| 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 | 81.3 | Confident | 95.4 | Very high | 205 Ų | 205 | 125.1 Ų | 125.1 | 100% | 1.01 | 57% | 0.574 | S | S | * | * | 0 | -50.9 | 0 | -67 | -54 | -91.4 | 0 | 0 | 114.2 | K3 K4 R5 | M1-K3 VanDerWaalsContact C-N 3.32Å; M1-K3 PolarHBondContact O-N 3.2Å; M1-K3 VanDerWaalsContact O-N 3.13Å; M1-K4 WeakPolarHBondContact O-CB 3.42Å; M1-K4 PolarHBondContact O-N 3.36Å; M1-R5 PolarHBondContact O-N 3.44Å | |||
| 2 | E | 96.7 | Very high | 95.5 | Very high | 78 Ų | 78 | 118.7 Ų | 118.7 | 36% | 0.364 | 55% | 0.554 | S | S | . | * | H | α-helix | trans | -52.4 | -37.1 | -173 | 175.2 | 60.1 | -179.4 | 0 | 0 | 115.4 | K4 R5 R6 | E2-K4 VanDerWaalsContact C-N 3.31Å; E2-K4 PolarHBondContact O-N 3.37Å; E2-R5 WeakPolarHBondContact O-CA 3.21Å; E2-R5 WeakPolarHBondContact O-CB 3.48Å; E2-R5 PolarHBondContact O-N 3.13Å; E2-R5 IonicContact OE1-NH1 2.67Å; E2-R5 PolarHBondContact OE1-NH1 3.46Å; E2-R5 WeakPolarHBondContact OE2-CD 3.47Å; E2-R5 IonicContact OE2-CZ 3.48Å; E2-R5 IonicContact OE2-NH1 3.29Å; E2-R5 PolarHBondContact OE2-NH1 3.39Å; E2-R6 HydrophobicContact CG-CG 4.32Å; E2-R6 PolarHBondContact O-N 3.17Å; E2-R6 WeakPolarHBondContact OE1-CG 3.47Å; E2-R6 IonicContact OE1-CZ 3.5Å; E2-R6 IonicContact OE1-NE 3.52Å; E2-R6 PolarHBondContact OE1-NE 3.46Å; E2-R6 IonicContact OE1-NH2 3.35Å; E2-R6 PolarHBondContact OE1-NH2 3.46Å |
| 3 | K | 96.3 | Very high | 95.5 | Very high | 190 Ų | 190 | 111.2 Ų | 111.2 | 83% | 0.826 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -55.6 | -41.8 | 174.6 | -170.5 | 177 | -179.1 | 179.3 | 0 | 112.9 | M1 R6 A7 | M1-K3 VanDerWaalsContact C-N 3.32Å; M1-K3 PolarHBondContact O-N 3.2Å; M1-K3 VanDerWaalsContact O-N 3.13Å; K3-R6 PolarHBondContact O-N 3.45Å; K3-A7 PolarHBondContact O-N 3.48Å |
| 4 | K | 96.2 | Very high | 95.4 | Very high | 151 Ų | 151 | 112.4 Ų | 112.4 | 66% | 0.657 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -68.8 | -34.7 | 176.9 | -172.6 | 174.6 | -178.5 | 175.6 | 0 | 111.6 | M1 E2 R8 | M1-K4 WeakPolarHBondContact O-CB 3.42Å; M1-K4 PolarHBondContact O-N 3.36Å; E2-K4 VanDerWaalsContact C-N 3.31Å; E2-K4 PolarHBondContact O-N 3.37Å; K4-R8 WeakPolarHBondContact O-CG 3.49Å; K4-R8 PolarHBondContact O-N 3.21Å |
| 5 | R | 97.8 | Very high | 95.4 | Very high | 142 Ų | 142 | 113.3 Ų | 113.3 | 54% | 0.536 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -66.4 | -46.6 | 173.7 | 177.6 | 173.3 | 166.5 | -84.3 | -3 | 111.6 | M1 E2 A7 R8 I9 | M1-R5 PolarHBondContact O-N 3.44Å; E2-R5 WeakPolarHBondContact O-CA 3.21Å; E2-R5 WeakPolarHBondContact O-CB 3.48Å; E2-R5 PolarHBondContact O-N 3.13Å; E2-R5 IonicContact OE1-NH1 2.67Å; E2-R5 PolarHBondContact OE1-NH1 3.46Å; E2-R5 WeakPolarHBondContact OE2-CD 3.47Å; E2-R5 IonicContact OE2-CZ 3.48Å; E2-R5 IonicContact OE2-NH1 3.29Å; E2-R5 PolarHBondContact OE2-NH1 3.39Å; R5-A7 PolarHBondContact O-N 3.45Å; R5-R8 PolarHBondContact O-N 3.15Å; R5-I9 HydrophobicContact CG-CD1 4.06Å; R5-I9 WeakPolarHBondContact O-CG1 3.4Å; R5-I9 PolarHBondContact O-N 3.39Å; R5-I9 VanDerWaalsContact O-N 3.12Å |
| 6 | R | 97.3 | Very high | 95.3 | Very high | 154 Ų | 154 | 109.4 Ų | 109.4 | 58% | 0.581 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -59.9 | -44 | 176.3 | -68.8 | -178.3 | -175.1 | -176.9 | 2.1 | 112.2 | E2 K3 R8 I9 N10 | E2-R6 HydrophobicContact CG-CG 4.32Å; E2-R6 PolarHBondContact O-N 3.17Å; E2-R6 WeakPolarHBondContact OE1-CG 3.47Å; E2-R6 IonicContact OE1-CZ 3.5Å; E2-R6 IonicContact OE1-NE 3.52Å; E2-R6 PolarHBondContact OE1-NE 3.46Å; E2-R6 IonicContact OE1-NH2 3.35Å; E2-R6 PolarHBondContact OE1-NH2 3.46Å; K3-R6 PolarHBondContact O-N 3.45Å; R6-R8 PolarHBondContact O-N 3.03Å; R6-I9 PolarHBondContact O-N 3.39Å; R6-N10 PolarHBondContact O-N 3.03Å |
| 7 | A | 97.2 | Very high | 95.1 | Very high | 54 Ų | 54 | 108.5 Ų | 108.5 | 45% | 0.446 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -57.4 | -47.7 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | K3 R5 I9 N10 V11 | K3-A7 PolarHBondContact O-N 3.48Å; R5-A7 PolarHBondContact O-N 3.45Å; A7-I9 VanDerWaalsContact C-N 3.32Å; A7-I9 PolarHBondContact O-N 3.37Å; A7-N10 PolarHBondContact O-N 3.36Å; A7-V11 WeakPolarHBondContact O-CG2 3.39Å; A7-V11 PolarHBondContact O-N 3.01Å |
| 8 | R | 97.6 | Very high | 94.9 | Very high | 189 Ų | 189 | 106.3 Ų | 106.3 | 71% | 0.713 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -57.9 | -41.7 | 176.2 | -71.7 | 173.3 | 66.5 | -165.2 | 0.9 | 112.8 | K4 R5 R6 S12 | K4-R8 WeakPolarHBondContact O-CG 3.49Å; K4-R8 PolarHBondContact O-N 3.21Å; R5-R8 PolarHBondContact O-N 3.15Å; R6-R8 PolarHBondContact O-N 3.03Å; R8-S12 PolarHBondContact O-N 2.7Å; R8-S12 VanDerWaalsContact O-N 3.1Å; R8-S12 PolarHBondContact O-OG 3.24Å |
| 9 | I | 96.1 | Very high | 94.8 | Very high | 55 Ų | 55 | 104.6 Ų | 104.6 | 28% | 0.282 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.4 | -43.6 | 178.7 | -67.4 | 166.1 | 0 | 0 | 0 | 110.7 | R5 R6 A7 S12 L13 | R5-I9 HydrophobicContact CG-CD1 4.06Å; R5-I9 WeakPolarHBondContact O-CG1 3.4Å; R5-I9 PolarHBondContact O-N 3.39Å; R5-I9 VanDerWaalsContact O-N 3.12Å; R6-I9 PolarHBondContact O-N 3.39Å; A7-I9 VanDerWaalsContact C-N 3.32Å; A7-I9 PolarHBondContact O-N 3.37Å; I9-S12 WeakPolarHBondContact CA-OG 3.39Å; I9-S12 PolarHBondContact O-N 2.81Å; I9-S12 PolarHBondContact O-OG 3.43Å; I9-L13 HydrophobicContact CG2-CD1 4.08Å; I9-L13 WeakPolarHBondContact O-CG 3.15Å; I9-L13 PolarHBondContact O-N 2.88Å |
| 10 | N | 96.6 | Very high | 94.6 | Very high | 86 Ų | 86 | 99.4 Ų | 99.4 | 46% | 0.46 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -65.4 | -44 | 179.7 | -70.2 | 3.5 | 0 | 0 | 0 | 111.7 | R6 A7 S12 L13 E14 | R6-N10 PolarHBondContact O-N 3.03Å; A7-N10 PolarHBondContact O-N 3.36Å; N10-S12 VanDerWaalsContact C-N 3.3Å; N10-S12 PolarHBondContact O-N 3.07Å; N10-L13 WeakPolarHBondContact O-CB 3.47Å; N10-L13 PolarHBondContact O-N 3.31Å; N10-E14 PolarHBondContact O-N 2.98Å |
| 11 | V | 96.7 | Very high | 94.3 | Very high | 72 Ų | 72 | 98.3 Ų | 98.3 | 44% | 0.436 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -55.9 | -44.1 | 172.9 | 172 | 0 | 0 | 0 | 0 | 111.3 | A7 L13 E14 Q15 | A7-V11 WeakPolarHBondContact O-CG2 3.39Å; A7-V11 PolarHBondContact O-N 3.01Å; V11-L13 VanDerWaalsContact C-N 3.33Å; V11-L13 PolarHBondContact O-N 2.92Å; V11-E14 PolarHBondContact O-N 3.18Å; V11-Q15 VanDerWaalsContact O-CG 3.31Å; V11-Q15 WeakPolarHBondContact O-CG 3.46Å; V11-Q15 PolarHBondContact O-N 3.5Å |
| 12 | S | 96.2 | Very high | 94.6 | Very high | 48 Ų | 48 | 97.5 Ų | 97.5 | 34% | 0.336 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -65.5 | -32.5 | 176.6 | 61.2 | 0 | 0 | 0 | 0 | 113.7 | R8 I9 N10 L16 | R8-S12 PolarHBondContact O-N 2.7Å; R8-S12 VanDerWaalsContact O-N 3.1Å; R8-S12 PolarHBondContact O-OG 3.24Å; I9-S12 WeakPolarHBondContact CA-OG 3.39Å; I9-S12 PolarHBondContact O-N 2.81Å; I9-S12 PolarHBondContact O-OG 3.43Å; N10-S12 VanDerWaalsContact C-N 3.3Å; N10-S12 PolarHBondContact O-N 3.07Å; S12-L16 WeakPolarHBondContact O-CB 3.49Å; S12-L16 VanDerWaalsContact O-CG 3.24Å; S12-L16 WeakPolarHBondContact O-CG 3.17Å; S12-L16 PolarHBondContact O-N 3.28Å |
| 13 | L | 95.3 | Very high | 94 | Very high | 22 Ų | 22 | 98.6 Ų | 98.6 | 12% | 0.115 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -71.7 | -37.1 | 176.6 | -71.3 | 166.5 | 0 | 0 | 0 | 112 | I9 N10 V11 L16 K17 K35 I38 L39 | I9-L13 HydrophobicContact CG2-CD1 4.08Å; I9-L13 WeakPolarHBondContact O-CG 3.15Å; I9-L13 PolarHBondContact O-N 2.88Å; N10-L13 WeakPolarHBondContact O-CB 3.47Å; N10-L13 PolarHBondContact O-N 3.31Å; V11-L13 VanDerWaalsContact C-N 3.33Å; V11-L13 PolarHBondContact O-N 2.92Å; L13-L16 PolarHBondContact O-N 3.46Å; L13-K17 WeakPolarHBondContact O-CB 3.49Å; L13-K17 PolarHBondContact O-N 3.01Å; L13-K35 HydrophobicContact CD1-CD 3.91Å; L13-K35 HydrophobicContact CD1-CG 4.11Å; L13-K35 HydrophobicContact CD2-CG 4.3Å; L13-I38 HydrophobicContact CD2-CG2 4.04Å; L13-L39 HydrophobicContact CD2-CD2 4.19Å; L13-L39 HydrophobicContact CD2-CG 4.46Å |
| 14 | E | 94.4 | Very high | 93.4 | Very high | 127 Ų | 127 | 91.2 Ų | 91.2 | 59% | 0.593 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -64.8 | -45.6 | 173.4 | -71.8 | 166.6 | -161.2 | 0 | 0 | 111 | N10 V11 L16 K17 S18 | N10-E14 PolarHBondContact O-N 2.98Å; V11-E14 PolarHBondContact O-N 3.18Å; E14-L16 PolarHBondContact O-N 2.98Å; E14-K17 WeakPolarHBondContact O-CB 3.47Å; E14-K17 PolarHBondContact O-N 3.42Å; E14-S18 PolarHBondContact O-N 3.32Å; E14-S18 PolarHBondContact O-OG 3.12Å |
| 15 | Q | 94.9 | Very high | 92.6 | Very high | 126 Ų | 126 | 85.3 Ų | 85.3 | 59% | 0.589 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -57.8 | -45.7 | 174.1 | -72.5 | 172 | -27.1 | 0 | 0 | 112.4 | V11 S18 L19 | V11-Q15 VanDerWaalsContact O-CG 3.31Å; V11-Q15 WeakPolarHBondContact O-CG 3.46Å; V11-Q15 PolarHBondContact O-N 3.5Å; Q15-S18 PolarHBondContact O-N 2.78Å; Q15-L19 PolarHBondContact O-N 3.28Å |
| 16 | L | 94.7 | Very high | 91.6 | Very high | 52 Ų | 52 | 85 Ų | 85 | 27% | 0.272 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -62.3 | -42.1 | 175.4 | -72.6 | 171.6 | 0 | 0 | 0 | 111.7 | S12 L13 E14 L19 L20 I38 L39 | S12-L16 WeakPolarHBondContact O-CB 3.49Å; S12-L16 VanDerWaalsContact O-CG 3.24Å; S12-L16 WeakPolarHBondContact O-CG 3.17Å; S12-L16 PolarHBondContact O-N 3.28Å; L13-L16 PolarHBondContact O-N 3.46Å; E14-L16 PolarHBondContact O-N 2.98Å; L16-L19 WeakPolarHBondContact O-CB 3.37Å; L16-L19 PolarHBondContact O-N 3.33Å; L16-L20 WeakPolarHBondContact O-CB 3.17Å; L16-L20 VanDerWaalsContact O-CG 3.26Å; L16-L20 WeakPolarHBondContact O-CG 3.43Å; L16-L20 PolarHBondContact O-N 2.9Å; L16-I38 HydrophobicContact CB-CG2 3.94Å; L16-L39 HydrophobicContact CD1-CD2 4.47Å |
| 17 | K | 91.5 | Very high | 90.6 | Very high | 93 Ų | 93 | 81 Ų | 81 | 40% | 0.404 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -59.7 | -47.7 | 175.8 | -173.1 | -171.7 | 173.2 | -167.3 | 0 | 111.5 | L13 E14 L19 L20 E21 I28 | L13-K17 WeakPolarHBondContact O-CB 3.49Å; L13-K17 PolarHBondContact O-N 3.01Å; E14-K17 WeakPolarHBondContact O-CB 3.47Å; E14-K17 PolarHBondContact O-N 3.42Å; K17-L19 VanDerWaalsContact C-N 3.32Å; K17-L19 PolarHBondContact O-N 3.33Å; K17-L20 PolarHBondContact O-N 3.31Å; K17-E21 WeakPolarHBondContact O-CB 3.32Å; K17-E21 PolarHBondContact O-N 2.96Å; K17-I28 HydrophobicContact CG-CG2 4.37Å |
| 18 | S | 91.3 | Very high | 89.8 | Confident | 70 Ų | 70 | 79.2 Ų | 79.2 | 49% | 0.49 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -65.6 | -31.2 | 178.6 | -61.9 | 0 | 0 | 0 | 0 | 113.5 | E14 Q15 | E14-S18 PolarHBondContact O-N 3.32Å; E14-S18 PolarHBondContact O-OG 3.12Å; Q15-S18 PolarHBondContact O-N 2.78Å |
| 19 | L | 92.6 | Very high | 88.9 | Confident | 74 Ų | 74 | 78.2 Ų | 78.2 | 39% | 0.387 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -65.5 | -51.5 | 171.1 | -174 | 84.9 | 0 | 0 | 0 | 110.6 | Q15 L16 K17 E21 K22 Y45 | Q15-L19 PolarHBondContact O-N 3.28Å; L16-L19 WeakPolarHBondContact O-CB 3.37Å; L16-L19 PolarHBondContact O-N 3.33Å; K17-L19 VanDerWaalsContact C-N 3.32Å; K17-L19 PolarHBondContact O-N 3.33Å; L19-E21 VanDerWaalsContact C-N 3.26Å; L19-E21 PolarHBondContact O-N 3.15Å; L19-K22 PolarHBondContact O-N 3.1Å; L19-Y45 HydrophobicContact CD2-CD1 3.84Å; L19-Y45 HydrophobicContact CD2-CE1 3.69Å; L19-Y45 HydrophobicContact CG-CE1 4.22Å |
| 20 | L | 91.2 | Very high | 87.7 | Confident | 0 Ų | 0 | 84.1 Ų | 84.1 | 0% | 0 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -65 | -28.2 | -178.8 | -68.4 | 171.4 | 0 | 0 | 0 | 112.6 | L16 K17 K22 H23 Y24 I28 L41 Y45 | L16-L20 WeakPolarHBondContact O-CB 3.17Å; L16-L20 VanDerWaalsContact O-CG 3.26Å; L16-L20 WeakPolarHBondContact O-CG 3.43Å; L16-L20 PolarHBondContact O-N 2.9Å; K17-L20 PolarHBondContact O-N 3.31Å; L20-K22 PolarHBondContact O-N 2.79Å; L20-H23 PolarHBondContact O-N 3.45Å; L20-H23 VanDerWaalsContact O-N 3.12Å; L20-Y24 HydrophobicContact CD2-CD2 3.82Å; L20-Y24 HydrophobicContact CD2-CE2 4.02Å; L20-Y24 WeakPolarHBondContact O-CA 3.26Å; L20-Y24 PolarHBondContact O-N 2.76Å; L20-I28 HydrophobicContact CB-CD1 3.59Å; L20-L41 HydrophobicContact CD1-CB 3.68Å; L20-L41 HydrophobicContact CD2-CB 4.02Å; L20-L41 WeakPolarHBondContact CD2-O 3.48Å; L20-L41 HydrophobicContact CG-CB 4.47Å; L20-Y45 HydrophobicContact CD2-CG 4.34Å |
| 21 | E | 89 | Confident | 87 | Confident | 76 Ų | 76 | 84.8 Ų | 84.8 | 36% | 0.355 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -63.7 | -28.6 | -179.6 | -170.2 | 160.4 | -159 | 0 | 0 | 112.7 | K17 L19 S25 I28 | K17-E21 WeakPolarHBondContact O-CB 3.32Å; K17-E21 PolarHBondContact O-N 2.96Å; L19-E21 VanDerWaalsContact C-N 3.26Å; L19-E21 PolarHBondContact O-N 3.15Å; E21-S25 WeakPolarHBondContact O-CA 3.39Å; E21-S25 WeakPolarHBondContact O-CB 3.33Å; E21-S25 PolarHBondContact O-N 3.04Å; E21-S25 VanDerWaalsContact O-N 3.15Å; E21-I28 HydrophobicContact CB-CD1 4.04Å |
| 22 | K | 86.4 | Confident | 86.4 | Confident | 188 Ų | 188 | 91.2 Ų | 91.2 | 82% | 0.817 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -68.8 | -35.5 | 174.8 | -59.3 | 179.4 | -177.6 | -177.6 | 0 | 112.6 | L19 L20 | L19-K22 PolarHBondContact O-N 3.1Å; L20-K22 PolarHBondContact O-N 2.79Å |
| 23 | H | 84.3 | Confident | 85.9 | Confident | 101 Ų | 101 | 90 Ų | 90 | 47% | 0.468 | 41% | 0.412 | S | S | . | . | H | α-helix | trans | -101.8 | -29 | -172.7 | -165.2 | -91.8 | 0 | 0 | 0 | 113.6 | L20 Y45 | L20-H23 PolarHBondContact O-N 3.45Å; L20-H23 VanDerWaalsContact O-N 3.12Å; H23-Y45 HydrophobicContact CB-CD2 4.17Å; H23-Y45 HydrophobicContact CB-CE2 4.08Å; H23-Y45 AromaticContact CD2-CE2 3.91Å; H23-Y45 AromaticContact CG-CD2 3.92Å; H23-Y45 AromaticContact CG-CE2 3.9Å |
| 24 | Y | 84.1 | Confident | 85.8 | Confident | 35 Ų | 35 | 95.7 Ų | 95.7 | 14% | 0.137 | 44% | 0.439 | C | S | . | . | H | α-helix | trans | -124.9 | 27.9 | -176.6 | -61.1 | -68.5 | 0 | 0 | 0 | 112.5 | L20 H26 Q27 I28 Y45 | L20-Y24 HydrophobicContact CD2-CD2 3.82Å; L20-Y24 HydrophobicContact CD2-CE2 4.02Å; L20-Y24 WeakPolarHBondContact O-CA 3.26Å; L20-Y24 PolarHBondContact O-N 2.76Å; Y24-H26 PolarHBondContact O-N 3.36Å; Y24-Q27 WeakPolarHBondContact O-CA 3.42Å; Y24-Q27 PolarHBondContact O-N 2.96Å; Y24-I28 PolarHBondContact O-N 3.48Å; Y24-I28 VanDerWaalsContact O-N 3.1Å; Y24-Y45 HydrophobicContact CE2-CD2 4.43Å |
| 25 | S | 79.9 | Confident | 85.7 | Confident | 28 Ų | 28 | 95.4 Ų | 95.4 | 20% | 0.196 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -40.1 | -43 | -178.5 | -168.7 | 0 | 0 | 0 | 0 | 114.3 | E21 Q27 I28 R29 | E21-S25 WeakPolarHBondContact O-CA 3.39Å; E21-S25 WeakPolarHBondContact O-CB 3.33Å; E21-S25 PolarHBondContact O-N 3.04Å; E21-S25 VanDerWaalsContact O-N 3.15Å; S25-Q27 PolarHBondContact O-N 2.75Å; S25-I28 PolarHBondContact O-N 3.38Å; S25-R29 WeakPolarHBondContact O-CB 3.3Å; S25-R29 WeakPolarHBondContact O-CG 3.46Å; S25-R29 PolarHBondContact O-N 3.39Å; S25-R29 PolarHBondContact OG-NE 3.23Å; S25-R29 PolarHBondContact OG-NH2 2.86Å |
| 26 | H | 75.7 | Confident | 85.7 | Confident | 134 Ų | 134 | 92.9 Ų | 92.9 | 62% | 0.62 | 44% | 0.436 | S | S | * | . | H | α-helix | trans | -67.6 | -30.7 | 179.7 | -67.9 | 94.6 | 0 | 0 | 0 | 114.2 | Y24 K30 | Y24-H26 PolarHBondContact O-N 3.36Å; H26-K30 VanDerWaalsContact O-CB 3.26Å; H26-K30 WeakPolarHBondContact O-CB 3.43Å; H26-K30 WeakPolarHBondContact O-CD 3.47Å; H26-K30 WeakPolarHBondContact O-CG 3.31Å |
| 27 | Q | 76.1 | Confident | 85.6 | Confident | 72 Ų | 72 | 91.6 Ų | 91.6 | 34% | 0.336 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -79.4 | -42.4 | 172.5 | -66.6 | -165.9 | 56.5 | 0 | 0 | 111.3 | Y24 S25 K30 R31 | Y24-Q27 WeakPolarHBondContact O-CA 3.42Å; Y24-Q27 PolarHBondContact O-N 2.96Å; S25-Q27 PolarHBondContact O-N 2.75Å; Q27-K30 PolarHBondContact O-N 3.08Å; Q27-R31 VanDerWaalsContact O-CG 3.23Å; Q27-R31 WeakPolarHBondContact O-CG 3.33Å; Q27-R31 PolarHBondContact O-N 2.92Å; Q27-R31 VanDerWaalsContact OE1-NH2 3.09Å |
| 28 | I | 81.7 | Confident | 85.6 | Confident | 15 Ų | 15 | 88.1 Ų | 88.1 | 8% | 0.077 | 42% | 0.415 | C | S | . | . | H | α-helix | trans | -68.3 | -38.1 | -176.5 | -50.1 | -148.6 | 0 | 0 | 0 | 112 | K17 L20 E21 Y24 S25 R31 L33 | K17-I28 HydrophobicContact CG-CG2 4.37Å; L20-I28 HydrophobicContact CB-CD1 3.59Å; E21-I28 HydrophobicContact CB-CD1 4.04Å; Y24-I28 PolarHBondContact O-N 3.48Å; Y24-I28 VanDerWaalsContact O-N 3.1Å; S25-I28 PolarHBondContact O-N 3.38Å; I28-R31 VanDerWaalsContact O-O 3.07Å; I28-L33 HydrophobicContact CB-CD1 4.36Å; I28-L33 HydrophobicContact CD1-CD1 3.64Å; I28-L33 HydrophobicContact CG1-CD1 3.83Å; I28-L33 HydrophobicContact CG2-CD1 4.13Å; I28-L33 HydrophobicContact CG2-CG 4.46Å |
| 29 | R | 79.1 | Confident | 85.8 | Confident | 168 Ų | 168 | 88.9 Ų | 88.9 | 63% | 0.634 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -79.7 | -23.3 | 179.5 | -68.8 | -171.4 | -72.6 | 151.7 | -6.9 | 113.8 | S25 | S25-R29 WeakPolarHBondContact O-CB 3.3Å; S25-R29 WeakPolarHBondContact O-CG 3.46Å; S25-R29 PolarHBondContact O-N 3.39Å; S25-R29 PolarHBondContact OG-NE 3.23Å; S25-R29 PolarHBondContact OG-NH2 2.86Å |
| 30 | K | 70 | Confident | 85.9 | Confident | 179 Ų | 179 | 91.6 Ų | 91.6 | 78% | 0.778 | 42% | 0.424 | S | S | * | . | H | α-helix | trans | -90.8 | -22.8 | -179.3 | -71.1 | -174.8 | 177.9 | -170.5 | 0 | 114.4 | H26 Q27 | H26-K30 VanDerWaalsContact O-CB 3.26Å; H26-K30 WeakPolarHBondContact O-CB 3.43Å; H26-K30 WeakPolarHBondContact O-CD 3.47Å; H26-K30 WeakPolarHBondContact O-CG 3.31Å; Q27-K30 PolarHBondContact O-N 3.08Å |
| 31 | R | 81.1 | Confident | 86 | Confident | 101 Ų | 101 | 91.8 Ų | 91.8 | 38% | 0.381 | 43% | 0.425 | S | S | . | . | S | Bend | trans | -137.7 | 143.4 | 176.4 | 57.2 | 171.7 | -179.7 | 136.7 | -0.9 | 112.3 | Q27 I28 L33 D37 | Q27-R31 VanDerWaalsContact O-CG 3.23Å; Q27-R31 WeakPolarHBondContact O-CG 3.33Å; Q27-R31 PolarHBondContact O-N 2.92Å; Q27-R31 VanDerWaalsContact OE1-NH2 3.09Å; I28-R31 VanDerWaalsContact O-O 3.07Å; R31-L33 HydrophobicContact CG-CD2 4.41Å; R31-L33 PolarHBondContact O-N 3.45Å; R31-D37 IonicContact CZ-OD1 3.32Å; R31-D37 IonicContact NH1-OD1 2.76Å; R31-D37 PolarHBondContact NH1-OD1 2.83Å; R31-D37 IonicContact NH1-OD2 2.99Å; R31-D37 PolarHBondContact NH1-OD2 2.84Å; R31-D37 IonicContact NH2-OD1 3.94Å |
| 32 | K | 84.4 | Confident | 86.2 | Confident | 206 Ų | 206 | 88.4 Ų | 88.4 | 90% | 0.896 | 41% | 0.41 | S | S | * | . | trans | -67.2 | 102.6 | 171.9 | -171.6 | -179.8 | -176.9 | -178.7 | 0 | 108.1 | E34 | K32-E34 PolarHBondContact O-N 2.99Š| ||
| 33 | L | 87.1 | Confident | 86.6 | Confident | 22 Ų | 22 | 83.2 Ų | 83.2 | 12% | 0.115 | 39% | 0.394 | C | S | . | . | trans | -62.2 | 127.7 | 178.8 | -63.9 | -175.8 | 0 | 0 | 0 | 110.6 | I28 R31 D37 I38 L41 | I28-L33 HydrophobicContact CB-CD1 4.36Å; I28-L33 HydrophobicContact CD1-CD1 3.64Å; I28-L33 HydrophobicContact CG1-CD1 3.83Å; I28-L33 HydrophobicContact CG2-CD1 4.13Å; I28-L33 HydrophobicContact CG2-CG 4.46Å; R31-L33 HydrophobicContact CG-CD2 4.41Å; R31-L33 PolarHBondContact O-N 3.45Å; L33-D37 HydrophobicContact CB-CB 4.15Å; L33-D37 HydrophobicContact CD2-CB 3.93Å; L33-I38 HydrophobicContact CB-CD1 4.47Å; L33-I38 HydrophobicContact CB-CG1 3.89Å; L33-I38 HydrophobicContact CD1-CG1 4.06Å; L33-L41 HydrophobicContact CD1-CD1 4.14Å; L33-L41 HydrophobicContact CD2-CD1 3.81Å | ||
| 34 | E | 92.5 | Very high | 87 | Confident | 142 Ų | 142 | 84.3 Ų | 84.3 | 66% | 0.664 | 40% | 0.397 | S | S | * | . | trans | -78.2 | 165.6 | 169.6 | -60.4 | -160.1 | 91.6 | 0 | 0 | 110.9 | K32 A36 D37 I38 | K32-E34 PolarHBondContact O-N 2.99Å; E34-A36 PolarHBondContact O-N 3.48Å; E34-D37 PolarHBondContact N-OD2 3Å; E34-D37 WeakPolarHBondContact O-CB 3.49Å; E34-D37 PolarHBondContact O-N 2.95Å; E34-D37 VanDerWaalsContact O-N 3.12Å; E34-I38 WeakPolarHBondContact O-CG1 3.42Å; E34-I38 PolarHBondContact O-N 3.21Å | ||
| 35 | K | 92.2 | Very high | 87.4 | Confident | 121 Ų | 121 | 85.2 Ų | 85.2 | 53% | 0.526 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -60.4 | -30 | 178 | -179 | 170.3 | 171.8 | 171.3 | 0 | 112.3 | L13 L39 | L13-K35 HydrophobicContact CD1-CD 3.91Å; L13-K35 HydrophobicContact CD1-CG 4.11Å; L13-K35 HydrophobicContact CD2-CG 4.3Å; K35-L39 WeakPolarHBondContact O-CG 3.26Å; K35-L39 PolarHBondContact O-N 3.42Å |
| 36 | A | 94.6 | Very high | 88 | Confident | 73 Ų | 73 | 88.6 Ų | 88.6 | 60% | 0.603 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -67.3 | -49.9 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | E34 I38 L39 E40 | E34-A36 PolarHBondContact O-N 3.48Å; A36-I38 VanDerWaalsContact C-N 3.32Å; A36-I38 PolarHBondContact O-N 3.44Å; A36-L39 PolarHBondContact O-N 3.46Å; A36-L39 VanDerWaalsContact O-N 3.12Å; A36-E40 PolarHBondContact O-N 3.38Å |
| 37 | D | 91.9 | Very high | 88.8 | Confident | 26 Ų | 26 | 90 Ų | 90 | 14% | 0.139 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -55.3 | -44.6 | 176.8 | -71.6 | -58.1 | 0 | 0 | 0 | 112.5 | R31 L33 E34 L39 E40 L41 | R31-D37 IonicContact CZ-OD1 3.32Å; R31-D37 IonicContact NH1-OD1 2.76Å; R31-D37 PolarHBondContact NH1-OD1 2.83Å; R31-D37 IonicContact NH1-OD2 2.99Å; R31-D37 PolarHBondContact NH1-OD2 2.84Å; R31-D37 IonicContact NH2-OD1 3.94Å; L33-D37 HydrophobicContact CB-CB 4.15Å; L33-D37 HydrophobicContact CD2-CB 3.93Å; E34-D37 PolarHBondContact N-OD2 3Å; E34-D37 WeakPolarHBondContact O-CB 3.49Å; E34-D37 PolarHBondContact O-N 2.95Å; E34-D37 VanDerWaalsContact O-N 3.12Å; D37-L39 VanDerWaalsContact C-N 3.26Å; D37-L39 PolarHBondContact O-N 2.94Å; D37-E40 PolarHBondContact O-N 3.39Å; D37-L41 VanDerWaalsContact O-CB 3.25Å; D37-L41 WeakPolarHBondContact O-CB 3.46Å; D37-L41 VanDerWaalsContact O-CG 3.29Å; D37-L41 WeakPolarHBondContact O-CG 3.47Å; D37-L41 PolarHBondContact O-N 3.35Å |
| 38 | I | 92.8 | Very high | 89.3 | Confident | 19 Ų | 19 | 89.2 Ų | 89.2 | 10% | 0.097 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -58.1 | -43.4 | -179.9 | -66.4 | 170 | 0 | 0 | 0 | 110 | L13 L16 L33 E34 A36 S42 | L13-I38 HydrophobicContact CD2-CG2 4.04Å; L16-I38 HydrophobicContact CB-CG2 3.94Å; L33-I38 HydrophobicContact CB-CD1 4.47Å; L33-I38 HydrophobicContact CB-CG1 3.89Å; L33-I38 HydrophobicContact CD1-CG1 4.06Å; E34-I38 WeakPolarHBondContact O-CG1 3.42Å; E34-I38 PolarHBondContact O-N 3.21Å; A36-I38 VanDerWaalsContact C-N 3.32Å; A36-I38 PolarHBondContact O-N 3.44Å; I38-S42 VanDerWaalsContact O-CB 3.27Å; I38-S42 WeakPolarHBondContact O-CB 3.23Å; I38-S42 PolarHBondContact O-N 2.9Å; I38-S42 VanDerWaalsContact O-N 3.09Å; I38-S42 PolarHBondContact O-OG 3.18Å |
| 39 | L | 95.8 | Very high | 89.7 | Confident | 86 Ų | 86 | 92.2 Ų | 92.2 | 45% | 0.45 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -71.8 | -44.2 | 179.7 | -66.5 | 173.3 | 0 | 0 | 0 | 111.8 | L13 L16 K35 A36 D37 S42 V43 | L13-L39 HydrophobicContact CD2-CD2 4.19Å; L13-L39 HydrophobicContact CD2-CG 4.46Å; L16-L39 HydrophobicContact CD1-CD2 4.47Å; K35-L39 WeakPolarHBondContact O-CG 3.26Å; K35-L39 PolarHBondContact O-N 3.42Å; A36-L39 PolarHBondContact O-N 3.46Å; A36-L39 VanDerWaalsContact O-N 3.12Å; D37-L39 VanDerWaalsContact C-N 3.26Å; D37-L39 PolarHBondContact O-N 2.94Å; L39-S42 WeakPolarHBondContact O-CB 3.41Å; L39-S42 PolarHBondContact O-N 2.96Å; L39-V43 WeakPolarHBondContact O-CG2 3.5Å; L39-V43 PolarHBondContact O-N 2.95Å |
| 40 | E | 94.1 | Very high | 90 | Very high | 131 Ų | 131 | 89.8 Ų | 89.8 | 61% | 0.612 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -62 | -50 | 178.2 | -174.2 | -175.6 | 95.9 | 0 | 0 | 111.9 | A36 D37 S42 V43 K44 | A36-E40 PolarHBondContact O-N 3.38Å; D37-E40 PolarHBondContact O-N 3.39Å; E40-S42 VanDerWaalsContact C-N 3.26Å; E40-S42 PolarHBondContact O-N 3.26Å; E40-V43 PolarHBondContact O-N 2.96Å; E40-K44 WeakPolarHBondContact O-CB 3.47Å; E40-K44 PolarHBondContact O-N 3.42Å |
| 41 | L | 93.4 | Very high | 90.6 | Very high | 4 Ų | 4 | 86.2 Ų | 86.2 | 2% | 0.021 | 42% | 0.418 | C | S | . | . | H | α-helix | trans | -62.5 | -34.1 | 177.5 | -69.7 | 173.5 | 0 | 0 | 0 | 111.5 | L20 L33 D37 K44 Y45 | L20-L41 HydrophobicContact CD1-CB 3.68Å; L20-L41 HydrophobicContact CD2-CB 4.02Å; L20-L41 WeakPolarHBondContact CD2-O 3.48Å; L20-L41 HydrophobicContact CG-CB 4.47Å; L33-L41 HydrophobicContact CD1-CD1 4.14Å; L33-L41 HydrophobicContact CD2-CD1 3.81Å; D37-L41 VanDerWaalsContact O-CB 3.25Å; D37-L41 WeakPolarHBondContact O-CB 3.46Å; D37-L41 VanDerWaalsContact O-CG 3.29Å; D37-L41 WeakPolarHBondContact O-CG 3.47Å; D37-L41 PolarHBondContact O-N 3.35Å; L41-K44 PolarHBondContact O-N 3.05Å; L41-Y45 VanDerWaalsContact O-CB 3.3Å; L41-Y45 WeakPolarHBondContact O-CB 3.24Å; L41-Y45 PolarHBondContact O-N 3.17Å |
| 42 | S | 93.9 | Very high | 90.4 | Very high | 5 Ų | 5 | 85.4 Ų | 85.4 | 4% | 0.035 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -64.9 | -45.1 | 173.8 | -62.6 | 0 | 0 | 0 | 0 | 112.1 | I38 L39 E40 K44 Y45 M46 | I38-S42 VanDerWaalsContact O-CB 3.27Å; I38-S42 WeakPolarHBondContact O-CB 3.23Å; I38-S42 PolarHBondContact O-N 2.9Å; I38-S42 VanDerWaalsContact O-N 3.09Å; I38-S42 PolarHBondContact O-OG 3.18Å; L39-S42 WeakPolarHBondContact O-CB 3.41Å; L39-S42 PolarHBondContact O-N 2.96Å; E40-S42 VanDerWaalsContact C-N 3.26Å; E40-S42 PolarHBondContact O-N 3.26Å; S42-K44 VanDerWaalsContact C-N 3.35Å; S42-Y45 PolarHBondContact O-N 3.32Å; S42-M46 WeakPolarHBondContact O-CG 3.48Å; S42-M46 PolarHBondContact O-N 3.07Å |
| 43 | V | 94.7 | Very high | 89.6 | Confident | 79 Ų | 79 | 79 Ų | 79 | 48% | 0.479 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -64.1 | -41.5 | 175.6 | 173.2 | 0 | 0 | 0 | 0 | 110.9 | L39 E40 M46 R47 | L39-V43 WeakPolarHBondContact O-CG2 3.5Å; L39-V43 PolarHBondContact O-N 2.95Å; E40-V43 PolarHBondContact O-N 2.96Å; V43-M46 HydrophobicContact CG2-CE 4.24Å; V43-M46 PolarHBondContact O-N 3.34Å; V43-R47 WeakPolarHBondContact O-CB 3.27Å; V43-R47 PolarHBondContact O-N 3.1Å |
| 44 | K | 92.9 | Very high | 88.2 | Confident | 125 Ų | 125 | 83.6 Ų | 83.6 | 54% | 0.543 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -63.2 | -41.9 | 175.7 | -170.4 | 170.5 | -175.1 | 168.1 | 0 | 112.1 | E40 L41 S42 R47 S48 | E40-K44 WeakPolarHBondContact O-CB 3.47Å; E40-K44 PolarHBondContact O-N 3.42Å; L41-K44 PolarHBondContact O-N 3.05Å; S42-K44 VanDerWaalsContact C-N 3.35Å; K44-R47 PolarHBondContact O-N 3.35Å; K44-S48 WeakPolarHBondContact O-CB 3.47Å; K44-S48 PolarHBondContact O-N 3.02Å |
| 45 | Y | 91.8 | Very high | 86.3 | Confident | 53 Ų | 53 | 80.2 Ų | 80.2 | 21% | 0.208 | 43% | 0.427 | C | S | . | . | H | α-helix | trans | -61 | -49.7 | 174.3 | 178.3 | -106.3 | 0 | 0 | 0 | 111.6 | L19 L20 H23 Y24 L41 S42 R47 S48 L49 | L19-Y45 HydrophobicContact CD2-CD1 3.84Å; L19-Y45 HydrophobicContact CD2-CE1 3.69Å; L19-Y45 HydrophobicContact CG-CE1 4.22Å; L20-Y45 HydrophobicContact CD2-CG 4.34Å; H23-Y45 HydrophobicContact CB-CD2 4.17Å; H23-Y45 HydrophobicContact CB-CE2 4.08Å; H23-Y45 AromaticContact CD2-CE2 3.91Å; H23-Y45 AromaticContact CG-CD2 3.92Å; H23-Y45 AromaticContact CG-CE2 3.9Å; Y24-Y45 HydrophobicContact CE2-CD2 4.43Å; L41-Y45 VanDerWaalsContact O-CB 3.3Å; L41-Y45 WeakPolarHBondContact O-CB 3.24Å; L41-Y45 PolarHBondContact O-N 3.17Å; S42-Y45 PolarHBondContact O-N 3.32Å; Y45-R47 VanDerWaalsContact C-N 3.35Å; Y45-R47 PolarHBondContact O-N 3.41Å; Y45-S48 WeakPolarHBondContact O-CB 3.45Å; Y45-S48 PolarHBondContact O-N 2.98Å; Y45-L49 HydrophobicContact CE1-CD2 4.45Å; Y45-L49 WeakPolarHBondContact O-CB 3.29Å; Y45-L49 PolarHBondContact O-N 3.04Å |
| 46 | M | 93.4 | Very high | 84.4 | Confident | 99 Ų | 99 | 80.9 Ų | 80.9 | 49% | 0.488 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -61.7 | -40.3 | 178.3 | -70.6 | -175.4 | -65.4 | 0 | 0 | 112.3 | S42 V43 L49 Q50 | S42-M46 WeakPolarHBondContact O-CG 3.48Å; S42-M46 PolarHBondContact O-N 3.07Å; V43-M46 HydrophobicContact CG2-CE 4.24Å; V43-M46 PolarHBondContact O-N 3.34Å; M46-L49 PolarHBondContact O-N 3.26Å; M46-Q50 WeakPolarHBondContact O-CB 3.25Å; M46-Q50 WeakPolarHBondContact O-CG 3.45Å; M46-Q50 PolarHBondContact O-N 3.44Å |
| 47 | R | 90.5 | Very high | 82.3 | Confident | 164 Ų | 164 | 86.2 Ų | 86.2 | 62% | 0.619 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -66.8 | -40.6 | 175.2 | -172.4 | 177.6 | -67.7 | -165 | -0.7 | 112 | V43 K44 Y45 L49 Q50 N51 | V43-R47 WeakPolarHBondContact O-CB 3.27Å; V43-R47 PolarHBondContact O-N 3.1Å; K44-R47 PolarHBondContact O-N 3.35Å; Y45-R47 VanDerWaalsContact C-N 3.35Å; Y45-R47 PolarHBondContact O-N 3.41Å; R47-L49 VanDerWaalsContact C-N 3.33Å; R47-Q50 PolarHBondContact O-N 3.19Å; R47-N51 WeakPolarHBondContact O-CB 3.47Å; R47-N51 PolarHBondContact O-N 2.99Å |
| 48 | S | 88 | Confident | 80.1 | Confident | 55 Ų | 55 | 89 Ų | 89 | 39% | 0.385 | 46% | 0.46 | S | S | . | . | H | α-helix | trans | -61.6 | -42.7 | 174.2 | -166 | 0 | 0 | 0 | 0 | 111.4 | K44 Y45 N51 S52 | K44-S48 WeakPolarHBondContact O-CB 3.47Å; K44-S48 PolarHBondContact O-N 3.02Å; Y45-S48 WeakPolarHBondContact O-CB 3.45Å; Y45-S48 PolarHBondContact O-N 2.98Å; S48-N51 PolarHBondContact O-N 3.35Å; S48-S52 WeakPolarHBondContact O-CB 3.46Å; S48-S52 PolarHBondContact O-N 3.12Å |
| 49 | L | 88.8 | Confident | 78.3 | Confident | 79 Ų | 79 | 93 Ų | 93 | 41% | 0.414 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -64.7 | -44.3 | 175.9 | -174.8 | 65.1 | 0 | 0 | 0 | 111.3 | Y45 M46 R47 N51 S52 L53 | Y45-L49 HydrophobicContact CE1-CD2 4.45Å; Y45-L49 WeakPolarHBondContact O-CB 3.29Å; Y45-L49 PolarHBondContact O-N 3.04Å; M46-L49 PolarHBondContact O-N 3.26Å; R47-L49 VanDerWaalsContact C-N 3.33Å; L49-N51 PolarHBondContact O-N 3.03Å; L49-S52 PolarHBondContact O-N 2.62Å; L49-L53 HydrophobicContact CD1-CD1 3.7Å; L49-L53 HydrophobicContact CG-CD1 4.17Å; L49-L53 WeakPolarHBondContact O-CB 3.38Å; L49-L53 PolarHBondContact O-N 2.88Å |
| 50 | Q | 86.3 | Confident | 76.1 | Confident | 116 Ų | 116 | 94.7 Ų | 94.7 | 54% | 0.542 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -63.3 | -38.5 | 175.8 | -77.5 | 174.9 | -12.8 | 0 | 0 | 113 | M46 R47 L53 Q54 | M46-Q50 WeakPolarHBondContact O-CB 3.25Å; M46-Q50 WeakPolarHBondContact O-CG 3.45Å; M46-Q50 PolarHBondContact O-N 3.44Å; R47-Q50 PolarHBondContact O-N 3.19Å; Q50-L53 PolarHBondContact O-N 3.45Å; Q50-Q54 WeakPolarHBondContact O-CB 3.42Å; Q50-Q54 VanDerWaalsContact O-CG 3.32Å; Q50-Q54 WeakPolarHBondContact O-CG 3.41Å; Q50-Q54 PolarHBondContact O-N 3.09Å; Q50-Q54 PolarHBondContact O-NE2 3.34Å; Q50-Q54 VanDerWaalsContact O-NE2 3.08Å |
| 51 | N | 82.7 | Confident | 74 | Confident | 104 Ų | 104 | 93.5 Ų | 93.5 | 56% | 0.556 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -68.7 | -38.7 | 175 | -71.9 | -14.9 | 0 | 0 | 0 | 111.3 | R47 S48 L49 Q54 | R47-N51 WeakPolarHBondContact O-CB 3.47Å; R47-N51 PolarHBondContact O-N 2.99Å; S48-N51 PolarHBondContact O-N 3.35Å; L49-N51 PolarHBondContact O-N 3.03Å; N51-Q54 PolarHBondContact OD1-NE2 2.85Å |
| 52 | S | 77.9 | Confident | 72.2 | Confident | 84 Ų | 84 | 96.6 Ų | 96.6 | 59% | 0.587 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -69.2 | -33.6 | 174 | -170.1 | 0 | 0 | 0 | 0 | 112.9 | S48 L49 | S48-S52 WeakPolarHBondContact O-CB 3.46Å; S48-S52 PolarHBondContact O-N 3.12Å; L49-S52 PolarHBondContact O-N 2.62Å |
| 53 | L | 65.7 | Low | 70.1 | Confident | 71 Ų | 71 | 100.3 Ų | 100.3 | 37% | 0.372 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -83.5 | -18.3 | 177.1 | -102.6 | 79.4 | 0 | 0 | 0 | 113.2 | L49 Q50 G55 L56 W57 | L49-L53 HydrophobicContact CD1-CD1 3.7Å; L49-L53 HydrophobicContact CG-CD1 4.17Å; L49-L53 WeakPolarHBondContact O-CB 3.38Å; L49-L53 PolarHBondContact O-N 2.88Å; Q50-L53 PolarHBondContact O-N 3.45Å; L53-G55 PolarHBondContact O-N 3.34Å; L53-L56 CarbonylContact O-C 3.52Å; L53-L56 PolarHBondContact O-N 3.29Å; L53-W57 HydrophobicContact CD2-CB 4.34Å; L53-W57 HydrophobicContact CD2-CE3 4.35Å; L53-W57 PolarHBondContact O-N 3.04Å |
| 54 | Q | 57.9 | Low | 68.4 | Low | 120 Ų | 120 | 105.3 Ų | 105.3 | 56% | 0.561 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.8 | -14.9 | 175.8 | -91.6 | 166.4 | 81.5 | 0 | 0 | 113.4 | Q50 N51 | Q50-Q54 WeakPolarHBondContact O-CB 3.42Å; Q50-Q54 VanDerWaalsContact O-CG 3.32Å; Q50-Q54 WeakPolarHBondContact O-CG 3.41Å; Q50-Q54 PolarHBondContact O-N 3.09Å; Q50-Q54 PolarHBondContact O-NE2 3.34Å; Q50-Q54 VanDerWaalsContact O-NE2 3.08Å; N51-Q54 PolarHBondContact OD1-NE2 2.85Å |
| 55 | G | 52.7 | Low | 66.7 | Low | 70 Ų | 70 | 107.6 Ų | 107.6 | 72% | 0.722 | 60% | 0.601 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.5 | -11 | 166.8 | 0 | 0 | 0 | 0 | 0 | 115.8 | L53 | L53-G55 PolarHBondContact O-N 3.34Š|
| 56 | L | 52.4 | Low | 65 | Low | 135 Ų | 135 | 109 Ų | 109 | 71% | 0.707 | 62% | 0.617 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -128.1 | -22.3 | -176.1 | -80.9 | 85.9 | 0 | 0 | 0 | 114.5 | L53 | L53-L56 CarbonylContact O-C 3.52Å; L53-L56 PolarHBondContact O-N 3.29Å |
| 57 | W | 49.8 | Very low | 63.3 | Low | 185 Ų | 185 | 109.6 Ų | 109.6 | 70% | 0.701 | 63% | 0.631 | S | S | * | * | trans | -141.5 | 101.2 | -179.2 | -107.7 | -80 | 0 | 0 | 0 | 109.5 | L53 V59 | L53-W57 HydrophobicContact CD2-CB 4.34Å; L53-W57 HydrophobicContact CD2-CE3 4.35Å; L53-W57 PolarHBondContact O-N 3.04Å; W57-V59 PolarHBondContact O-N 3.01Å | ||
| 58 | P | 47.3 | Very low | 61.7 | Low | 85 Ų | 85 | 104.5 Ų | 104.5 | 55% | 0.552 | 63% | 0.629 | S | S | * | * | trans | -59.5 | 121.9 | 162.6 | -19.6 | 32.5 | 0 | 0 | 0 | 108.8 | P60 | P58-P60 WeakPolarHBondContact O-CD 3.48Š| ||
| 59 | V | 53.7 | Low | 60.1 | Low | 103 Ų | 103 | 110.3 Ų | 110.3 | 62% | 0.624 | 65% | 0.648 | S | S | * | * | trans | -59.2 | 126.6 | 157.6 | 168.3 | 0 | 0 | 0 | 0 | 106.2 | W57 S61 | W57-V59 PolarHBondContact O-N 3.01Å; V59-S61 PolarHBondContact O-N 3.34Å | ||
| 60 | P | 49.7 | Very low | 58.6 | Low | 121 Ų | 121 | 117.6 Ų | 117.6 | 79% | 0.786 | 67% | 0.67 | S | S | * | * | trans | -75.9 | 65 | 180 | 31.8 | -35.3 | 0 | 0 | 0 | 110.6 | P58 G62 | P58-P60 WeakPolarHBondContact O-CD 3.48Å; P60-G62 VanDerWaalsContact C-N 3.25Å; P60-G62 PolarHBondContact O-N 2.67Å; P60-G62 VanDerWaalsContact O-N 3.07Å | ||
| 61 | S | 51.6 | Low | 57.3 | Low | 106 Ų | 106 | 116.6 Ų | 116.6 | 74% | 0.741 | 68% | 0.675 | S | S | * | * | trans | -81.3 | 73 | 171.4 | -179.8 | 0 | 0 | 0 | 0 | 109.4 | V59 | V59-S61 PolarHBondContact O-N 3.34Š| ||
| 62 | G | 53.8 | Low | 56.2 | Low | 69 Ų | 69 | 116.5 Ų | 116.5 | 71% | 0.711 | 68% | 0.682 | S | S | * | * | S | Bend | trans | 54.3 | 87.2 | 162.3 | 0 | 0 | 0 | 0 | 0 | 117.1 | P60 | P60-G62 VanDerWaalsContact C-N 3.25Å; P60-G62 PolarHBondContact O-N 2.67Å; P60-G62 VanDerWaalsContact O-N 3.07Å |
| 63 | A | 51.3 | Low | 55.4 | Low | 84 Ų | 84 | 118.5 Ų | 118.5 | 69% | 0.694 | 69% | 0.685 | S | S | * | * | S | Bend | trans | 60.1 | 117.8 | -176.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||
| 64 | E | 58.4 | Low | 54.9 | Low | 183 Ų | 183 | 120 Ų | 120 | 86% | 0.855 | 70% | 0.699 | S | S | * | * | cis | -140.8 | 141.1 | 45 | -68.7 | 143.9 | 138.8 | 0 | 0 | 111.2 | ||||
| 65 | H | 56.9 | Low | 54.9 | Low | 173 Ų | 173 | 116.4 Ų | 116.4 | 80% | 0.801 | 70% | 0.695 | S | S | * | * | trans | -83.9 | 126.5 | 177.4 | -64.4 | 94.4 | 0 | 0 | 0 | 110.1 | S67 | H65-S67 PolarHBondContact O-N 3.32Š| ||
| 66 | P | 56.4 | Low | 55.2 | Low | 84 Ų | 84 | 116.8 Ų | 116.8 | 55% | 0.545 | 68% | 0.683 | S | S | . | * | trans | -63 | 121.9 | 177 | 25 | -32.7 | 0 | 0 | 0 | 110.1 | G68 F69 | P66-G68 PolarHBondContact O-N 3.21Å; P66-F69 PolarHBondContact O-N 3.46Å | ||
| 67 | S | 57.8 | Low | 55.6 | Low | 111 Ų | 111 | 114.1 Ų | 114.1 | 78% | 0.776 | 68% | 0.676 | S | S | * | * | G | 310 helix | trans | -59.9 | -16.4 | -169 | 48.2 | 0 | 0 | 0 | 0 | 115.1 | H65 | H65-S67 PolarHBondContact O-N 3.32Š|
| 68 | G | 57.3 | Low | 56 | Low | 56 Ų | 56 | 112.2 Ų | 112.2 | 58% | 0.577 | 68% | 0.675 | S | S | * | * | G | 310 helix | trans | -69.7 | -28.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 115.7 | P66 R70 S71 | P66-G68 PolarHBondContact O-N 3.21Å; G68-R70 PolarHBondContact O-N 3.24Å; G68-S71 PolarHBondContact O-N 3.37Å |
| 69 | F | 53.8 | Low | 56.4 | Low | 177 Ų | 177 | 114.6 Ų | 114.6 | 78% | 0.776 | 68% | 0.682 | S | S | * | * | G | 310 helix | trans | -69.7 | -21.5 | -174.6 | -166.4 | -102.8 | 0 | 0 | 0 | 113.3 | P66 S71 | P66-F69 PolarHBondContact O-N 3.46Å; F69-S71 VanDerWaalsContact C-N 3.31Å; F69-S71 PolarHBondContact O-N 3.29Å |
| 70 | R | 58 | Low | 56.7 | Low | 232 Ų | 232 | 116.1 Ų | 116.1 | 88% | 0.875 | 69% | 0.686 | S | S | * | * | G | 310 helix | trans | -75 | -15.1 | -177.9 | -58.2 | -161.1 | 77.8 | -136.3 | 2.6 | 114.3 | G68 | G68-R70 PolarHBondContact O-N 3.24Š|
| 71 | S | 58.3 | Low | 57 | Low | 95 Ų | 95 | 120.9 Ų | 120.9 | 66% | 0.664 | 69% | 0.688 | S | S | * | * | G | 310 helix | trans | -84.4 | -12.1 | -178.8 | -70.2 | 0 | 0 | 0 | 0 | 114.9 | G68 F69 L73 P74 | G68-S71 PolarHBondContact O-N 3.37Å; F69-S71 VanDerWaalsContact C-N 3.31Å; F69-S71 PolarHBondContact O-N 3.29Å; S71-L73 PolarHBondContact O-N 3.05Å; S71-P74 WeakPolarHBondContact O-CD 3.43Å |
| 72 | C | 58.5 | Low | 57 | Low | 103 Ų | 103 | 125.3 Ų | 125.3 | 70% | 0.696 | 69% | 0.689 | S | S | * | * | G | 310 helix | trans | -80.6 | -1.1 | -172.2 | -95.2 | 0 | 0 | 0 | 0 | 116.2 | ||
| 73 | L | 61.3 | Low | 56.8 | Low | 125 Ų | 125 | 124.9 Ų | 124.9 | 65% | 0.654 | 68% | 0.684 | S | S | * | * | trans | -132.3 | 59 | 179 | -63.3 | 173.8 | 0 | 0 | 0 | 114.9 | S71 G75 V76 | S71-L73 PolarHBondContact O-N 3.05Å; L73-G75 VanDerWaalsContact C-N 3.26Å; L73-G75 PolarHBondContact O-N 3.48Å; L73-V76 HydrophobicContact CB-CG2 4.5Å; L73-V76 HydrophobicContact CD2-CG2 4.02Å | ||
| 74 | P | 56.9 | Low | 56.9 | Low | 102 Ų | 102 | 127.9 Ų | 127.9 | 66% | 0.662 | 69% | 0.688 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.2 | -22.9 | 174.6 | -16.7 | 32.2 | 0 | 0 | 0 | 113.9 | S71 | S71-P74 WeakPolarHBondContact O-CD 3.43Š|
| 75 | G | 57.2 | Low | 56.8 | Low | 46 Ų | 46 | 126.5 Ų | 126.5 | 47% | 0.474 | 68% | 0.682 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -86.4 | -30.5 | -171.3 | 0 | 0 | 0 | 0 | 0 | 116.1 | L73 Q78 L79 | L73-G75 VanDerWaalsContact C-N 3.26Å; L73-G75 PolarHBondContact O-N 3.48Å; G75-Q78 PolarHBondContact O-N 3Å; G75-L79 WeakPolarHBondContact O-CB 3.38Å; G75-L79 PolarHBondContact O-N 3.12Å |
| 76 | V | 58.2 | Low | 56.4 | Low | 78 Ų | 78 | 124 Ų | 124 | 47% | 0.473 | 68% | 0.679 | S | S | . | * | H | α-helix | trans | -74.1 | -39.7 | -167.3 | -174.5 | 0 | 0 | 0 | 0 | 112.3 | L73 Q78 L79 L80 | L73-V76 HydrophobicContact CB-CG2 4.5Å; L73-V76 HydrophobicContact CD2-CG2 4.02Å; V76-Q78 VanDerWaalsContact C-N 3.33Å; V76-Q78 PolarHBondContact O-N 3.22Å; V76-L79 PolarHBondContact O-N 3.39Å; V76-L80 HydrophobicContact CG1-CD1 4.27Å; V76-L80 WeakPolarHBondContact O-CG 3.5Å; V76-L80 PolarHBondContact O-N 2.91Å |
| 77 | S | 60.7 | Low | 56.2 | Low | 79 Ų | 79 | 124.2 Ų | 124.2 | 55% | 0.552 | 70% | 0.696 | S | S | * | * | H | α-helix | trans | -68 | -31.9 | 177.1 | 54.2 | 0 | 0 | 0 | 0 | 112.8 | R81 | S77-R81 WeakPolarHBondContact O-CB 3.43Å; S77-R81 PolarHBondContact O-N 3.12Å; S77-R81 VanDerWaalsContact O-N 3.15Å |
| 78 | Q | 59.1 | Low | 55.8 | Low | 145 Ų | 145 | 121.7 Ų | 121.7 | 68% | 0.678 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -76.8 | -33.9 | 176.5 | -160 | 176.6 | 54.3 | 0 | 0 | 111.9 | G75 V76 R81 R82 | G75-Q78 PolarHBondContact O-N 3Å; V76-Q78 VanDerWaalsContact C-N 3.33Å; V76-Q78 PolarHBondContact O-N 3.22Å; Q78-R81 PolarHBondContact O-N 2.71Å; Q78-R82 WeakPolarHBondContact O-CB 3.5Å; Q78-R82 PolarHBondContact O-N 3.21Å; Q78-R82 VanDerWaalsContact O-N 3.13Å |
| 79 | L | 55.5 | Low | 55.5 | Low | 134 Ų | 134 | 122.1 Ų | 122.1 | 70% | 0.702 | 69% | 0.692 | S | S | * | * | H | α-helix | trans | -66.1 | -44.5 | 173.1 | -156.2 | 76.8 | 0 | 0 | 0 | 111.3 | G75 V76 R81 R82 G83 | G75-L79 WeakPolarHBondContact O-CB 3.38Å; G75-L79 PolarHBondContact O-N 3.12Å; V76-L79 PolarHBondContact O-N 3.39Å; L79-R81 VanDerWaalsContact C-N 3.34Å; L79-R81 PolarHBondContact O-N 3.33Å; L79-R82 PolarHBondContact O-N 3.39Å; L79-G83 PolarHBondContact O-N 3.06Å |
| 80 | L | 59.9 | Low | 55.3 | Low | 136 Ų | 136 | 122 Ų | 122 | 71% | 0.712 | 70% | 0.699 | S | S | * | * | H | α-helix | trans | -62.5 | -37.8 | 175.1 | -72.8 | 168.7 | 0 | 0 | 0 | 112.5 | V76 R82 G83 | V76-L80 HydrophobicContact CG1-CD1 4.27Å; V76-L80 WeakPolarHBondContact O-CG 3.5Å; V76-L80 PolarHBondContact O-N 2.91Å; L80-R82 VanDerWaalsContact C-N 3.3Å; L80-R82 PolarHBondContact O-N 3.4Å; L80-G83 PolarHBondContact O-N 2.97Å |
| 81 | R | 56.5 | Low | 54.9 | Low | 221 Ų | 221 | 118 Ų | 118 | 83% | 0.834 | 69% | 0.694 | S | S | * | * | H | α-helix | trans | -73 | -18.8 | 176 | -172.5 | 170.1 | -68.4 | -176.5 | -1.4 | 113.9 | S77 Q78 L79 | S77-R81 WeakPolarHBondContact O-CB 3.43Å; S77-R81 PolarHBondContact O-N 3.12Å; S77-R81 VanDerWaalsContact O-N 3.15Å; Q78-R81 PolarHBondContact O-N 2.71Å; L79-R81 VanDerWaalsContact C-N 3.34Å; L79-R81 PolarHBondContact O-N 3.33Å |
| 82 | R | 52.1 | Low | 54 | Low | 199 Ų | 199 | 119.1 Ų | 119.1 | 75% | 0.751 | 70% | 0.7 | S | S | * | * | H | α-helix | trans | -92.3 | -6.8 | 175.4 | -174.2 | 174.2 | -78.6 | -92.3 | 4.3 | 112.7 | Q78 L79 L80 D84 | Q78-R82 WeakPolarHBondContact O-CB 3.5Å; Q78-R82 PolarHBondContact O-N 3.21Å; Q78-R82 VanDerWaalsContact O-N 3.13Å; L79-R82 PolarHBondContact O-N 3.39Å; L80-R82 VanDerWaalsContact C-N 3.3Å; L80-R82 PolarHBondContact O-N 3.4Å; R82-D84 VanDerWaalsContact C-N 3.35Å; R82-D84 PolarHBondContact O-N 3.39Å |
| 83 | G | 49.1 | Very low | 53.5 | Low | 59 Ų | 59 | 120 Ų | 120 | 61% | 0.608 | 71% | 0.705 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.6 | -8.5 | -175.6 | 0 | 0 | 0 | 0 | 0 | 116.3 | L79 L80 | L79-G83 PolarHBondContact O-N 3.06Å; L80-G83 PolarHBondContact O-N 2.97Å |
| 84 | D | 54 | Low | 52.5 | Low | 147 Ų | 147 | 121.5 Ų | 121.5 | 79% | 0.786 | 71% | 0.713 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -88 | -14.2 | -174.8 | -141.2 | -142.7 | 0 | 0 | 0 | 113.5 | R82 | R82-D84 VanDerWaalsContact C-N 3.35Å; R82-D84 PolarHBondContact O-N 3.39Å |
| 85 | E | 55.7 | Low | 51.9 | Low | 154 Ų | 154 | 122.9 Ų | 122.9 | 72% | 0.72 | 72% | 0.719 | S | S | * | * | S | Bend | trans | -105.9 | -8.3 | -162.4 | -58.7 | -65 | 133.2 | 0 | 0 | 115.7 | ||
| 86 | V | 47.4 | Very low | 51.3 | Low | 121 Ų | 121 | 126.7 Ų | 126.7 | 73% | 0.733 | 74% | 0.735 | S | S | * | * | trans | -143.9 | 102.7 | 175.1 | -176.1 | 0 | 0 | 0 | 0 | 111.4 | G88 | V86-G88 PolarHBondContact O-N 3.3Š| ||
| 87 | G | 53.4 | Low | 50.5 | Low | 89 Ų | 89 | 129.3 Ų | 129.3 | 92% | 0.918 | 74% | 0.742 | S | S | * | * | trans | -69.5 | 114.2 | 156.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||||
| 88 | G | 48.5 | Very low | 49.6 | Very low | 57 Ų | 57 | 136 Ų | 136 | 59% | 0.588 | 76% | 0.756 | S | S | * | * | trans | 170.9 | 121.7 | -179.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | V86 L90 | V86-G88 PolarHBondContact O-N 3.3Å; G88-L90 PolarHBondContact O-N 3.45Å | ||
| 89 | G | 52 | Low | 48.7 | Very low | 66 Ų | 66 | 133.9 Ų | 133.9 | 68% | 0.68 | 76% | 0.763 | S | S | * | * | trans | -64.6 | 131.5 | -169.4 | 0 | 0 | 0 | 0 | 0 | 113.8 | L91 | G89-L91 PolarHBondContact O-N 3.13Š| ||
| 90 | L | 49.5 | Very low | 48.1 | Very low | 175 Ų | 175 | 132.7 Ų | 132.7 | 92% | 0.916 | 77% | 0.773 | S | S | * | * | trans | -92.5 | 87.6 | 166.2 | -66.3 | -179.8 | 0 | 0 | 0 | 109.5 | G88 | G88-L90 PolarHBondContact O-N 3.45Š| ||
| 91 | L | 48.6 | Very low | 47 | Very low | 147 Ų | 147 | 129.6 Ų | 129.6 | 77% | 0.77 | 77% | 0.773 | S | S | * | * | trans | -66 | 124.8 | 167.6 | -76.4 | -73 | 0 | 0 | 0 | 108.1 | G89 P93 | G89-L91 PolarHBondContact O-N 3.13Å; L91-P93 WeakPolarHBondContact O-CD 3.43Å | ||
| 92 | C | 39 | Very low | 46.2 | Very low | 118 Ų | 118 | 124.7 Ų | 124.7 | 80% | 0.797 | 77% | 0.773 | S | S | * | * | trans | -69.7 | 116.5 | 168.3 | -69.8 | 0 | 0 | 0 | 0 | 109.5 | L94 | C92-L94 PolarHBondContact O-N 2.88Š| ||
| 93 | P | 49.3 | Very low | 46.2 | Very low | 123 Ų | 123 | 120.8 Ų | 120.8 | 80% | 0.799 | 77% | 0.771 | S | S | * | * | trans | -87 | 90.2 | 175.5 | 6.2 | 14.1 | 0 | 0 | 0 | 108.7 | L91 | L91-P93 WeakPolarHBondContact O-CD 3.43Š| ||
| 94 | L | 39.8 | Very low | 46.2 | Very low | 156 Ų | 156 | 126.1 Ų | 126.1 | 82% | 0.817 | 78% | 0.782 | S | S | * | * | trans | -126.5 | 103.9 | 165.8 | -71.6 | 177.1 | 0 | 0 | 0 | 109 | C92 P96 | C92-L94 PolarHBondContact O-N 2.88Å; L94-P96 WeakPolarHBondContact O-CD 3.43Å | ||
| 95 | V | 45.1 | Very low | 45.5 | Very low | 130 Ų | 130 | 126 Ų | 126 | 79% | 0.788 | 78% | 0.781 | S | S | * | * | trans | -60.9 | 134.3 | 176.7 | 173.5 | 0 | 0 | 0 | 0 | 110.3 | E97 | V95-E97 HydrophobicContact CG1-CB 4.29Š| ||
| 96 | P | 44.6 | Very low | 45.1 | Very low | 127 Ų | 127 | 123.7 Ų | 123.7 | 83% | 0.825 | 78% | 0.783 | S | S | * | * | -111.2 | 137.3 | 125.5 | -14.1 | 31.8 | 0 | 0 | 0 | 112.7 | L94 | L94-P96 WeakPolarHBondContact O-CD 3.43Š| |||
| 97 | E | 40.8 | Very low | 44.6 | Very low | 132 Ų | 132 | 123.3 Ų | 123.3 | 62% | 0.617 | 79% | 0.792 | S | S | * | * | trans | -89.4 | 144.1 | 177.3 | -170.8 | -136.5 | 92.5 | 0 | 0 | 110.8 | V95 | V95-E97 HydrophobicContact CG1-CB 4.29Š| ||
| 98 | R | 41.1 | Very low | 43.8 | Very low | 220 Ų | 220 | 122.5 Ų | 122.5 | 83% | 0.83 | 78% | 0.784 | S | S | * | * | trans | 65.6 | 146.7 | 175 | -76.4 | 176.7 | 173.7 | 116 | -7.1 | 116.4 | ||||
| 99 | A | 41 | Very low | 43.1 | Very low | 100 Ų | 100 | 127.9 Ų | 127.9 | 83% | 0.826 | 80% | 0.798 | S | S | * | * | cis | -136.6 | 159.9 | 6.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 100 | A | 43.8 | Very low | 42.2 | Very low | 110 Ų | 110 | 128.5 Ų | 128.5 | 91% | 0.909 | 81% | 0.805 | S | S | * | * | trans | -97.9 | 150.3 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 101 | G | 35.6 | Very low | 41.5 | Very low | 70 Ų | 70 | 128.9 Ų | 128.9 | 72% | 0.722 | 80% | 0.802 | S | S | * | * | trans | 133.2 | 92.9 | -179.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 102 | S | 39.4 | Very low | 40.7 | Very low | 119 Ų | 119 | 130.9 Ų | 130.9 | 83% | 0.832 | 81% | 0.807 | S | S | * | * | 55.6 | 119.3 | 73.5 | -154.4 | 0 | 0 | 0 | 0 | 110.9 | |||||
| 103 | T | 53.2 | Low | 40.6 | Very low | 117 Ų | 117 | 128.8 Ų | 128.8 | 72% | 0.718 | 80% | 0.799 | S | S | * | * | cis | -168.7 | 158.1 | 39.8 | -173.8 | 0 | 0 | 0 | 0 | 113.4 | ||||
| 104 | M | 47.5 | Very low | 40 | Very low | 170 Ų | 170 | 129.3 Ų | 129.3 | 84% | 0.837 | 80% | 0.802 | S | S | * | * | trans | 62.8 | 154.5 | 168.3 | -36.8 | -148.5 | 97.3 | 0 | 0 | 117.9 | ||||
| 105 | D | 39.4 | Very low | 39.9 | Very low | 144 Ų | 144 | 125.5 Ų | 125.5 | 77% | 0.77 | 79% | 0.793 | S | S | * | * | cis | -144.3 | 174.9 | 4.2 | -171 | -147.9 | 0 | 0 | 0 | 111.5 | ||||
| 106 | S | 48.6 | Very low | 39.8 | Very low | 107 Ų | 107 | 126.8 Ų | 126.8 | 75% | 0.748 | 80% | 0.795 | S | S | * | * | trans | -107.9 | 142.1 | -167.1 | -54.6 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 107 | A | 37.3 | Very low | 39.6 | Very low | 112 Ų | 112 | 130.7 Ų | 130.7 | 93% | 0.926 | 79% | 0.794 | S | S | * | * | trans | 165.1 | 146.5 | 146.2 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 108 | G | 36.4 | Very low | 39.7 | Very low | 73 Ų | 73 | 127.2 Ų | 127.2 | 75% | 0.753 | 79% | 0.794 | S | S | * | * | cis | -168.3 | 173.8 | -1.9 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 109 | L | 32.4 | Very low | 39.7 | Very low | 169 Ų | 169 | 123.1 Ų | 123.1 | 89% | 0.885 | 80% | 0.796 | S | S | * | * | trans | -60.6 | 144.1 | -171 | -76.7 | 132.3 | 0 | 0 | 0 | 115.1 | ||||
| 110 | G | 33.5 | Very low | 39.7 | Very low | 79 Ų | 79 | 124.6 Ų | 124.6 | 81% | 0.814 | 80% | 0.799 | S | S | * | * | trans | -166 | 58.4 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 111 | Q | 35.8 | Very low | 39.9 | Very low | 184 Ų | 184 | 125.4 Ų | 125.4 | 86% | 0.86 | 79% | 0.792 | S | S | * | * | trans | -73.8 | 130.4 | 172.8 | -65 | 178.7 | -75.4 | 0 | 0 | 110.7 | ||||
| 112 | E | 31.9 | Very low | 40.3 | Very low | 188 Ų | 188 | 128 Ų | 128 | 88% | 0.879 | 80% | 0.797 | S | S | * | * | trans | -144.3 | 145.2 | 142.9 | -140.9 | -129.7 | 91.4 | 0 | 0 | 109.1 | ||||
| 113 | A | 35.8 | Very low | 40.6 | Very low | 75 Ų | 75 | 127.3 Ų | 127.3 | 62% | 0.62 | 80% | 0.798 | S | S | * | * | trans | -107.2 | 134.2 | -164.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | A115 | A113-A115 PolarHBondContact O-N 3.5Š| ||
| 114 | P | 37.8 | Very low | 40.1 | Very low | 134 Ų | 134 | 128.4 Ų | 128.4 | 87% | 0.87 | 80% | 0.804 | S | S | * | * | trans | -73.2 | 105 | 175.1 | 23.9 | -22.4 | 0 | 0 | 0 | 110.1 | ||||
| 115 | A | 36.9 | Very low | 39.7 | Very low | 76 Ų | 76 | 131.6 Ų | 131.6 | 63% | 0.628 | 81% | 0.807 | S | S | * | * | trans | -68.9 | 148.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | A113 Y117 | A113-A115 PolarHBondContact O-N 3.5Å; A115-Y117 HydrophobicContact CB-CD2 4.42Å; A115-Y117 HydrophobicContact CB-CE2 3.58Å | ||
| 116 | L | 42.1 | Very low | 39.8 | Very low | 157 Ų | 157 | 128.8 Ų | 128.8 | 82% | 0.822 | 80% | 0.804 | S | S | * | * | trans | -105.6 | 97.5 | -159.2 | -170.3 | 167.7 | 0 | 0 | 0 | 111.8 | ||||
| 117 | Y | 42.1 | Very low | 39.6 | Very low | 208 Ų | 208 | 129.1 Ų | 129.1 | 82% | 0.816 | 80% | 0.804 | S | S | * | * | trans | -148.6 | 117.8 | 170.9 | -36.6 | -82.5 | 0 | 0 | 0 | 106.8 | A115 | A115-Y117 HydrophobicContact CB-CD2 4.42Å; A115-Y117 HydrophobicContact CB-CE2 3.58Å | ||
| 118 | G | 42.6 | Very low | 39.8 | Very low | 59 Ų | 59 | 128.6 Ų | 128.6 | 61% | 0.608 | 80% | 0.799 | S | S | * | * | 108.8 | 102.5 | 58 | 0 | 0 | 0 | 0 | 0 | 107.8 | C120 | G118-C120 PolarHBondContact O-N 2.76Š| |||
| 119 | P | 40.9 | Very low | 40.5 | Very low | 135 Ų | 135 | 131.2 Ų | 131.2 | 88% | 0.877 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -76.4 | 116 | -169 | 27 | -32 | 0 | 0 | 0 | 113 | ||
| 120 | C | 40.9 | Very low | 40.9 | Very low | 130 Ų | 130 | 127.8 Ų | 127.8 | 88% | 0.878 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 127.7 | 175 | -65.2 | 0 | 0 | 0 | 0 | 112.1 | G118 | G118-C120 PolarHBondContact O-N 2.76Š|
| 121 | T | 47.4 | Very low | 41.2 | Very low | 127 Ų | 127 | 129.1 Ų | 129.1 | 78% | 0.779 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -73.2 | 149.5 | 171.1 | 48 | 0 | 0 | 0 | 0 | 111.6 | A123 | T121-A123 PolarHBondContact O-N 3.29Š|
| 122 | P | 44.5 | Very low | 41.2 | Very low | 126 Ų | 126 | 124.2 Ų | 124.2 | 82% | 0.818 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -73.1 | 122.6 | 177.1 | 29.2 | -33.1 | 0 | 0 | 0 | 110.8 | V124 | P122-V124 PolarHBondContact O-N 2.99Š|
| 123 | A | 44.8 | Very low | 41.5 | Very low | 103 Ų | 103 | 119 Ų | 119 | 85% | 0.851 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -68.6 | 124.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | T121 | T121-A123 PolarHBondContact O-N 3.29Š|
| 124 | V | 42.9 | Very low | 42.3 | Very low | 141 Ų | 141 | 121.1 Ų | 121.1 | 86% | 0.855 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 124.2 | 171 | 69.4 | 0 | 0 | 0 | 0 | 109.4 | P122 A126 | P122-V124 PolarHBondContact O-N 2.99Å; V124-A126 PolarHBondContact O-N 3.35Å |
| 125 | W | 39.9 | Very low | 42.3 | Very low | 236 Ų | 236 | 126.5 Ų | 126.5 | 89% | 0.894 | 81% | 0.808 | S | S | * | * | P | Polyproline II helix | trans | -83.5 | 116.2 | -177.9 | -173.9 | -74.8 | 0 | 0 | 0 | 110.5 | ||
| 126 | A | 41 | Very low | 42.4 | Very low | 86 Ų | 86 | 128.2 Ų | 128.2 | 71% | 0.711 | 82% | 0.816 | S | S | * | * | trans | -119.2 | 129.3 | 172.4 | 0 | 0 | 0 | 0 | 0 | 110.1 | V124 | V124-A126 PolarHBondContact O-N 3.35Š| ||
| 127 | P | 44.6 | Very low | 43.4 | Very low | 113 Ų | 113 | 126.1 Ų | 126.1 | 73% | 0.734 | 81% | 0.812 | S | S | * | * | trans | -85.1 | 137.6 | 174.5 | 32.9 | -31.6 | 0 | 0 | 0 | 111.7 | ||||
| 128 | A | 40.8 | Very low | 43.2 | Very low | 101 Ų | 101 | 122 Ų | 122 | 84% | 0.835 | 81% | 0.811 | S | S | * | * | trans | -90.2 | 149.4 | 175 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 129 | P | 51.6 | Low | 43.4 | Very low | 129 Ų | 129 | 124.7 Ų | 124.7 | 84% | 0.838 | 82% | 0.817 | S | S | * | * | trans | -110.7 | 132.5 | 176.2 | 37.1 | -28.6 | 0 | 0 | 0 | 114.5 | ||||
| 130 | A | 42 | Very low | 43.8 | Very low | 96 Ų | 96 | 123.2 Ų | 123.2 | 79% | 0.793 | 81% | 0.808 | S | S | * | * | trans | -167.1 | 116.8 | 156.8 | 0 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 131 | A | 40 | Very low | 43.6 | Very low | 107 Ų | 107 | 124.7 Ų | 124.7 | 88% | 0.884 | 81% | 0.806 | S | S | * | * | 79.2 | 121.1 | 71 | 0 | 0 | 0 | 0 | 0 | 113.4 | |||||
| 132 | G | 34.9 | Very low | 42.8 | Very low | 82 Ų | 82 | 125.3 Ų | 125.3 | 85% | 0.845 | 80% | 0.804 | S | S | * | * | trans | 165.2 | 45 | 177.1 | 0 | 0 | 0 | 0 | 0 | 122.2 | ||||
| 133 | G | 38.4 | Very low | 42.6 | Very low | 78 Ų | 78 | 126.4 Ų | 126.4 | 80% | 0.804 | 80% | 0.802 | S | S | * | * | trans | 64.6 | 166.6 | 146.1 | 0 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 134 | P | 52.9 | Low | 42.6 | Very low | 119 Ų | 119 | 127 Ų | 127 | 77% | 0.773 | 80% | 0.797 | S | S | * | * | trans | -120.1 | 166 | -166.5 | 41.4 | -29 | 0 | 0 | 0 | 115.8 | ||||
| 135 | R | 36.3 | Very low | 42 | Very low | 247 Ų | 247 | 124.1 Ų | 124.1 | 93% | 0.932 | 80% | 0.796 | S | S | * | * | trans | -141.9 | 134.9 | 158.4 | -63.2 | -174.2 | 85.3 | -166.4 | 6 | 111.4 | ||||
| 136 | S | 39.4 | Very low | 41.5 | Very low | 112 Ų | 112 | 116.9 Ų | 116.9 | 78% | 0.783 | 80% | 0.795 | S | S | * | * | trans | -117.5 | -167.4 | 173.3 | -55 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 137 | P | 62.4 | Low | 41.5 | Very low | 113 Ų | 113 | 120.9 Ų | 120.9 | 73% | 0.734 | 80% | 0.803 | S | S | * | * | -113.8 | -170.5 | -89.7 | 38.8 | -23.6 | 0 | 0 | 0 | 112.4 | |||||
| 138 | P | 39 | Very low | 41.8 | Very low | 123 Ų | 123 | 121.1 Ų | 121.1 | 80% | 0.799 | 81% | 0.805 | S | S | * | * | -151.1 | 155.5 | 116.2 | 38.7 | -23.5 | 0 | 0 | 0 | 116.9 | |||||
| 139 | P | 46.2 | Very low | 41.4 | Very low | 115 Ų | 115 | 120.2 Ų | 120.2 | 75% | 0.747 | 81% | 0.805 | S | S | * | * | trans | -117.7 | -165.6 | 154.7 | 43.1 | -32 | 0 | 0 | 0 | 110.3 | ||||
| 140 | P | 50.4 | Low | 41 | Very low | 104 Ų | 104 | 119.6 Ų | 119.6 | 68% | 0.675 | 80% | 0.804 | S | S | * | * | cis | -127.3 | 178.2 | -24.3 | 36.9 | -20.2 | 0 | 0 | 0 | 113.9 | ||||
| 141 | L | 35.3 | Very low | 40.7 | Very low | 160 Ų | 160 | 120.4 Ų | 120.4 | 84% | 0.838 | 80% | 0.804 | S | S | * | * | trans | -140.4 | 119.5 | 154.4 | -66.4 | 174.8 | 0 | 0 | 0 | 106.6 | ||||
| 142 | L | 32.2 | Very low | 40.5 | Very low | 140 Ų | 140 | 119.4 Ų | 119.4 | 73% | 0.733 | 80% | 0.795 | S | S | * | * | 54.9 | 125.8 | 75.5 | -53 | -179.1 | 0 | 0 | 0 | 111.9 | |||||
| 143 | L | 38.9 | Very low | 40.4 | Very low | 149 Ų | 149 | 120.6 Ų | 120.6 | 78% | 0.78 | 79% | 0.791 | S | S | * | * | cis | -153.5 | -150.3 | 10.3 | -152.6 | 79.4 | 0 | 0 | 0 | 110.9 | ||||
| 144 | P | 45.1 | Very low | 40.6 | Very low | 117 Ų | 117 | 123.3 Ų | 123.3 | 76% | 0.76 | 79% | 0.791 | S | S | * | * | -123.1 | -176.9 | -122.5 | 44.2 | -26.7 | 0 | 0 | 0 | 116.8 | |||||
| 145 | G | 30.7 | Very low | 40.7 | Very low | 80 Ų | 80 | 123 Ų | 123 | 83% | 0.825 | 79% | 0.79 | S | S | * | * | trans | 164.2 | 129.6 | 153.4 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 146 | G | 30.3 | Very low | 41.2 | Very low | 84 Ų | 84 | 116.8 Ų | 116.8 | 87% | 0.866 | 78% | 0.781 | S | S | * | * | trans | 107.6 | 81.1 | 155.9 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 147 | L | 40.1 | Very low | 41.6 | Very low | 169 Ų | 169 | 117 Ų | 117 | 89% | 0.885 | 78% | 0.78 | S | S | * | * | trans | -95.6 | 175.2 | 150.9 | -79.9 | 170.1 | 0 | 0 | 0 | 108.9 | ||||
| 148 | P | 50.2 | Low | 40.6 | Very low | 119 Ų | 119 | 119.7 Ų | 119.7 | 77% | 0.773 | 78% | 0.783 | S | S | * | * | cis | -128.7 | 176.7 | -29.9 | 30.9 | -12.2 | 0 | 0 | 0 | 112.4 | ||||
| 149 | G | 32.3 | Very low | 40.9 | Very low | 81 Ų | 81 | 119.9 Ų | 119.9 | 84% | 0.835 | 78% | 0.784 | S | S | * | * | trans | -156.5 | 110.3 | 170.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 150 | S | 43.4 | Very low | 40.2 | Very low | 116 Ų | 116 | 118.6 Ų | 118.6 | 81% | 0.811 | 78% | 0.783 | S | S | * | * | trans | -90.7 | 156.1 | -170 | -55.8 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 151 | S | 36.6 | Very low | 39.8 | Very low | 114 Ų | 114 | 119.4 Ų | 119.4 | 80% | 0.797 | 79% | 0.791 | S | S | * | * | 126.5 | 125.8 | 120.5 | -157.5 | 0 | 0 | 0 | 0 | 117.4 | |||||
| 152 | A | 34.8 | Very low | 40.2 | Very low | 86 Ų | 86 | 117.1 Ų | 117.1 | 71% | 0.711 | 79% | 0.789 | S | S | * | * | trans | 57.9 | 148.4 | 146.2 | 0 | 0 | 0 | 0 | 0 | 120.7 | ||||
| 153 | S | 33.7 | Very low | 40.5 | Very low | 106 Ų | 106 | 122.2 Ų | 122.2 | 74% | 0.741 | 80% | 0.798 | S | S | * | * | cis | -169.8 | 139.9 | -11.4 | -102.6 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 154 | V | 41.8 | Very low | 40.2 | Very low | 135 Ų | 135 | 121.6 Ų | 121.6 | 82% | 0.818 | 80% | 0.804 | S | S | * | * | trans | 76.4 | 142.7 | 138.2 | 175.5 | 0 | 0 | 0 | 0 | 120.5 | ||||
| 155 | P | 55.8 | Low | 39.7 | Very low | 114 Ų | 114 | 120.5 Ų | 120.5 | 74% | 0.74 | 81% | 0.805 | S | S | * | * | trans | -103.7 | -160.3 | -165 | 45.3 | -32.9 | 0 | 0 | 0 | 112 | ||||
| 156 | P | 47 | Very low | 39.7 | Very low | 115 Ų | 115 | 125.6 Ų | 125.6 | 75% | 0.747 | 81% | 0.808 | S | S | * | * | cis | -139.4 | -152.7 | 15.9 | 48.5 | -27.5 | 0 | 0 | 0 | 113.8 | ||||
| 157 | P | 47.6 | Very low | 40.2 | Very low | 118 Ų | 118 | 126.9 Ų | 126.9 | 77% | 0.766 | 80% | 0.803 | S | S | * | * | cis | -126.8 | -179.4 | -14.9 | 40.3 | -22.6 | 0 | 0 | 0 | 115.8 | ||||
| 158 | Q | 41 | Very low | 40.5 | Very low | 169 Ų | 169 | 124.5 Ų | 124.5 | 79% | 0.79 | 80% | 0.798 | S | S | * | * | trans | -81.7 | 168.9 | 175.9 | -60.4 | -101.7 | -58.5 | 0 | 0 | 112.3 | ||||
| 159 | P | 45.1 | Very low | 39.9 | Very low | 126 Ų | 126 | 122.9 Ų | 122.9 | 82% | 0.818 | 80% | 0.803 | S | S | * | * | -141.1 | 137.5 | 87.9 | 35.5 | -19.8 | 0 | 0 | 0 | 116.4 | |||||
| 160 | A | 31.9 | Very low | 40.4 | Very low | 88 Ų | 88 | 126.9 Ų | 126.9 | 73% | 0.727 | 80% | 0.804 | S | S | * | * | trans | 28.1 | 114.8 | 144.9 | 0 | 0 | 0 | 0 | 0 | 120.8 | ||||
| 161 | S | 41.1 | Very low | 40.6 | Very low | 122 Ų | 122 | 124.9 Ų | 124.9 | 85% | 0.853 | 80% | 0.802 | S | S | * | * | -143.4 | 138.3 | 128.8 | -159.8 | 0 | 0 | 0 | 0 | 110.1 | |||||
| 162 | S | 44.2 | Very low | 41.1 | Very low | 112 Ų | 112 | 127.4 Ų | 127.4 | 78% | 0.783 | 81% | 0.805 | S | S | * | * | trans | -68.8 | 128.2 | -166.8 | 44.4 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 163 | R | 39.6 | Very low | 42.4 | Very low | 247 Ų | 247 | 132 Ų | 132 | 93% | 0.932 | 81% | 0.812 | S | S | * | * | trans | -159.4 | 83.7 | 161 | -111.7 | 169.3 | -157.8 | -95.1 | 1.8 | 113.4 | ||||
| 164 | C | 32.3 | Very low | 43.6 | Very low | 135 Ų | 135 | 132.2 Ų | 132.2 | 91% | 0.912 | 81% | 0.808 | S | S | * | * | trans | -126.9 | 143.7 | 148.1 | -67.3 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 165 | A | 33.1 | Very low | 44.2 | Very low | 94 Ų | 94 | 136.7 Ų | 136.7 | 78% | 0.777 | 81% | 0.811 | S | S | * | * | cis | -120.8 | -179.4 | -26.7 | 0 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 166 | E | 31.2 | Very low | 44.7 | Very low | 188 Ų | 188 | 139.9 Ų | 139.9 | 88% | 0.879 | 81% | 0.808 | S | S | * | * | -178.2 | 142.2 | 68.1 | -171.3 | 152.9 | 79.1 | 0 | 0 | 108.3 | |||||
| 167 | S | 41.2 | Very low | 45.1 | Very low | 110 Ų | 110 | 139.3 Ų | 139.3 | 77% | 0.769 | 80% | 0.804 | S | S | * | * | trans | -113.3 | 168.6 | 174.4 | -71.6 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 168 | P | 46.8 | Very low | 45.5 | Very low | 120 Ų | 120 | 143.6 Ų | 143.6 | 78% | 0.779 | 81% | 0.805 | S | S | * | * | cis | -131 | 121.3 | -22.3 | 27.6 | -7 | 0 | 0 | 0 | 112.4 | L170 | P168-L170 PolarHBondContact O-N 3.02Š| ||
| 169 | G | 36.8 | Very low | 45.7 | Very low | 85 Ų | 85 | 140.1 Ų | 140.1 | 88% | 0.876 | 80% | 0.799 | S | S | * | * | trans | -87.3 | 87.2 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 170 | L | 43.3 | Very low | 46 | Very low | 165 Ų | 165 | 140 Ų | 140 | 86% | 0.864 | 80% | 0.799 | S | S | * | * | trans | 19.4 | 111.8 | 157.7 | -65.6 | 170.6 | 0 | 0 | 0 | 118.4 | P168 L172 | P168-L170 PolarHBondContact O-N 3.02Å; L170-L172 PolarHBondContact O-N 3.22Å; L170-L172 VanDerWaalsContact O-N 3.15Å | ||
| 171 | G | 47.4 | Very low | 46.7 | Very low | 73 Ų | 73 | 139.7 Ų | 139.7 | 75% | 0.753 | 80% | 0.804 | S | S | * | * | trans | -64.5 | 110.8 | 177.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | H173 | G171-H173 PolarHBondContact O-N 3.22Å; G171-H173 VanDerWaalsContact O-N 3.13Å | ||
| 172 | L | 48.4 | Very low | 46.9 | Very low | 167 Ų | 167 | 141.2 Ų | 141.2 | 87% | 0.874 | 80% | 0.802 | S | S | * | * | trans | -73.6 | 95 | 159 | -71.1 | 172.8 | 0 | 0 | 0 | 108.9 | L170 V174 | L170-L172 PolarHBondContact O-N 3.22Å; L170-L172 VanDerWaalsContact O-N 3.15Å; L172-V174 VanDerWaalsContact C-N 3.28Å; L172-V174 PolarHBondContact O-N 3.31Å | ||
| 173 | H | 60.3 | Low | 47.3 | Very low | 183 Ų | 183 | 139.1 Ų | 139.1 | 85% | 0.847 | 80% | 0.799 | S | S | * | * | trans | -64 | 89 | 167.6 | -85.4 | -89.1 | 0 | 0 | 0 | 110 | G171 W175 | G171-H173 PolarHBondContact O-N 3.22Å; G171-H173 VanDerWaalsContact O-N 3.13Å; H173-W175 PolarHBondContact O-N 3.2Å | ||
| 174 | V | 59 | Low | 47.7 | Very low | 110 Ų | 110 | 135.1 Ų | 135.1 | 67% | 0.667 | 80% | 0.795 | S | S | * | * | trans | -61.1 | 118.9 | 166.8 | 133.4 | 0 | 0 | 0 | 0 | 108.4 | L172 R176 | L172-V174 VanDerWaalsContact C-N 3.28Å; L172-V174 PolarHBondContact O-N 3.31Å; V174-R176 HydrophobicContact CG1-CG 4.02Å; V174-R176 PolarHBondContact O-N 2.83Å | ||
| 175 | W | 54.3 | Low | 48.2 | Very low | 229 Ų | 229 | 139.4 Ų | 139.4 | 87% | 0.867 | 81% | 0.809 | S | S | * | * | trans | -61.2 | 118.2 | 174.7 | -114.6 | 81.4 | 0 | 0 | 0 | 109.7 | H173 P177 | H173-W175 PolarHBondContact O-N 3.2Å; W175-P177 HydrophobicContact CE3-CG 4.34Å | ||
| 176 | R | 66.4 | Low | 48.9 | Very low | 182 Ų | 182 | 141.7 Ų | 141.7 | 69% | 0.687 | 81% | 0.811 | S | S | * | * | trans | -115.2 | 107.6 | 169.7 | -67.5 | -161.4 | -173.3 | -132.8 | 6.6 | 109.9 | V174 W178 | V174-R176 HydrophobicContact CG1-CG 4.02Å; V174-R176 PolarHBondContact O-N 2.83Å; R176-W178 PolarHBondContact O-N 3.13Å | ||
| 177 | P | 55 | Low | 49.8 | Very low | 103 Ų | 103 | 139.3 Ų | 139.3 | 67% | 0.669 | 81% | 0.807 | S | S | * | * | S | Bend | trans | -71.7 | 9.1 | 179.8 | -17.4 | 30.1 | 0 | 0 | 0 | 115.5 | W175 | W175-P177 HydrophobicContact CE3-CG 4.34Š|
| 178 | W | 56.2 | Low | 50.3 | Low | 208 Ų | 208 | 140.9 Ų | 140.9 | 79% | 0.788 | 81% | 0.809 | S | S | * | * | trans | -160.1 | 72.3 | -168.2 | 49.5 | -72.1 | 0 | 0 | 0 | 111.7 | R176 | R176-W178 PolarHBondContact O-N 3.13Š| ||
| 179 | S | 47 | Very low | 50.5 | Low | 95 Ų | 95 | 142.1 Ų | 142.1 | 66% | 0.664 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -98.9 | 125 | 154.8 | -67.2 | 0 | 0 | 0 | 0 | 108.2 | ||
| 180 | P | 51.2 | Low | 51.4 | Low | 125 Ų | 125 | 145.7 Ų | 145.7 | 81% | 0.812 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 138.6 | 164.8 | -17.2 | 31.2 | 0 | 0 | 0 | 109 | D182 | P180-D182 PolarHBondContact O-N 3.15Š|
| 181 | G | 46.7 | Very low | 51.9 | Low | 81 Ų | 81 | 144.4 Ų | 144.4 | 84% | 0.835 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 120.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 109.9 | G183 | G181-G183 PolarHBondContact O-N 3.24Š|
| 182 | D | 44.7 | Very low | 52.3 | Low | 153 Ų | 153 | 149.5 Ų | 149.5 | 82% | 0.818 | 81% | 0.807 | S | S | * | * | trans | -74 | 104.2 | 167.1 | -152.2 | -88.8 | 0 | 0 | 0 | 107.4 | P180 | P180-D182 PolarHBondContact O-N 3.15Š| ||
| 183 | G | 53.4 | Low | 52.5 | Low | 69 Ų | 69 | 148.2 Ų | 148.2 | 71% | 0.711 | 80% | 0.802 | S | S | * | * | trans | -109.1 | 110.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 108.9 | G181 | G181-G183 PolarHBondContact O-N 3.24Š| ||
| 184 | L | 47.8 | Very low | 51.9 | Low | 162 Ų | 162 | 145.3 Ų | 145.3 | 85% | 0.848 | 80% | 0.798 | S | S | * | * | trans | -134.9 | 147.6 | 164.1 | -93.7 | 114.7 | 0 | 0 | 0 | 111.7 | ||||
| 185 | N | 41.2 | Very low | 51.3 | Low | 226 Ų | 226 | 148.5 Ų | 148.5 | 100% | 1.209 | 81% | 0.81 | S | S | * | * | trans | -93.3 | 0 | -175.6 | 159.1 | 98.1 | 0 | 0 | 0 | 110.3 |
Retrieved 185 of 185 residues in 68.8 ms
(Link to these results)