9 | 154.5 | 173.7 | -43.9 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 161 | H | 39.3 | Very low | 40.7 | Very low | 165 Ų | 165 | 127 Ų | 127 | 76% | 0.764 | 74% | 0.739 | S | S | * | * | 175.2 | 116.4 | 119.6 | -92 | 78 | 0 | 0 | 0 | 110 | |||||
| 162 | H | 34.1 | Very low | 39.8 | Very low | 150 Ų | 150 | 130.5 Ų | 130.5 | 69% | 0.694 | 75% | 0.75 | S | S | * | * | trans | 38.7 | 122.8 | 140.1 | -61 | 82.4 | 0 | 0 | 0 | 119.5 | ||||
| 163 | H | 44.1 | Very low | 39.3 | Very low | 170 Ų | 170 | 134.7 Ų | 134.7 | 79% | 0.787 | 76% | 0.762 | S | S | * | * | 174.3 | 174.9 | 85.6 | -114.4 | -43.8 | 0 | 0 | 0 | 111.4 | |||||
| 164 | P | 45.7 | Very low | 38.6 | Very low | 113 Ų | 113 | 138.6 Ų | 138.6 | 73% | 0.734 | 77% | 0.766 | S | S | * | * | trans | -115.8 | 171.1 | -135.5 | 38.4 | -19.4 | 0 | 0 | 0 | 114 | ||||
| 165 | G | 32.3 | Very low | 38.4 | Very low | 61 Ų | 61 | 138.5 Ų | 138.5 | 63% | 0.629 | 77% | 0.771 | S | S | * | * | trans | 91.1 | 98.1 | 154.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 166 | D | 41.2 | Very low | 38.3 | Very low | 175 Ų | 175 | 142.7 Ų | 142.7 | 94% | 0.936 | 78% | 0.779 | S | S | * | * | -168.7 | 87.9 | 126.7 | -86.2 | -24.6 | 0 | 0 | 0 | 106.2 | |||||
| 167 | D | 40.5 | Very low | 37.8 | Very low | 154 Ų | 154 | 145.7 Ų | 145.7 | 82% | 0.824 | 78% | 0.781 | S | S | * | * | trans | -78.6 | 154.8 | 175 | -84.8 | -46 | 0 | 0 | 0 | 111.1 | ||||
| 168 | D | 42.7 | Very low | 37.5 | Very low | 142 Ų | 142 | 147.2 Ų | 147.2 | 76% | 0.759 | 79% | 0.786 | S | S | * | * | trans | 87.8 | 80.8 | 165.5 | -61.3 | -28.3 | 0 | 0 | 0 | 119.2 | ||||
| 169 | H | 39.6 | Very low | 37.3 | Very low | 165 Ų | 165 | 152 Ų | 152 | 76% | 0.764 | 79% | 0.794 | S | S | * | * | 22.8 | 123.3 | 116.5 | -74.6 | -79.3 | 0 | 0 | 0 | 118.1 | |||||
| 170 | H | 42.6 | Very low | 37.2 | Very low | 171 Ų | 171 | 155 Ų | 155 | 79% | 0.792 | 80% | 0.796 | S | S | * | * | -177.1 | 120.2 | 103.4 | -98.3 | -68.3 | 0 | 0 | 0 | 114.5 | |||||
| 171 | H | 35.9 | Very low | 37.4 | Very low | 168 Ų | 168 | 159.4 Ų | 159.4 | 78% | 0.778 | 80% | 0.804 | S | S | * | * | trans | 57.8 | 104.8 | 138.5 | -100.1 | -48.5 | 0 | 0 | 0 | 122.7 | ||||
| 172 | L | 34.2 | Very low | 36.9 | Very low | 155 Ų | 155 | 156.8 Ų | 156.8 | 81% | 0.812 | 80% | 0.8 | S | S | * | * | trans | -41.9 | 135.9 | 136.7 | -69.4 | 158.1 | 0 | 0 | 0 | 112.8 | ||||
| 173 | H | 38.2 | Very low | 37.3 | Very low | 189 Ų | 189 | 154.8 Ų | 154.8 | 88% | 0.875 | 80% | 0.798 | S | S | * | * | trans | -140.4 | 132.8 | 137.7 | -141.1 | -79 | 0 | 0 | 0 | 110.4 | ||||
| 174 | E | 30.9 | Very low | 36.9 | Very low | 166 Ų | 166 | 153.2 Ų | 153.2 | 78% | 0.776 | 80% | 0.795 | S | S | * | * | trans | -79.8 | 159.4 | -170.1 | -62.4 | 177.6 | 130.8 | 0 | 0 | 114.3 | ||||
| 175 | A | 33.1 | Very low | 36.5 | Very low | 93 Ų | 93 | 154.4 Ų | 154.4 | 77% | 0.769 | 80% | 0.796 | S | S | * | * | trans | 65.2 | 90.7 | 138.4 | 0 | 0 | 0 | 0 | 0 | 120 | ||||
| 176 | E | 35.1 | Very low | 36.7 | Very low | 193 Ų | 193 | 156.4 Ų | 156.4 | 90% | 0.902 | 80% | 0.8 | S | S | * | * | trans | -101.1 | 85.5 | 150.3 | -75.9 | -166.8 | 149.2 | 0 | 0 | 111.5 | T178 | E176-T178 PolarHBondContact O-N 3.32Š| ||
| 177 | K | 32.6 | Very low | 36.6 | Very low | 199 Ų | 199 | 156.2 Ų | 156.2 | 87% | 0.865 | 80% | 0.796 | S | S | * | * | trans | 20.2 | 87.1 | 131.7 | -143.8 | 172.4 | -168.8 | 175.6 | 0 | 116.6 | K179 | K177-K179 PolarHBondContact O-N 3.46Š| ||
| 178 | T | 35 | Very low | 36.7 | Very low | 138 Ų | 138 | 158.4 Ų | 158.4 | 85% | 0.847 | 80% | 0.798 | S | S | * | * | trans | -75.5 | 115 | 163.8 | 41.3 | 0 | 0 | 0 | 0 | 110 | E176 E180 | E176-T178 PolarHBondContact O-N 3.32Å; T178-E180 PolarHBondContact O-N 3.28Å; T178-E180 VanDerWaalsContact O-N 3.17Å | ||
| 179 | K | 34.5 | Very low | 36.4 | Very low | 205 Ų | 205 | 158.6 Ų | 158.6 | 89% | 0.891 | 80% | 0.799 | S | S | * | * | trans | -63.5 | 106.2 | 178.2 | -77.3 | 171.3 | 174.9 | 171.5 | 0 | 110.9 | K177 K181 | K177-K179 PolarHBondContact O-N 3.46Å; K179-K181 PolarHBondContact O-N 3.41Å | ||
| 180 | E | 34.9 | Very low | 36.4 | Very low | 187 Ų | 187 | 155.1 Ų | 155.1 | 87% | 0.874 | 79% | 0.793 | S | S | * | * | trans | -71.9 | 116.7 | 160.7 | -166.1 | 166.6 | -170.4 | 0 | 0 | 108.5 | T178 T182 | T178-E180 PolarHBondContact O-N 3.28Å; T178-E180 VanDerWaalsContact O-N 3.17Å; E180-T182 PolarHBondContact O-N 2.92Å | ||
| 181 | K | 38.1 | Very low | 36.1 | Very low | 188 Ų | 188 | 154.7 Ų | 154.7 | 82% | 0.817 | 80% | 0.796 | S | S | * | * | trans | -84.2 | 95 | -175.3 | -168.5 | 172.1 | -176.3 | 178.3 | 0 | 108.6 | K179 V183 | K179-K181 PolarHBondContact O-N 3.41Å; K181-V183 PolarHBondContact O-N 3.24Å; K181-V183 VanDerWaalsContact O-N 3.15Å | ||
| 182 | T | 30.1 | Very low | 36.2 | Very low | 111 Ų | 111 | 153.1 Ų | 153.1 | 68% | 0.681 | 79% | 0.793 | S | S | * | * | trans | -60 | 109.2 | 165.4 | -43.2 | 0 | 0 | 0 | 0 | 108.6 | E180 D184 | E180-T182 PolarHBondContact O-N 2.92Å; T182-D184 PolarHBondContact O-N 3.45Å | ||
| 183 | V | 40.9 | Very low | 36.4 | Very low | 107 Ų | 107 | 152 Ų | 152 | 65% | 0.648 | 79% | 0.787 | S | S | * | * | trans | -90.5 | 93 | 167.2 | 178.5 | 0 | 0 | 0 | 0 | 106.4 | K181 N185 | K181-V183 PolarHBondContact O-N 3.24Å; K181-V183 VanDerWaalsContact O-N 3.15Å; V183-N185 WeakPolarHBondContact CG1-OD1 3.43Å; V183-N185 PolarHBondContact O-N 3.4Å | ||
| 184 | D | 37.3 | Very low | 36.6 | Very low | 137 Ų | 137 | 150.6 Ų | 150.6 | 73% | 0.733 | 78% | 0.78 | S | S | * | * | trans | -67 | 95 | 166.5 | -76.5 | -39.7 | 0 | 0 | 0 | 108.6 | T182 S186 | T182-D184 PolarHBondContact O-N 3.45Å; D184-S186 PolarHBondContact O-N 2.99Å | ||
| 185 | N | 36.9 | Very low | 37 | Very low | 139 Ų | 139 | 149.8 Ų | 149.8 | 74% | 0.743 | 78% | 0.776 | S | S | * | * | trans | -73.6 | 80.6 | 161.9 | -81.2 | 5.5 | 0 | 0 | 0 | 108.1 | V183 M187 | V183-N185 WeakPolarHBondContact CG1-OD1 3.43Å; V183-N185 PolarHBondContact O-N 3.4Å; N185-M187 PolarHBondContact O-N 3.1Å | ||
| 186 | S | 35.9 | Very low | 37.2 | Very low | 102 Ų | 102 | 151.2 Ų | 151.2 | 71% | 0.713 | 77% | 0.771 | S | S | * | * | trans | -65.8 | 88.7 | 160.8 | -179.3 | 0 | 0 | 0 | 0 | 108 | D184 K188 | D184-S186 PolarHBondContact O-N 2.99Å; S186-K188 PolarHBondContact O-N 2.86Å; S186-K188 VanDerWaalsContact O-N 3.15Å | ||
| 187 | M | 40.3 | Very low | 37.4 | Very low | 172 Ų | 172 | 147.4 Ų | 147.4 | 85% | 0.847 | 76% | 0.757 | S | S | * | * | trans | -67.4 | 105.1 | 162.5 | -91.6 | 175.7 | 159.5 | 0 | 0 | 106.8 | N185 D189 | N185-M187 PolarHBondContact O-N 3.1Å; M187-D189 PolarHBondContact O-N 2.94Å; M187-D189 VanDerWaalsContact O-N 3.13Å | ||
| 188 | K | 41.3 | Very low | 37.9 | Very low | 200 Ų | 200 | 143.7 Ų | 143.7 | 87% | 0.87 | 75% | 0.747 | S | S | * | * | trans | -62.7 | 110.8 | 170.3 | -80.7 | 173.8 | 175.4 | 176.6 | 0 | 108.6 | S186 | S186-K188 PolarHBondContact O-N 2.86Å; S186-K188 VanDerWaalsContact O-N 3.15Å | ||
| 189 | D | 37.1 | Very low | 38.4 | Very low | 146 Ų | 146 | 143 Ų | 143 | 78% | 0.781 | 74% | 0.738 | S | S | * | * | trans | -61.4 | 135.6 | 168.9 | -78.9 | -45.3 | 0 | 0 | 0 | 111.5 | M187 | M187-D189 PolarHBondContact O-N 2.94Å; M187-D189 VanDerWaalsContact O-N 3.13Å | ||
| 190 | S | 40 | Very low | 38.6 | Very low | 92 Ų | 92 | 140.2 Ų | 140.2 | 64% | 0.643 | 73% | 0.733 | S | S | * | * | trans | 60.4 | 91.4 | 139.4 | -55.4 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 191 | N | 34.8 | Very low | 38.9 | Very low | 161 Ų | 161 | 136.6 Ų | 136.6 | 86% | 0.861 | 72% | 0.723 | S | S | * | * | trans | -101.7 | 91.7 | 137.6 | -109.1 | -14.2 | 0 | 0 | 0 | 108.7 | I193 | N191-I193 VanDerWaalsContact C-N 3.33Å; N191-I193 PolarHBondContact O-N 2.81Å; N191-I193 VanDerWaalsContact O-N 3.08Å | ||
| 192 | L | 39.5 | Very low | 38.8 | Very low | 135 Ų | 135 | 134.5 Ų | 134.5 | 71% | 0.707 | 72% | 0.721 | S | S | * | * | trans | -70.6 | 86.2 | 170.5 | -147 | 85.7 | 0 | 0 | 0 | 107.4 | H194 | L192-H194 PolarHBondContact O-N 3.28Š| ||
| 193 | I | 38.1 | Very low | 39.4 | Very low | 132 Ų | 132 | 136.7 Ų | 136.7 | 68% | 0.677 | 73% | 0.728 | S | S | * | * | trans | -79.5 | 81.5 | 168.9 | -57.2 | -179.4 | 0 | 0 | 0 | 107.2 | N191 Q195 | N191-I193 VanDerWaalsContact C-N 3.33Å; N191-I193 PolarHBondContact O-N 2.81Å; N191-I193 VanDerWaalsContact O-N 3.08Å; I193-Q195 VanDerWaalsContact C-N 3.34Å; I193-Q195 HydrophobicContact CG2-CB 4.15Å; I193-Q195 HydrophobicContact CG2-CG 3.87Å; I193-Q195 PolarHBondContact O-N 2.89Å | ||
| 194 | H | 41.5 | Very low | 39.1 | Very low | 159 Ų | 159 | 137.6 Ų | 137.6 | 74% | 0.736 | 73% | 0.729 | S | S | * | * | trans | -67.5 | 97.1 | 151.8 | -101.8 | -58.9 | 0 | 0 | 0 | 106.9 | L192 | L192-H194 PolarHBondContact O-N 3.28Š| ||
| 195 | Q | 39.9 | Very low | 39.1 | Very low | 150 Ų | 150 | 136.2 Ų | 136.2 | 70% | 0.701 | 73% | 0.73 | S | S | * | * | trans | -117.7 | 89.4 | 157.7 | -81.5 | -176.4 | -14.8 | 0 | 0 | 108.1 | I193 N197 | I193-Q195 VanDerWaalsContact C-N 3.34Å; I193-Q195 HydrophobicContact CG2-CB 4.15Å; I193-Q195 HydrophobicContact CG2-CG 3.87Å; I193-Q195 PolarHBondContact O-N 2.89Å; Q195-N197 PolarHBondContact O-N 3.22Å; Q195-N197 VanDerWaalsContact O-N 3.09Å | ||
| 196 | N | 36.8 | Very low | 39.1 | Very low | 123 Ų | 123 | 134.9 Ų | 134.9 | 66% | 0.658 | 73% | 0.731 | S | S | * | * | trans | -68.8 | 83.3 | 161.8 | -177.1 | 10.2 | 0 | 0 | 0 | 107.6 | N198 | N196-N198 VanDerWaalsContact C-N 3.27Å; N196-N198 PolarHBondContact O-N 3.44Å | ||
| 197 | N | 41 | Very low | 39 | Very low | 113 Ų | 113 | 136.1 Ų | 136.1 | 60% | 0.604 | 74% | 0.735 | S | S | * | * | trans | -88.4 | 78 | 168.7 | -69.5 | -4.1 | 0 | 0 | 0 | 107.8 | Q195 D199 | Q195-N197 PolarHBondContact O-N 3.22Å; Q195-N197 VanDerWaalsContact O-N 3.09Å; N197-D199 PolarHBondContact O-N 2.96Å | ||
| 198 | N | 42.9 | Very low | 38.8 | Very low | 121 Ų | 121 | 134.4 Ų | 134.4 | 65% | 0.647 | 74% | 0.735 | S | S | * | * | trans | -72 | 72 | 156.1 | -90.7 | -1 | 0 | 0 | 0 | 108 | N196 N200 | N196-N198 VanDerWaalsContact C-N 3.27Å; N196-N198 PolarHBondContact O-N 3.44Å; N198-N200 PolarHBondContact O-N 3.42Å | ||
| 199 | D | 44.4 | Very low | 38.5 | Very low | 124 Ų | 124 | 131.4 Ų | 131.4 | 66% | 0.663 | 73% | 0.728 | S | S | * | * | trans | -80.9 | 79.1 | 164.8 | -71.7 | -32 | 0 | 0 | 0 | 107.7 | N197 T201 | N197-D199 PolarHBondContact O-N 2.96Å; D199-T201 PolarHBondContact O-N 3.47Å | ||
| 200 | N | 39.2 | Very low | 38.2 | Very low | 146 Ų | 146 | 132.4 Ų | 132.4 | 78% | 0.781 | 73% | 0.728 | S | S | * | * | trans | -65.7 | 80.9 | 159.5 | -84.4 | -12.7 | 0 | 0 | 0 | 107.7 | N198 N202 | N198-N200 PolarHBondContact O-N 3.42Å; N200-N202 PolarHBondContact O-N 2.99Å | ||
| 201 | T | 41.6 | Very low | 37.9 | Very low | 111 Ų | 111 | 133.7 Ų | 133.7 | 68% | 0.681 | 74% | 0.737 | S | S | * | * | trans | -75 | 84.9 | 164.1 | 45.1 | 0 | 0 | 0 | 0 | 108 | D199 L203 | D199-T201 PolarHBondContact O-N 3.47Å; T201-L203 PolarHBondContact O-N 2.83Å | ||
| 202 | N | 36 | Very low | 37.6 | Very low | 143 Ų | 143 | 129.9 Ų | 129.9 | 77% | 0.765 | 74% | 0.736 | S | S | * | * | trans | -56.2 | 89.6 | 159 | 179.7 | -7.3 | 0 | 0 | 0 | 108 | N200 N204 | N200-N202 PolarHBondContact O-N 2.99Å; N202-N204 PolarHBondContact O-N 2.99Å; N202-N204 PolarHBondContact OD1-N 3.07Å | ||
| 203 | L | 42 | Very low | 37.3 | Very low | 157 Ų | 157 | 128.6 Ų | 128.6 | 82% | 0.822 | 74% | 0.738 | S | S | * | * | trans | -75.9 | 78.1 | 170 | -71.5 | 172.9 | 0 | 0 | 0 | 107.8 | T201 S205 | T201-L203 PolarHBondContact O-N 2.83Å; L203-S205 PolarHBondContact O-N 3.4Å | ||
| 204 | N | 35.3 | Very low | 37 | Very low | 127 Ų | 127 | 130 Ų | 130 | 68% | 0.679 | 74% | 0.742 | S | S | * | * | trans | -61.2 | 125.4 | 165.7 | -174.1 | 17.2 | 0 | 0 | 0 | 108.7 | N202 S206 | N202-N204 PolarHBondContact O-N 2.99Å; N202-N204 PolarHBondContact OD1-N 3.07Å; N204-S206 PolarHBondContact O-N 2.98Å | ||
| 205 | S | 36.4 | Very low | 36.8 | Very low | 107 Ų | 107 | 127.7 Ų | 127.7 | 75% | 0.748 | 74% | 0.743 | S | S | * | * | trans | -50.2 | 114.4 | -178.8 | -47 | 0 | 0 | 0 | 0 | 111.4 | L203 | L203-S205 PolarHBondContact O-N 3.4Š| ||
| 206 | S | 37.4 | Very low | 36.4 | Very low | 111 Ų | 111 | 127.1 Ų | 127.1 | 78% | 0.776 | 74% | 0.743 | S | S | * | * | trans | -117.6 | 113.2 | 166.2 | -68.2 | 0 | 0 | 0 | 0 | 109.1 | N204 | N204-S206 PolarHBondContact O-N 2.98Š| ||
| 207 | T | 34.3 | Very low | 36.2 | Very low | 128 Ų | 128 | 127.6 Ų | 127.6 | 79% | 0.785 | 75% | 0.746 | S | S | * | * | trans | -46.1 | 121.3 | -178.1 | -38.6 | 0 | 0 | 0 | 0 | 113 | N209 | T207-N209 PolarHBondContact O-N 3.07Š| ||
| 208 | T | 35 | Very low | 35.7 | Very low | 137 Ų | 137 | 128.3 Ų | 128.3 | 84% | 0.84 | 76% | 0.755 | S | S | * | * | trans | -73.6 | 110.8 | 173 | -48.9 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 209 | N | 35.8 | Very low | 35.2 | Very low | 136 Ų | 136 | 130.6 Ų | 130.6 | 73% | 0.727 | 76% | 0.761 | S | S | * | * | trans | -88.9 | 111.2 | 163.9 | -79.7 | -31.7 | 0 | 0 | 0 | 109.8 | T207 | T207-N209 PolarHBondContact O-N 3.07Š| ||
| 210 | Q | 31.1 | Very low | 34.8 | Very low | 167 Ų | 167 | 133.8 Ų | 133.8 | 78% | 0.78 | 77% | 0.769 | S | S | * | * | trans | 45.3 | 137 | 135 | -60.2 | -175.7 | 11.9 | 0 | 0 | 121.7 | ||||
| 211 | S | 32.3 | Very low | 34.6 | Very low | 119 Ų | 119 | 133.3 Ų | 133.3 | 83% | 0.832 | 77% | 0.772 | S | S | * | * | trans | 97.6 | 113.6 | 146.2 | -47 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 212 | G | 30.2 | Very low | 34.3 | Very low | 81 Ų | 81 | 135.5 Ų | 135.5 | 84% | 0.835 | 78% | 0.779 | S | S | * | * | trans | 170.2 | 78 | 169.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | ||||
| 213 | S | 32.4 | Very low | 34.1 | Very low | 108 Ų | 108 | 132.2 Ų | 132.2 | 76% | 0.755 | 78% | 0.779 | S | S | * | * | trans | -47.5 | 146.8 | -178.6 | -50.8 | 0 | 0 | 0 | 0 | 117 | ||||
| 214 | H | 31.6 | Very low | 33.8 | Very low | 163 Ų | 163 | 131.4 Ų | 131.4 | 76% | 0.755 | 78% | 0.776 | S | S | * | * | trans | 59.9 | 111.8 | 138.9 | -79.8 | 43.7 | 0 | 0 | 0 | 118.1 | ||||
| 215 | S | 37.5 | Very low | 33.9 | Very low | 110 Ų | 110 | 131.4 Ų | 131.4 | 77% | 0.769 | 78% | 0.78 | S | S | * | * | -155.7 | 109.3 | 128.6 | -80.7 | 0 | 0 | 0 | 0 | 109.6 | N217 | S215-N217 PolarHBondContact O-N 2.85Š| |||
| 216 | I | 30.9 | Very low | 33.8 | Very low | 138 Ų | 138 | 132.8 Ų | 132.8 | 71% | 0.708 | 78% | 0.775 | S | S | * | * | trans | -75.6 | 97 | 170.8 | -51.7 | 161 | 0 | 0 | 0 | 105.6 | ||||
| 217 | N | 33.6 | Very low | 33.6 | Very low | 132 Ų | 132 | 134.4 Ų | 134.4 | 71% | 0.706 | 77% | 0.774 | S | S | * | * | trans | -110.9 | 91.4 | 167.5 | -85.1 | -7.3 | 0 | 0 | 0 | 108.8 | S215 H219 | S215-N217 PolarHBondContact O-N 2.85Å; N217-H219 VanDerWaalsContact C-N 3.3Å; N217-H219 PolarHBondContact O-N 2.81Å | ||
| 218 | T | 30.7 | Very low | 33.6 | Very low | 129 Ų | 129 | 138.2 Ų | 138.2 | 79% | 0.791 | 78% | 0.775 | S | S | * | * | trans | -61.5 | 91 | 158.2 | 45.8 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 219 | H | 32.6 | Very low | 33.5 | Very low | 169 Ų | 169 | 136.9 Ų | 136.9 | 78% | 0.782 | 77% | 0.767 | S | S | * | * | trans | -87.8 | 116.9 | 162.1 | -96.8 | -80.5 | 0 | 0 | 0 | 108.9 | N217 | N217-H219 VanDerWaalsContact C-N 3.3Å; N217-H219 PolarHBondContact O-N 2.81Å | ||
| 220 | K | 34.4 | Very low | 33.3 | Very low | 190 Ų | 190 | 135.1 Ų | 135.1 | 83% | 0.826 | 77% | 0.771 | S | S | * | * | trans | -52 | 135.7 | 171.6 | -75.6 | 173.9 | 173.6 | 176.8 | 0 | 110 | D222 | K220-D222 PolarHBondContact O-N 3.15Å; K220-D222 VanDerWaalsContact O-N 3.15Å | ||
| 221 | T | 36.3 | Very low | 33.4 | Very low | 137 Ų | 137 | 132.9 Ų | 132.9 | 84% | 0.84 | 77% | 0.77 | S | S | * | * | trans | -63.9 | 99.2 | 171 | 49.7 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 222 | D | 34 | Very low | 33.3 | Very low | 156 Ų | 156 | 136.3 Ų | 136.3 | 83% | 0.834 | 77% | 0.769 | S | S | * | * | trans | -82.6 | 115.3 | 156.6 | -77.1 | -30.7 | 0 | 0 | 0 | 107.2 | K220 N224 | K220-D222 PolarHBondContact O-N 3.15Å; K220-D222 VanDerWaalsContact O-N 3.15Å; D222-N224 PolarHBondContact O-N 3.17Å | ||
| 223 | G | 33.2 | Very low | 33.6 | Very low | 75 Ų | 75 | 138 Ų | 138 | 77% | 0.773 | 76% | 0.764 | S | S | * | * | trans | -57.7 | 106.1 | -176.1 | 0 | 0 | 0 | 0 | 0 | 111.4 | V225 | G223-V225 PolarHBondContact O-N 3.39Š| ||
| 224 | N | 34.9 | Very low | 33.6 | Very low | 139 Ų | 139 | 138.6 Ų | 138.6 | 74% | 0.743 | 76% | 0.763 | S | S | * | * | trans | -81.3 | 101.2 | 164.7 | -168.5 | 28.5 | 0 | 0 | 0 | 107.6 | D222 E226 | D222-N224 PolarHBondContact O-N 3.17Å; N224-E226 PolarHBondContact O-N 2.7Å | ||
| 225 | V | 36.9 | Very low | 33.7 | Very low | 127 Ų | 127 | 138.3 Ų | 138.3 | 77% | 0.77 | 77% | 0.765 | S | S | * | * | trans | -67.2 | 98 | 168.6 | 174.3 | 0 | 0 | 0 | 0 | 106.8 | G223 L227 | G223-V225 PolarHBondContact O-N 3.39Å; V225-L227 PolarHBondContact O-N 3.5Å | ||
| 226 | E | 35.2 | Very low | 33.4 | Very low | 137 Ų | 137 | 135.8 Ų | 135.8 | 64% | 0.64 | 76% | 0.757 | S | S | * | * | trans | -63.9 | 102.1 | 172.9 | -75.1 | -175 | 163.7 | 0 | 0 | 109.7 | N224 Y228 | N224-E226 PolarHBondContact O-N 2.7Å; E226-Y228 PolarHBondContact O-N 3.01Å; E226-Y228 VanDerWaalsContact O-N 3.11Å | ||
| 227 | L | 32.9 | Very low | 33.4 | Very low | 144 Ų | 144 | 139.1 Ų | 139.1 | 75% | 0.754 | 77% | 0.766 | S | S | * | * | trans | -73.7 | 96 | 171.1 | -167.3 | 81.6 | 0 | 0 | 0 | 108.3 | V225 T229 | V225-L227 PolarHBondContact O-N 3.5Å; L227-T229 HydrophobicContact CD2-CG2 3.98Å; L227-T229 HydrophobicContact CG-CG2 4.33Å; L227-T229 PolarHBondContact O-N 3.44Å | ||
| 228 | Y | 33.3 | Very low | 33.3 | Very low | 208 Ų | 208 | 138.7 Ų | 138.7 | 82% | 0.816 | 77% | 0.773 | S | S | * | * | trans | -57.5 | 98.3 | 168.2 | -74.9 | -91.8 | 0 | 0 | 0 | 109.9 | E226 A230 | E226-Y228 PolarHBondContact O-N 3.01Å; E226-Y228 VanDerWaalsContact O-N 3.11Å; Y228-A230 PolarHBondContact O-N 3.13Å | ||
| 229 | T | 32.6 | Very low | 33.5 | Very low | 109 Ų | 109 | 138 Ų | 138 | 67% | 0.669 | 77% | 0.774 | S | S | * | * | trans | -92.5 | 95.6 | 168.7 | 48 | 0 | 0 | 0 | 0 | 108.9 | L227 T231 | L227-T229 HydrophobicContact CD2-CG2 3.98Å; L227-T229 HydrophobicContact CG-CG2 4.33Å; L227-T229 PolarHBondContact O-N 3.44Å; T229-T231 PolarHBondContact O-N 3.4Å | ||
| 230 | A | 32.9 | Very low | 33.5 | Very low | 99 Ų | 99 | 135.1 Ų | 135.1 | 82% | 0.818 | 77% | 0.772 | S | S | * | * | trans | -67.3 | 98.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | Y228 K232 | Y228-A230 PolarHBondContact O-N 3.13Å; A230-K232 PolarHBondContact O-N 3.34Å; A230-K232 VanDerWaalsContact O-N 3.13Å | ||
| 231 | T | 32.5 | Very low | 33.5 | Very low | 121 Ų | 121 | 132.5 Ų | 132.5 | 74% | 0.742 | 77% | 0.772 | S | S | * | * | trans | -75.2 | 101.1 | 171.7 | -60.3 | 0 | 0 | 0 | 0 | 108.8 | T229 T233 | T229-T231 PolarHBondContact O-N 3.4Å; T231-T233 PolarHBondContact O-N 3.1Å | ||
| 232 | K | 31.3 | Very low | 33.4 | Very low | 191 Ų | 191 | 134.5 Ų | 134.5 | 83% | 0.83 | 77% | 0.772 | S | S | * | * | trans | -76.4 | 83 | 176.1 | -169.2 | 178.8 | -177.3 | 179.6 | 0 | 109.8 | A230 T234 | A230-K232 PolarHBondContact O-N 3.34Å; A230-K232 VanDerWaalsContact O-N 3.13Å; K232-T234 PolarHBondContact O-N 3.15Å; K232-T234 VanDerWaalsContact O-N 3.14Å | ||
| 233 | T | 36.5 | Very low | 33.4 | Very low | 116 Ų | 116 | 133.6 Ų | 133.6 | 71% | 0.712 | 77% | 0.767 | S | S | * | * | trans | -69.3 | 108.9 | 174.2 | -52.4 | 0 | 0 | 0 | 0 | 109.6 | T231 I235 | T231-T233 PolarHBondContact O-N 3.1Å; T233-I235 PolarHBondContact O-N 3.47Å | ||
| 234 | T | 31.7 | Very low | 33.7 | Very low | 121 Ų | 121 | 137.6 Ų | 137.6 | 74% | 0.742 | 77% | 0.766 | S | S | * | * | trans | -79.1 | 113.2 | 175.8 | -61.8 | 0 | 0 | 0 | 0 | 108.8 | K232 G236 | K232-T234 PolarHBondContact O-N 3.15Å; K232-T234 VanDerWaalsContact O-N 3.14Å; T234-G236 PolarHBondContact O-N 3.49Å | ||
| 235 | I | 33.9 | Very low | 33.9 | Very low | 157 Ų | 157 | 140.2 Ų | 140.2 | 81% | 0.805 | 77% | 0.771 | S | S | * | * | trans | -71.2 | 94.3 | 175.1 | -59.5 | 172.1 | 0 | 0 | 0 | 108.1 | T233 K237 | T233-I235 PolarHBondContact O-N 3.47Å; I235-K237 PolarHBondContact O-N 3.09Å | ||
| 236 | G | 31.6 | Very low | 34.1 | Very low | 57 Ų | 57 | 141 Ų | 141 | 59% | 0.588 | 77% | 0.771 | S | S | * | * | trans | -70.3 | 120.1 | 170.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | T234 S238 | T234-G236 PolarHBondContact O-N 3.49Å; G236-S238 PolarHBondContact O-N 2.97Å; G236-S238 VanDerWaalsContact O-N 3.12Å | ||
| 237 | K | 30.2 | Very low | 34.5 | Very low | 208 Ų | 208 | 137.8 Ų | 137.8 | 90% | 0.904 | 76% | 0.763 | S | S | * | * | trans | -72.2 | 95.9 | 173.5 | -71.3 | 174 | 177.3 | 173.9 | 0 | 109.6 | I235 | I235-K237 PolarHBondContact O-N 3.09Š| ||
| 238 | S | 32.6 | Very low | 35.2 | Very low | 122 Ų | 122 | 134.9 Ų | 134.9 | 85% | 0.853 | 75% | 0.754 | S | S | * | * | trans | -92.8 | 113.6 | 168 | -51.8 | 0 | 0 | 0 | 0 | 109.3 | G236 | G236-S238 PolarHBondContact O-N 2.97Å; G236-S238 VanDerWaalsContact O-N 3.12Å | ||
| 239 | S | 33.8 | Very low | 36.4 | Very low | 116 Ų | 116 | 129 Ų | 129 | 81% | 0.811 | 74% | 0.744 | S | S | * | * | trans | -75.8 | 133.1 | 177.5 | 47.5 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 240 | S | 32.5 | Very low | 37.7 | Very low | 107 Ų | 107 | 130 Ų | 130 | 75% | 0.748 | 75% | 0.745 | S | S | * | * | trans | 62.9 | 106.2 | 147.6 | -161.1 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 241 | T | 34.4 | Very low | 39.3 | Very low | 135 Ų | 135 | 127.9 Ų | 127.9 | 83% | 0.828 | 72% | 0.724 | S | S | * | * | -166.5 | 128.7 | 111.1 | 23.3 | 0 | 0 | 0 | 0 | 109.2 | N243 | T241-N243 PolarHBondContact O-N 3.21Å; T241-N243 VanDerWaalsContact O-N 3.11Å | |||
| 242 | H | 33.6 | Very low | 40.8 | Very low | 180 Ų | 180 | 127.6 Ų | 127.6 | 83% | 0.833 | 72% | 0.718 | S | S | * | * | trans | -57.7 | 105.6 | -178.3 | -140.5 | -89.1 | 0 | 0 | 0 | 110 | ||||
| 243 | N | 35 | Very low | 42.7 | Very low | 136 Ų | 136 | 122.9 Ų | 122.9 | 73% | 0.727 | 70% | 0.7 | S | S | * | * | trans | -130.7 | 108.5 | 158.9 | -123.4 | 1.9 | 0 | 0 | 0 | 105.4 | T241 F245 | T241-N243 PolarHBondContact O-N 3.21Å; T241-N243 VanDerWaalsContact O-N 3.11Å; N243-F245 PolarHBondContact O-N 2.93Å | ||
| 244 | E | 39.1 | Very low | 44.3 | Very low | 159 Ų | 159 | 123.7 Ų | 123.7 | 74% | 0.743 | 70% | 0.696 | S | S | * | * | trans | -50.6 | 104.7 | -176.2 | -77.5 | 170.7 | 142.4 | 0 | 0 | 109.9 | N246 | E244-N246 PolarHBondContact O-N 3.32Š| ||
| 245 | F | 40 | Very low | 45.8 | Very low | 194 Ų | 194 | 120.6 Ų | 120.6 | 85% | 0.851 | 68% | 0.679 | S | S | * | * | trans | -64.3 | 85.7 | 161.8 | -90.1 | -95.8 | 0 | 0 | 0 | 107.2 | N243 C247 | N243-F245 PolarHBondContact O-N 2.93Å; F245-C247 PolarHBondContact O-N 2.62Å | ||
| 246 | N | 39.8 | Very low | 48.1 | Very low | 145 Ų | 145 | 116.1 Ų | 116.1 | 78% | 0.775 | 66% | 0.659 | S | S | * | * | trans | -76.2 | 53.3 | 157.1 | -84 | -24.1 | 0 | 0 | 0 | 109.2 | E244 S248 | E244-N246 PolarHBondContact O-N 3.32Å; N246-S248 VanDerWaalsContact C-N 3.27Å; N246-S248 PolarHBondContact O-N 2.74Å | ||
| 247 | C | 43.9 | Very low | 50.2 | Low | 69 Ų | 69 | 117.9 Ų | 117.9 | 47% | 0.466 | 66% | 0.655 | S | S | . | * | S | Bend | trans | -77.6 | 96.8 | 147.2 | -168 | 0 | 0 | 0 | 0 | 102.9 | F245 S249 S251 | F245-C247 PolarHBondContact O-N 2.62Å; C247-S249 PolarHBondContact O-N 3.24Å; C247-S251 PolarHBondContact SG-OG 3Å |
| 248 | S | 48 | Very low | 52.8 | Low | 82 Ų | 82 | 110.3 Ų | 110.3 | 57% | 0.573 | 63% | 0.628 | S | S | * | * | trans | -36.7 | 115.1 | -174.7 | -65.5 | 0 | 0 | 0 | 0 | 109.1 | N246 N250 S251 | N246-S248 VanDerWaalsContact C-N 3.27Å; N246-S248 PolarHBondContact O-N 2.74Å; S248-N250 CarbonylContact O-C 3.57Å; S248-N250 PolarHBondContact O-N 3.46Å; S248-S251 PolarHBondContact O-N 3.38Å; S248-S251 PolarHBondContact O-OG 3.48Å | ||
| 249 | S | 57.8 | Low | 54.8 | Low | 86 Ų | 86 | 109.7 Ų | 109.7 | 60% | 0.601 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -50.5 | -25.9 | -173.4 | -55.4 | 0 | 0 | 0 | 0 | 112.8 | C247 S251 L252 I253 | C247-S249 PolarHBondContact O-N 3.24Å; S249-S251 PolarHBondContact O-N 2.94Å; S249-L252 PolarHBondContact O-N 2.91Å; S249-I253 WeakPolarHBondContact O-CD1 3.43Å; S249-I253 VanDerWaalsContact O-CG1 3.29Å; S249-I253 WeakPolarHBondContact O-CG1 3.37Å; S249-I253 PolarHBondContact O-N 3.11Å |
| 250 | N | 60.4 | Low | 57 | Low | 129 Ų | 129 | 108.3 Ų | 108.3 | 69% | 0.69 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -57.4 | -37.1 | 171.4 | -63.6 | -5.2 | 0 | 0 | 0 | 114.4 | S248 H254 | S248-N250 CarbonylContact O-C 3.57Å; S248-N250 PolarHBondContact O-N 3.46Å; N250-H254 VanDerWaalsContact O-CB 3.28Å; N250-H254 WeakPolarHBondContact O-CB 3.47Å; N250-H254 PolarHBondContact O-N 3.25Å |
| 251 | S | 66.4 | Low | 59.3 | Low | 54 Ų | 54 | 109.3 Ų | 109.3 | 38% | 0.378 | 59% | 0.589 | S | S | . | * | H | α-helix | trans | -73.4 | -34.9 | 178.5 | 74.1 | 0 | 0 | 0 | 0 | 112.2 | C247 S248 S249 C255 | C247-S251 PolarHBondContact SG-OG 3Å; S248-S251 PolarHBondContact O-N 3.38Å; S248-S251 PolarHBondContact O-OG 3.48Å; S249-S251 PolarHBondContact O-N 2.94Å; S251-C255 WeakPolarHBondContact O-CB 3.43Å; S251-C255 PolarHBondContact O-N 3.24Å; S251-C255 PolarHBondContact O-SG 3.25Å |
| 252 | L | 63.9 | Low | 61.3 | Low | 116 Ų | 116 | 106.8 Ų | 106.8 | 61% | 0.607 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -73.6 | -38.9 | 178.6 | -154.3 | 81.2 | 0 | 0 | 0 | 111.7 | S249 C255 T256 | S249-L252 PolarHBondContact O-N 2.91Å; L252-C255 PolarHBondContact O-N 3.36Å; L252-T256 PolarHBondContact O-N 3.29Å; L252-T256 PolarHBondContact O-OG1 3.28Å |
| 253 | I | 71.4 | Confident | 63.6 | Low | 92 Ų | 92 | 105.2 Ų | 105.2 | 47% | 0.472 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -60.5 | -49.5 | 171.8 | -66.9 | 164.7 | 0 | 0 | 0 | 109.3 | S249 C255 T256 D257 | S249-I253 WeakPolarHBondContact O-CD1 3.43Å; S249-I253 VanDerWaalsContact O-CG1 3.29Å; S249-I253 WeakPolarHBondContact O-CG1 3.37Å; S249-I253 PolarHBondContact O-N 3.11Å; I253-C255 VanDerWaalsContact C-N 3.33Å; I253-C255 PolarHBondContact O-N 3.43Å; I253-T256 WeakPolarHBondContact O-CB 3.3Å; I253-T256 PolarHBondContact O-N 2.92Å; I253-D257 PolarHBondContact O-N 2.89Å |
| 254 | H | 69.7 | Low | 66 | Low | 132 Ų | 132 | 103.9 Ų | 103.9 | 61% | 0.611 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -60 | -39.4 | 177.5 | -170.3 | -76.1 | 0 | 0 | 0 | 113.1 | N250 T256 S258 | N250-H254 VanDerWaalsContact O-CB 3.28Å; N250-H254 WeakPolarHBondContact O-CB 3.47Å; N250-H254 PolarHBondContact O-N 3.25Å; H254-T256 VanDerWaalsContact C-N 3.33Å; H254-T256 PolarHBondContact O-N 3.31Å; H254-S258 VanDerWaalsContact O-CB 3.25Å; H254-S258 WeakPolarHBondContact O-CB 3.27Å; H254-S258 PolarHBondContact O-N 2.96Å |
| 255 | C | 64.7 | Low | 68.2 | Low | 57 Ų | 57 | 100.1 Ų | 100.1 | 39% | 0.385 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -64.9 | -36.8 | 174.2 | -76.2 | 0 | 0 | 0 | 0 | 112.5 | S251 L252 I253 M259 | S251-C255 WeakPolarHBondContact O-CB 3.43Å; S251-C255 PolarHBondContact O-N 3.24Å; S251-C255 PolarHBondContact O-SG 3.25Å; L252-C255 PolarHBondContact O-N 3.36Å; I253-C255 VanDerWaalsContact C-N 3.33Å; I253-C255 PolarHBondContact O-N 3.43Å; C255-M259 WeakPolarHBondContact O-CB 3.34Å; C255-M259 PolarHBondContact O-N 2.87Å |
| 256 | T | 80.4 | Confident | 70 | Confident | 63 Ų | 63 | 94.4 Ų | 94.4 | 39% | 0.387 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -69.3 | -44.4 | 179.1 | -56.4 | 0 | 0 | 0 | 0 | 110.6 | L252 I253 H254 M259 N260 | L252-T256 PolarHBondContact O-N 3.29Å; L252-T256 PolarHBondContact O-OG1 3.28Å; I253-T256 WeakPolarHBondContact O-CB 3.3Å; I253-T256 PolarHBondContact O-N 2.92Å; H254-T256 VanDerWaalsContact C-N 3.33Å; H254-T256 PolarHBondContact O-N 3.31Å; T256-M259 PolarHBondContact O-N 3.42Å; T256-N260 VanDerWaalsContact O-CG 3.25Å; T256-N260 PolarHBondContact O-N 2.99Å; T256-N260 PolarHBondContact O-ND2 3.23Å; T256-N260 VanDerWaalsContact O-ND2 3.14Å |
| 257 | D | 75.8 | Confident | 72.1 | Confident | 94 Ų | 94 | 90.1 Ų | 90.1 | 50% | 0.503 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.7 | -45.6 | 177.8 | -66.1 | -20.8 | 0 | 0 | 0 | 110.9 | I253 M259 N260 E261 | I253-D257 PolarHBondContact O-N 2.89Å; D257-M259 PolarHBondContact O-N 3.42Å; D257-N260 PolarHBondContact O-N 3.28Å; D257-N260 VanDerWaalsContact O-N 3.14Å; D257-E261 PolarHBondContact O-N 3.42Å |
| 258 | S | 84.7 | Confident | 74.2 | Confident | 49 Ų | 49 | 90.4 Ų | 90.4 | 34% | 0.343 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -64.5 | -37.2 | 178.7 | -165.5 | 0 | 0 | 0 | 0 | 112.9 | H254 E261 L262 | H254-S258 VanDerWaalsContact O-CB 3.25Å; H254-S258 WeakPolarHBondContact O-CB 3.27Å; H254-S258 PolarHBondContact O-N 2.96Å; S258-E261 PolarHBondContact O-N 2.89Å; S258-L262 WeakPolarHBondContact O-CG 3.47Å; S258-L262 PolarHBondContact O-N 2.93Å |
| 259 | M | 76.4 | Confident | 76.1 | Confident | 108 Ų | 108 | 89.6 Ų | 89.6 | 53% | 0.532 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -65.3 | -39.4 | 171.6 | -98.6 | -165.8 | -55.4 | 0 | 0 | 113 | C255 T256 D257 E261 K263 | C255-M259 WeakPolarHBondContact O-CB 3.34Å; C255-M259 PolarHBondContact O-N 2.87Å; T256-M259 PolarHBondContact O-N 3.42Å; D257-M259 PolarHBondContact O-N 3.42Å; M259-E261 VanDerWaalsContact C-N 3.34Å; M259-K263 WeakPolarHBondContact O-CG 3.33Å; M259-K263 PolarHBondContact O-N 3.34Å |
| 260 | N | 79.4 | Confident | 77.6 | Confident | 87 Ų | 87 | 92 Ų | 92 | 47% | 0.465 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -68.9 | -37.8 | 179.4 | -71 | -30.7 | 0 | 0 | 0 | 110.9 | T256 D257 K263 L264 | T256-N260 VanDerWaalsContact O-CG 3.25Å; T256-N260 PolarHBondContact O-N 2.99Å; T256-N260 PolarHBondContact O-ND2 3.23Å; T256-N260 VanDerWaalsContact O-ND2 3.14Å; D257-N260 PolarHBondContact O-N 3.28Å; D257-N260 VanDerWaalsContact O-N 3.14Å; N260-K263 PolarHBondContact O-N 3.5Å; N260-L264 WeakPolarHBondContact O-CB 3.36Å; N260-L264 PolarHBondContact O-N 3.34Å |
| 261 | E | 80.3 | Confident | 79 | Confident | 129 Ų | 129 | 90.1 Ų | 90.1 | 60% | 0.603 | 48% | 0.479 | S | S | * | . | H | α-helix | trans | -62.5 | -46.7 | 173.7 | -162.5 | 168.8 | -165.1 | 0 | 0 | 111.2 | D257 S258 M259 K263 L264 D265 | D257-E261 PolarHBondContact O-N 3.42Å; S258-E261 PolarHBondContact O-N 2.89Å; M259-E261 VanDerWaalsContact C-N 3.34Å; E261-K263 PolarHBondContact O-N 3.47Å; E261-L264 WeakPolarHBondContact O-CB 3.33Å; E261-L264 PolarHBondContact O-N 2.96Å; E261-D265 PolarHBondContact O-N 3.04Å |
| 262 | L | 77 | Confident | 80.1 | Confident | 81 Ų | 81 | 90.9 Ų | 90.9 | 42% | 0.424 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -61.6 | -41.1 | 174.8 | -74.2 | 171.3 | 0 | 0 | 0 | 113.2 | S258 L264 D265 C266 | S258-L262 WeakPolarHBondContact O-CG 3.47Å; S258-L262 PolarHBondContact O-N 2.93Å; L262-L264 VanDerWaalsContact C-N 3.3Å; L262-L264 PolarHBondContact O-N 2.92Å; L262-D265 PolarHBondContact O-N 3.4Å; L262-C266 PolarHBondContact O-N 3.46Å; L262-C266 PolarHBondContact O-SG 3.44Å; L262-C266 VanDerWaalsContact O-SG 3.41Å |
| 263 | K | 82.5 | Confident | 81.4 | Confident | 147 Ų | 147 | 90 Ų | 90 | 64% | 0.639 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -62.6 | -38.9 | 175.4 | -82.6 | -178.4 | 178 | 178 | 0 | 112.1 | M259 N260 E261 S267 | M259-K263 WeakPolarHBondContact O-CG 3.33Å; M259-K263 PolarHBondContact O-N 3.34Å; N260-K263 PolarHBondContact O-N 3.5Å; E261-K263 PolarHBondContact O-N 3.47Å; K263-S267 PolarHBondContact O-N 3.26Å; K263-S267 VanDerWaalsContact O-N 3.13Å |
| 264 | L | 84.5 | Confident | 82.3 | Confident | 108 Ų | 108 | 90.6 Ų | 90.6 | 57% | 0.565 | 48% | 0.477 | S | S | * | . | H | α-helix | trans | -66 | -43.3 | 176.4 | -170.2 | 67.1 | 0 | 0 | 0 | 110.6 | N260 E261 L262 C266 S267 I268 | N260-L264 WeakPolarHBondContact O-CB 3.36Å; N260-L264 PolarHBondContact O-N 3.34Å; E261-L264 WeakPolarHBondContact O-CB 3.33Å; E261-L264 PolarHBondContact O-N 2.96Å; L262-L264 VanDerWaalsContact C-N 3.3Å; L262-L264 PolarHBondContact O-N 2.92Å; L264-C266 PolarHBondContact O-N 3.43Å; L264-S267 PolarHBondContact O-N 3.33Å; L264-I268 HydrophobicContact CG-CD1 4.06Å; L264-I268 VanDerWaalsContact O-CG1 3.28Å; L264-I268 WeakPolarHBondContact O-CG1 3.09Å; L264-I268 PolarHBondContact O-N 2.72Å |
| 265 | D | 86.3 | Confident | 83.3 | Confident | 81 Ų | 81 | 88.6 Ų | 88.6 | 43% | 0.433 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -61.3 | -42.5 | 176.2 | -77.6 | -13.1 | 0 | 0 | 0 | 112.3 | E261 L262 S267 I268 I269 | E261-D265 PolarHBondContact O-N 3.04Å; L262-D265 PolarHBondContact O-N 3.4Å; D265-S267 PolarHBondContact O-N 2.96Å; D265-I268 PolarHBondContact O-N 3.49Å; D265-I269 VanDerWaalsContact O-CG1 3.28Å; D265-I269 WeakPolarHBondContact O-CG1 3.47Å; D265-I269 PolarHBondContact O-N 3.5Å |
| 266 | C | 77.2 | Confident | 84.6 | Confident | 73 Ų | 73 | 89.4 Ų | 89.4 | 49% | 0.493 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -59.3 | -46.8 | 173.7 | -71.9 | 0 | 0 | 0 | 0 | 111.9 | L262 L264 I268 I269 E270 | L262-C266 PolarHBondContact O-N 3.46Å; L262-C266 PolarHBondContact O-SG 3.44Å; L262-C266 VanDerWaalsContact O-SG 3.41Å; L264-C266 PolarHBondContact O-N 3.43Å; C266-I268 VanDerWaalsContact C-N 3.32Å; C266-I268 PolarHBondContact O-N 3Å; C266-I269 PolarHBondContact O-N 3.42Å; C266-E270 WeakPolarHBondContact O-CG 3.35Å; C266-E270 PolarHBondContact O-N 3.42Å |
| 267 | S | 84 | Confident | 85 | Confident | 56 Ų | 56 | 89.8 Ų | 89.8 | 39% | 0.392 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -61.3 | -40.5 | 177.9 | -170.7 | 0 | 0 | 0 | 0 | 111.8 | K263 L264 D265 I269 E270 D271 | K263-S267 PolarHBondContact O-N 3.26Å; K263-S267 VanDerWaalsContact O-N 3.13Å; L264-S267 PolarHBondContact O-N 3.33Å; D265-S267 PolarHBondContact O-N 2.96Å; S267-I269 VanDerWaalsContact C-N 3.35Å; S267-E270 PolarHBondContact O-N 2.85Å; S267-D271 PolarHBondContact O-N 3.26Å |
| 268 | I | 87.4 | Confident | 85.7 | Confident | 75 Ų | 75 | 90.3 Ų | 90.3 | 39% | 0.385 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -65.4 | -39.6 | 177.3 | -68.2 | 165.1 | 0 | 0 | 0 | 110.8 | L264 D265 C266 D271 I272 | L264-I268 HydrophobicContact CG-CD1 4.06Å; L264-I268 VanDerWaalsContact O-CG1 3.28Å; L264-I268 WeakPolarHBondContact O-CG1 3.09Å; L264-I268 PolarHBondContact O-N 2.72Å; D265-I268 PolarHBondContact O-N 3.49Å; C266-I268 VanDerWaalsContact C-N 3.32Å; C266-I268 PolarHBondContact O-N 3Å; I268-D271 PolarHBondContact O-N 2.79Å; I268-I272 HydrophobicContact CG2-CD1 3.78Å; I268-I272 HydrophobicContact CG2-CG1 4.4Å; I268-I272 WeakPolarHBondContact O-CB 3.43Å; I268-I272 VanDerWaalsContact O-CG1 3.24Å; I268-I272 WeakPolarHBondContact O-CG1 3.34Å; I268-I272 PolarHBondContact O-N 2.84Å |
| 269 | I | 87.9 | Confident | 85.9 | Confident | 64 Ų | 64 | 94.1 Ų | 94.1 | 33% | 0.328 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.8 | -45.4 | 177.4 | -70.1 | 165.9 | 0 | 0 | 0 | 110.7 | D265 C266 S267 D271 I272 I273 | D265-I269 VanDerWaalsContact O-CG1 3.28Å; D265-I269 WeakPolarHBondContact O-CG1 3.47Å; D265-I269 PolarHBondContact O-N 3.5Å; C266-I269 PolarHBondContact O-N 3.42Å; S267-I269 VanDerWaalsContact C-N 3.35Å; I269-D271 VanDerWaalsContact C-N 3.33Å; I269-D271 PolarHBondContact O-N 2.92Å; I269-I272 PolarHBondContact O-N 2.96Å; I269-I273 HydrophobicContact CG2-CD1 3.83Å; I269-I273 HydrophobicContact CG2-CG1 4.41Å; I269-I273 WeakPolarHBondContact O-CG1 3.23Å; I269-I273 PolarHBondContact O-N 3.1Å |
| 270 | E | 88.8 | Confident | 86.4 | Confident | 136 Ų | 136 | 91.8 Ų | 91.8 | 64% | 0.636 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -58.1 | -45.3 | 176.4 | -73 | 177.7 | -177 | 0 | 0 | 111.4 | C266 S267 I272 I273 L274 | C266-E270 WeakPolarHBondContact O-CG 3.35Å; C266-E270 PolarHBondContact O-N 3.42Å; S267-E270 PolarHBondContact O-N 2.85Å; E270-I272 PolarHBondContact O-N 2.79Å; E270-I273 PolarHBondContact O-N 3.48Å; E270-L274 PolarHBondContact O-N 3.28Å |
| 271 | D | 90 | Very high | 86.8 | Confident | 91 Ų | 91 | 92 Ų | 92 | 49% | 0.487 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -63.2 | -42.3 | 176.5 | -73.9 | -19.8 | 0 | 0 | 0 | 112.3 | S267 I268 I269 L274 I275 | S267-D271 PolarHBondContact O-N 3.26Å; I268-D271 PolarHBondContact O-N 2.79Å; I269-D271 VanDerWaalsContact C-N 3.33Å; I269-D271 PolarHBondContact O-N 2.92Å; D271-L274 PolarHBondContact O-N 3.46Å; D271-I275 VanDerWaalsContact O-CG1 3.29Å; D271-I275 WeakPolarHBondContact O-CG1 3.43Å; D271-I275 PolarHBondContact O-N 2.88Å |
| 272 | I | 89.7 | Confident | 87.2 | Confident | 70 Ų | 70 | 89.5 Ų | 89.5 | 36% | 0.359 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -63.4 | -43.5 | 177 | -72.2 | 168.7 | 0 | 0 | 0 | 110.9 | I268 I269 E270 L274 I275 L276 | I268-I272 HydrophobicContact CG2-CD1 3.78Å; I268-I272 HydrophobicContact CG2-CG1 4.4Å; I268-I272 WeakPolarHBondContact O-CB 3.43Å; I268-I272 VanDerWaalsContact O-CG1 3.24Å; I268-I272 WeakPolarHBondContact O-CG1 3.34Å; I268-I272 PolarHBondContact O-N 2.84Å; I269-I272 PolarHBondContact O-N 2.96Å; E270-I272 PolarHBondContact O-N 2.79Å; I272-L274 VanDerWaalsContact C-N 3.34Å; I272-I275 PolarHBondContact O-N 2.81Å; I272-L276 HydrophobicContact CG2-CD1 4.01Å; I272-L276 HydrophobicContact CG2-CG 4.44Å; I272-L276 WeakPolarHBondContact O-CG 3.48Å; I272-L276 PolarHBondContact O-N 3.37Å |
| 273 | I | 91 | Very high | 87.7 | Confident | 97 Ų | 97 | 90 Ų | 90 | 50% | 0.497 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -60.5 | -46.3 | 176.9 | -70.8 | 170 | 0 | 0 | 0 | 109.7 | I269 E270 I275 L276 V277 | I269-I273 HydrophobicContact CG2-CD1 3.83Å; I269-I273 HydrophobicContact CG2-CG1 4.41Å; I269-I273 WeakPolarHBondContact O-CG1 3.23Å; I269-I273 PolarHBondContact O-N 3.1Å; E270-I273 PolarHBondContact O-N 3.48Å; I273-I275 PolarHBondContact O-N 3.49Å; I273-L276 PolarHBondContact O-N 3.03Å; I273-V277 HydrophobicContact CG2-CG2 4.44Å; I273-V277 WeakPolarHBondContact O-CG2 3.45Å; I273-V277 PolarHBondContact O-N 3.18Å |
| 274 | L | 90.9 | Very high | 87.9 | Confident | 104 Ų | 104 | 87.9 Ų | 87.9 | 55% | 0.545 | 47% | 0.468 | S | S | . | . | H | α-helix | trans | -60.5 | -44.3 | 178.6 | -171.4 | 66.6 | 0 | 0 | 0 | 111.8 | E270 D271 I272 L276 V277 I278 | E270-L274 PolarHBondContact O-N 3.28Å; D271-L274 PolarHBondContact O-N 3.46Å; I272-L274 VanDerWaalsContact C-N 3.34Å; L274-L276 VanDerWaalsContact C-N 3.33Å; L274-L276 PolarHBondContact O-N 2.89Å; L274-V277 PolarHBondContact O-N 3.07Å; L274-I278 HydrophobicContact CG-CD1 4.12Å; L274-I278 VanDerWaalsContact O-CG1 3.3Å; L274-I278 WeakPolarHBondContact O-CG1 3.38Å; L274-I278 PolarHBondContact O-N 2.93Å |
| 275 | I | 91 | Very high | 88 | Confident | 91 Ų | 91 | 86.4 Ų | 86.4 | 47% | 0.467 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -62 | -40.2 | 176.2 | -69.6 | 166.8 | 0 | 0 | 0 | 111.4 | D271 I272 I273 K279 | D271-I275 VanDerWaalsContact O-CG1 3.29Å; D271-I275 WeakPolarHBondContact O-CG1 3.43Å; D271-I275 PolarHBondContact O-N 2.88Å; I272-I275 PolarHBondContact O-N 2.81Å; I273-I275 PolarHBondContact O-N 3.49Å; I275-K279 HydrophobicContact CG2-CD 4.3Å; I275-K279 WeakPolarHBondContact O-CB 3.45Å; I275-K279 WeakPolarHBondContact O-CG 3.49Å; I275-K279 PolarHBondContact O-N 3.37Å |
| 276 | L | 90.6 | Very high | 88.1 | Confident | 74 Ų | 74 | 87.8 Ų | 87.8 | 39% | 0.387 | 47% | 0.471 | S | S | . | . | H | α-helix | trans | -67.6 | -40.8 | 178.8 | -74.9 | 173.2 | 0 | 0 | 0 | 112.2 | I272 I273 L274 K279 N280 | I272-L276 HydrophobicContact CG2-CD1 4.01Å; I272-L276 HydrophobicContact CG2-CG 4.44Å; I272-L276 WeakPolarHBondContact O-CG 3.48Å; I272-L276 PolarHBondContact O-N 3.37Å; I273-L276 PolarHBondContact O-N 3.03Å; L274-L276 VanDerWaalsContact C-N 3.33Å; L274-L276 PolarHBondContact O-N 2.89Å; L276-K279 PolarHBondContact O-N 3.41Å; L276-N280 WeakPolarHBondContact O-CB 3.4Å; L276-N280 VanDerWaalsContact O-CG 3.3Å; L276-N280 PolarHBondContact O-N 3.06Å; L276-N280 PolarHBondContact O-ND2 2.88Å |
| 277 | V | 90.5 | Very high | 88.5 | Confident | 71 Ų | 71 | 91.4 Ų | 91.4 | 43% | 0.43 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -60.5 | -50.5 | 175.1 | 171.7 | 0 | 0 | 0 | 0 | 110 | I273 L274 K279 N280 D281 | I273-V277 HydrophobicContact CG2-CG2 4.44Å; I273-V277 WeakPolarHBondContact O-CG2 3.45Å; I273-V277 PolarHBondContact O-N 3.18Å; L274-V277 PolarHBondContact O-N 3.07Å; V277-K279 VanDerWaalsContact C-N 3.32Å; V277-K279 PolarHBondContact O-N 3.47Å; V277-N280 PolarHBondContact O-N 2.85Å; V277-D281 PolarHBondContact O-N 3.4Å |
| 278 | I | 90.1 | Very high | 88.5 | Confident | 104 Ų | 104 | 93 Ų | 93 | 53% | 0.533 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -59.1 | -43.1 | 178.9 | -66.8 | 166.6 | 0 | 0 | 0 | 111.5 | L274 S282 | L274-I278 HydrophobicContact CG-CD1 4.12Å; L274-I278 VanDerWaalsContact O-CG1 3.3Å; L274-I278 WeakPolarHBondContact O-CG1 3.38Å; L274-I278 PolarHBondContact O-N 2.93Å; I278-S282 WeakPolarHBondContact O-CB 3.46Å; I278-S282 PolarHBondContact O-N 3.19Å |
| 279 | K | 88.5 | Confident | 88.4 | Confident | 129 Ų | 129 | 91.6 Ų | 91.6 | 56% | 0.561 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -66.3 | -42.2 | 178 | -79.9 | -174.3 | 175.7 | -176.6 | 0 | 112.4 | I275 L276 V277 S282 I283 | I275-K279 HydrophobicContact CG2-CD 4.3Å; I275-K279 WeakPolarHBondContact O-CB 3.45Å; I275-K279 WeakPolarHBondContact O-CG 3.49Å; I275-K279 PolarHBondContact O-N 3.37Å; L276-K279 PolarHBondContact O-N 3.41Å; V277-K279 VanDerWaalsContact C-N 3.32Å; V277-K279 PolarHBondContact O-N 3.47Å; K279-S282 PolarHBondContact O-N 2.92Å; K279-I283 VanDerWaalsContact O-CG1 3.28Å; K279-I283 WeakPolarHBondContact O-CG1 3.45Å; K279-I283 PolarHBondContact O-N 2.97Å |
| 280 | N | 86.8 | Confident | 88.2 | Confident | 60 Ų | 60 | 92.9 Ų | 92.9 | 32% | 0.321 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.3 | -44.4 | 177.3 | -76.2 | -18.6 | 0 | 0 | 0 | 111 | L276 V277 S282 I283 I284 | L276-N280 WeakPolarHBondContact O-CB 3.4Å; L276-N280 VanDerWaalsContact O-CG 3.3Å; L276-N280 PolarHBondContact O-N 3.06Å; L276-N280 PolarHBondContact O-ND2 2.88Å; V277-N280 PolarHBondContact O-N 2.85Å; N280-S282 VanDerWaalsContact C-N 3.31Å; N280-S282 PolarHBondContact O-N 2.91Å; N280-I283 PolarHBondContact O-N 3.33Å; N280-I284 VanDerWaalsContact O-CG1 3.3Å; N280-I284 WeakPolarHBondContact O-CG1 3.25Å; N280-I284 PolarHBondContact O-N 3.04Å |
| 281 | D | 88.2 | Confident | 87.8 | Confident | 91 Ų | 91 | 89.5 Ų | 89.5 | 49% | 0.487 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -62.1 | -38.9 | 177.3 | -73.2 | -12.3 | 0 | 0 | 0 | 112 | V277 I284 S285 | V277-D281 PolarHBondContact O-N 3.4Å; D281-I284 PolarHBondContact O-N 2.75Å; D281-S285 WeakPolarHBondContact O-CB 3.5Å; D281-S285 PolarHBondContact O-N 3.49Å; D281-S285 PolarHBondContact O-OG 3.3Å |
| 282 | S | 88.5 | Confident | 87.1 | Confident | 77 Ų | 77 | 88.5 Ų | 88.5 | 54% | 0.538 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -64.7 | -40.9 | 175.2 | -175.4 | 0 | 0 | 0 | 0 | 112.4 | I278 K279 N280 S285 Q286 | I278-S282 WeakPolarHBondContact O-CB 3.46Å; I278-S282 PolarHBondContact O-N 3.19Å; K279-S282 PolarHBondContact O-N 2.92Å; N280-S282 VanDerWaalsContact C-N 3.31Å; N280-S282 PolarHBondContact O-N 2.91Å; S282-S285 PolarHBondContact O-N 3.34Å; S282-Q286 PolarHBondContact O-N 2.92Å |
| 283 | I | 88.1 | Confident | 86.1 | Confident | 91 Ų | 91 | 92.2 Ų | 92.2 | 47% | 0.467 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -67.1 | -44.4 | 177.9 | -69 | 165.1 | 0 | 0 | 0 | 110.3 | K279 N280 S285 Q286 F287 | K279-I283 VanDerWaalsContact O-CG1 3.28Å; K279-I283 WeakPolarHBondContact O-CG1 3.45Å; K279-I283 PolarHBondContact O-N 2.97Å; N280-I283 PolarHBondContact O-N 3.33Å; I283-S285 VanDerWaalsContact C-N 3.32Å; I283-S285 PolarHBondContact O-N 3.27Å; I283-Q286 PolarHBondContact O-N 2.92Å; I283-F287 PolarHBondContact O-N 2.92Å |
| 284 | I | 85.7 | Confident | 85 | Confident | 102 Ų | 102 | 91.9 Ų | 91.9 | 52% | 0.523 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -61.1 | -44 | 177 | -67.7 | 166.9 | 0 | 0 | 0 | 110.1 | N280 D281 Q286 F287 V288 | N280-I284 VanDerWaalsContact O-CG1 3.3Å; N280-I284 WeakPolarHBondContact O-CG1 3.25Å; N280-I284 PolarHBondContact O-N 3.04Å; D281-I284 PolarHBondContact O-N 2.75Å; I284-Q286 PolarHBondContact O-N 3.35Å; I284-F287 PolarHBondContact O-N 2.89Å; I284-V288 HydrophobicContact CG2-CG2 4.48Å; I284-V288 WeakPolarHBondContact O-CG2 3.4Å; I284-V288 PolarHBondContact O-N 2.99Å |
| 285 | S | 87.4 | Confident | 83.8 | Confident | 77 Ų | 77 | 90.9 Ų | 90.9 | 54% | 0.538 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.2 | -41.8 | 178.2 | -60 | 0 | 0 | 0 | 0 | 112.4 | D281 S282 I283 V288 A289 | D281-S285 WeakPolarHBondContact O-CB 3.5Å; D281-S285 PolarHBondContact O-N 3.49Å; D281-S285 PolarHBondContact O-OG 3.3Å; S282-S285 PolarHBondContact O-N 3.34Å; I283-S285 VanDerWaalsContact C-N 3.32Å; I283-S285 PolarHBondContact O-N 3.27Å; S285-V288 PolarHBondContact O-N 2.93Å; S285-A289 WeakPolarHBondContact O-CB 3.5Å; S285-A289 PolarHBondContact O-N 3.47Å |
| 286 | Q | 87 | Confident | 82.4 | Confident | 111 Ų | 111 | 94.8 Ų | 94.8 | 52% | 0.519 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -64.4 | -42.9 | 175.7 | -170.5 | 63.3 | 48.4 | 0 | 0 | 111.6 | S282 I283 I284 V288 A289 D290 | S282-Q286 PolarHBondContact O-N 2.92Å; I283-Q286 PolarHBondContact O-N 2.92Å; I284-Q286 PolarHBondContact O-N 3.35Å; Q286-V288 VanDerWaalsContact C-N 3.34Å; Q286-V288 PolarHBondContact O-N 3.46Å; Q286-A289 PolarHBondContact O-N 3.05Å; Q286-D290 PolarHBondContact NE2-OD1 2.95Å; Q286-D290 VanDerWaalsContact O-CG 3.24Å; Q286-D290 PolarHBondContact O-N 3.43Å |
| 287 | F | 86.3 | Confident | 80.8 | Confident | 149 Ų | 149 | 98.2 Ų | 98.2 | 65% | 0.654 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -61.5 | -41.7 | 177.2 | -178.9 | -97.7 | 0 | 0 | 0 | 112.4 | I283 I284 S291 | I283-F287 PolarHBondContact O-N 2.92Å; I284-F287 PolarHBondContact O-N 2.89Å; F287-S291 WeakPolarHBondContact O-CB 3.26Å; F287-S291 PolarHBondContact O-N 3.41Å |
| 288 | V | 85 | Confident | 79 | Confident | 90 Ų | 90 | 104.3 Ų | 104.3 | 55% | 0.545 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -64.7 | -41.8 | 175.6 | 172.4 | 0 | 0 | 0 | 0 | 111 | I284 S285 Q286 S291 S292 | I284-V288 HydrophobicContact CG2-CG2 4.48Å; I284-V288 WeakPolarHBondContact O-CG2 3.4Å; I284-V288 PolarHBondContact O-N 2.99Å; S285-V288 PolarHBondContact O-N 2.93Å; Q286-V288 VanDerWaalsContact C-N 3.34Å; Q286-V288 PolarHBondContact O-N 3.46Å; V288-S291 PolarHBondContact O-N 3.46Å; V288-S292 PolarHBondContact O-N 3.43Å; V288-S292 PolarHBondContact O-OG 3.47Å |
| 289 | A | 83.6 | Confident | 78.4 | Confident | 45 Ų | 45 | 104.3 Ų | 104.3 | 37% | 0.372 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -62.3 | -48.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | S285 Q286 S291 S292 Y293 | S285-A289 WeakPolarHBondContact O-CB 3.5Å; S285-A289 PolarHBondContact O-N 3.47Å; Q286-A289 PolarHBondContact O-N 3.05Å; A289-S291 VanDerWaalsContact C-N 3.32Å; A289-S291 PolarHBondContact O-N 2.94Å; A289-S292 PolarHBondContact O-N 3.36Å; A289-S292 VanDerWaalsContact O-N 3.17Å; A289-S292 PolarHBondContact O-OG 2.92Å; A289-Y293 PolarHBondContact O-N 3.12Å; A289-Y293 VanDerWaalsContact O-N 3.15Å |
| 290 | D | 84.8 | Confident | 77.9 | Confident | 91 Ų | 91 | 103 Ų | 103 | 49% | 0.487 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -62.9 | -39 | 179.4 | -65.1 | -9.4 | 0 | 0 | 0 | 111.2 | Q286 Y293 V294 | Q286-D290 PolarHBondContact NE2-OD1 2.95Å; Q286-D290 VanDerWaalsContact O-CG 3.24Å; Q286-D290 PolarHBondContact O-N 3.43Å; D290-Y293 PolarHBondContact O-N 3.38Å; D290-V294 WeakPolarHBondContact O-CG2 3.28Å; D290-V294 PolarHBondContact O-N 3.02Å |
| 291 | S | 79.8 | Confident | 77.4 | Confident | 65 Ų | 65 | 105.4 Ų | 105.4 | 46% | 0.455 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -69 | -31.7 | 176.4 | -173 | 0 | 0 | 0 | 0 | 113.4 | F287 V288 A289 S295 | F287-S291 WeakPolarHBondContact O-CB 3.26Å; F287-S291 PolarHBondContact O-N 3.41Å; V288-S291 PolarHBondContact O-N 3.46Å; A289-S291 VanDerWaalsContact C-N 3.32Å; A289-S291 PolarHBondContact O-N 2.94Å; S291-S295 PolarHBondContact O-OG 2.7Å; S291-S295 VanDerWaalsContact O-OG 3.13Å |
| 292 | S | 76.1 | Confident | 76.7 | Confident | 69 Ų | 69 | 106.2 Ų | 106.2 | 48% | 0.483 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -71 | -38 | 177.2 | 68.2 | 0 | 0 | 0 | 0 | 112 | V288 A289 V294 S295 E296 | V288-S292 PolarHBondContact O-N 3.43Å; V288-S292 PolarHBondContact O-OG 3.47Å; A289-S292 PolarHBondContact O-N 3.36Å; A289-S292 VanDerWaalsContact O-N 3.17Å; A289-S292 PolarHBondContact O-OG 2.92Å; S292-V294 PolarHBondContact O-N 3.43Å; S292-S295 WeakPolarHBondContact O-CB 3.37Å; S292-S295 PolarHBondContact O-N 3.25Å; S292-S295 VanDerWaalsContact O-N 3.11Å; S292-E296 PolarHBondContact O-N 3.25Å |
| 293 | Y | 67.8 | Low | 76 | Confident | 148 Ų | 148 | 108.1 Ų | 108.1 | 58% | 0.58 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -64.1 | -41 | 179 | -165.5 | -89.7 | 0 | 0 | 0 | 112 | A289 D290 S295 E296 | A289-Y293 PolarHBondContact O-N 3.12Å; A289-Y293 VanDerWaalsContact O-N 3.15Å; D290-Y293 PolarHBondContact O-N 3.38Å; Y293-S295 PolarHBondContact O-N 3.21Å; Y293-E296 PolarHBondContact O-N 3.28Å |
| 294 | V | 68.5 | Low | 75.2 | Confident | 91 Ų | 91 | 109.2 Ų | 109.2 | 55% | 0.552 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -63.5 | -26.7 | 176 | 178.5 | 0 | 0 | 0 | 0 | 112.2 | D290 S292 | D290-V294 WeakPolarHBondContact O-CG2 3.28Å; D290-V294 PolarHBondContact O-N 3.02Å; S292-V294 PolarHBondContact O-N 3.43Å |
| 295 | S | 64.7 | Low | 74.4 | Confident | 83 Ų | 83 | 109.7 Ų | 109.7 | 58% | 0.58 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -80.8 | -22.8 | -179.9 | -56.4 | 0 | 0 | 0 | 0 | 113.5 | S291 S292 Y293 | S291-S295 PolarHBondContact O-OG 2.7Å; S291-S295 VanDerWaalsContact O-OG 3.13Å; S292-S295 WeakPolarHBondContact O-CB 3.37Å; S292-S295 PolarHBondContact O-N 3.25Å; S292-S295 VanDerWaalsContact O-N 3.11Å; Y293-S295 PolarHBondContact O-N 3.21Å |
| 296 | E | 62.9 | Low | 73.4 | Confident | 172 Ų | 172 | 112.2 Ų | 112.2 | 80% | 0.804 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -84.8 | -15.9 | 176.6 | -81 | -178 | 165 | 0 | 0 | 113.3 | S292 Y293 | S292-E296 PolarHBondContact O-N 3.25Å; Y293-E296 PolarHBondContact O-N 3.28Å |
| 297 | E | 56.2 | Low | 72.3 | Confident | 147 Ų | 147 | 112.3 Ų | 112.3 | 69% | 0.687 | 60% | 0.601 | S | S | * | * | trans | -93.7 | -1.9 | -177.9 | -137 | 165.3 | -159.4 | 0 | 0 | 113.8 | ||||
| 298 | I | 51.8 | Low | 71 | Confident | 198 Ų | 198 | 109 Ų | 109 | 100% | 1.015 | 60% | 0.596 | S | S | * | * | trans | -104.4 | 0 | 175.6 | -59.6 | 178 | 0 | 0 | 0 | 110.6 |
Retrieved 298 of 298 residues in 151.4 ms
(Link to these results)