| 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 | 62 | Low | 81.4 | Confident | 213 Ų | 213 | 111.7 Ų | 111.7 | 100% | 1.049 | 62% | 0.622 | S | S | * | * | 0 | -36.6 | 0 | -69.7 | -167.9 | -99.6 | 0 | 0 | 113.7 | R3 T4 | M1-R3 PolarHBondContact O-N 3.42Å; M1-T4 PolarHBondContact O-OG1 3.31Å | |||
| 2 | A | 65.3 | Low | 82.4 | Confident | 75 Ų | 75 | 110.4 Ų | 110.4 | 62% | 0.62 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -68.4 | -32 | -177.8 | 0 | 0 | 0 | 0 | 0 | 116.3 | T5 T6 | A2-T5 PolarHBondContact O-OG1 2.93Å; A2-T6 PolarHBondContact O-N 2.95Å; A2-T6 PolarHBondContact O-OG1 2.96Å |
| 3 | R | 73.4 | Confident | 83.2 | Confident | 215 Ų | 215 | 106.2 Ų | 106.2 | 81% | 0.811 | 60% | 0.6 | S | S | * | * | H | α-helix | trans | -70 | -35.4 | 179.8 | -71 | -176.5 | -180 | 172.8 | -0.2 | 113.3 | M1 T5 T6 D7 | M1-R3 PolarHBondContact O-N 3.42Å; R3-T5 VanDerWaalsContact C-N 3.34Å; R3-T5 PolarHBondContact O-N 3.03Å; R3-T6 PolarHBondContact O-N 3.1Å; R3-T6 PolarHBondContact O-OG1 2.91Å; R3-D7 PolarHBondContact O-N 2.91Å |
| 4 | T | 79.4 | Confident | 83.9 | Confident | 97 Ų | 97 | 106.8 Ų | 106.8 | 60% | 0.595 | 60% | 0.599 | S | S | * | * | H | α-helix | trans | -70.6 | -31.9 | 179.8 | 49.1 | 0 | 0 | 0 | 0 | 112.1 | M1 L8 | M1-T4 PolarHBondContact O-OG1 3.31Å; T4-L8 PolarHBondContact O-N 3.26Å |
| 5 | T | 82.1 | Confident | 84.5 | Confident | 83 Ų | 83 | 102.9 Ų | 102.9 | 51% | 0.509 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -70.7 | -37.9 | 175.2 | 47.4 | 0 | 0 | 0 | 0 | 112.1 | A2 R3 L8 V9 | A2-T5 PolarHBondContact O-OG1 2.93Å; R3-T5 VanDerWaalsContact C-N 3.34Å; R3-T5 PolarHBondContact O-N 3.03Å; T5-L8 PolarHBondContact O-N 3.09Å; T5-V9 VanDerWaalsContact O-CG2 3.26Å; T5-V9 WeakPolarHBondContact O-CG2 3.23Å; T5-V9 PolarHBondContact O-N 3.41Å; T5-V9 VanDerWaalsContact O-N 3.1Å |
| 6 | T | 83.3 | Confident | 85 | Confident | 87 Ų | 87 | 103.8 Ų | 103.8 | 53% | 0.534 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -67 | -39.8 | 177.4 | 48.8 | 0 | 0 | 0 | 0 | 112 | A2 R3 V9 A10 | A2-T6 PolarHBondContact O-N 2.95Å; A2-T6 PolarHBondContact O-OG1 2.96Å; R3-T6 PolarHBondContact O-N 3.1Å; R3-T6 PolarHBondContact O-OG1 2.91Å; T6-V9 PolarHBondContact O-N 3.23Å; T6-A10 PolarHBondContact O-N 2.94Å |
| 7 | D | 87 | Confident | 85.6 | Confident | 103 Ų | 103 | 101.2 Ų | 101.2 | 55% | 0.551 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -65.8 | -42.1 | 177.6 | -67.8 | -23.1 | 0 | 0 | 0 | 111.6 | R3 V9 A10 V11 | R3-D7 PolarHBondContact O-N 2.91Å; D7-V9 VanDerWaalsContact C-N 3.35Å; D7-V9 PolarHBondContact O-N 2.94Å; D7-A10 PolarHBondContact O-N 3.14Å; D7-V11 WeakPolarHBondContact O-CG2 3.31Å; D7-V11 PolarHBondContact O-N 3.46Å |
| 8 | L | 89 | Confident | 86.1 | Confident | 114 Ų | 114 | 98.2 Ų | 98.2 | 60% | 0.597 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -62.7 | -41.9 | 177 | -169.8 | 70.5 | 0 | 0 | 0 | 111.8 | T4 T5 A10 V11 L12 | T4-L8 PolarHBondContact O-N 3.26Å; T5-L8 PolarHBondContact O-N 3.09Å; L8-A10 VanDerWaalsContact C-N 3.34Å; L8-V11 PolarHBondContact O-N 3.5Å; L8-L12 HydrophobicContact CG-CD1 4.43Å; L8-L12 WeakPolarHBondContact O-CG 3.5Å; L8-L12 PolarHBondContact O-N 3.26Å |
| 9 | V | 91.6 | Very high | 86.6 | Confident | 100 Ų | 100 | 99.2 Ų | 99.2 | 61% | 0.606 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -63.8 | -40.2 | 176.1 | 172.9 | 0 | 0 | 0 | 0 | 111.1 | T5 T6 D7 L12 A13 | T5-V9 VanDerWaalsContact O-CG2 3.26Å; T5-V9 WeakPolarHBondContact O-CG2 3.23Å; T5-V9 PolarHBondContact O-N 3.41Å; T5-V9 VanDerWaalsContact O-N 3.1Å; T6-V9 PolarHBondContact O-N 3.23Å; D7-V9 VanDerWaalsContact C-N 3.35Å; D7-V9 PolarHBondContact O-N 2.94Å; V9-L12 PolarHBondContact O-N 2.99Å; V9-A13 WeakPolarHBondContact O-CB 3.42Å; V9-A13 PolarHBondContact O-N 3.37Å |
| 10 | A | 90.4 | Very high | 87 | Confident | 48 Ų | 48 | 97.1 Ų | 97.1 | 40% | 0.397 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -64.2 | -43.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | T6 D7 L8 L12 A13 I14 | T6-A10 PolarHBondContact O-N 2.94Å; D7-A10 PolarHBondContact O-N 3.14Å; L8-A10 VanDerWaalsContact C-N 3.34Å; A10-L12 PolarHBondContact O-N 3.36Å; A10-A13 PolarHBondContact O-N 2.92Å; A10-I14 VanDerWaalsContact O-CG1 3.31Å; A10-I14 WeakPolarHBondContact O-CG1 3.42Å; A10-I14 PolarHBondContact O-N 3.49Å |
| 11 | V | 92.3 | Very high | 87.4 | Confident | 94 Ų | 94 | 97.1 Ų | 97.1 | 57% | 0.57 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -63.3 | -42.5 | 177.1 | 174.1 | 0 | 0 | 0 | 0 | 111.2 | D7 L8 A13 I14 S15 | D7-V11 WeakPolarHBondContact O-CG2 3.31Å; D7-V11 PolarHBondContact O-N 3.46Å; L8-V11 PolarHBondContact O-N 3.5Å; V11-A13 VanDerWaalsContact C-N 3.34Å; V11-A13 PolarHBondContact O-N 3.47Å; V11-I14 PolarHBondContact O-N 3.43Å; V11-S15 PolarHBondContact O-N 3.32Å; V11-S15 PolarHBondContact O-OG 2.86Å |
| 12 | L | 93.1 | Very high | 89.1 | Confident | 96 Ų | 96 | 91.8 Ų | 91.8 | 50% | 0.503 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -64.4 | -37.4 | 175.3 | -69.8 | 174.4 | 0 | 0 | 0 | 112.2 | L8 V9 A10 S15 L16 | L8-L12 HydrophobicContact CG-CD1 4.43Å; L8-L12 WeakPolarHBondContact O-CG 3.5Å; L8-L12 PolarHBondContact O-N 3.26Å; V9-L12 PolarHBondContact O-N 2.99Å; A10-L12 PolarHBondContact O-N 3.36Å; L12-S15 WeakPolarHBondContact CA-OG 3.46Å; L12-S15 PolarHBondContact O-N 3.41Å; L12-S15 PolarHBondContact O-OG 3.45Å; L12-L16 WeakPolarHBondContact O-CB 3.43Å; L12-L16 WeakPolarHBondContact O-CG 3.4Å; L12-L16 PolarHBondContact O-N 3.48Å |
| 13 | A | 92.4 | Very high | 90.5 | Very high | 56 Ų | 56 | 90 Ų | 90 | 46% | 0.463 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -66.7 | -40 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | V9 A10 V11 S17 | V9-A13 WeakPolarHBondContact O-CB 3.42Å; V9-A13 PolarHBondContact O-N 3.37Å; A10-A13 PolarHBondContact O-N 2.92Å; V11-A13 VanDerWaalsContact C-N 3.34Å; V11-A13 PolarHBondContact O-N 3.47Å; A13-S17 WeakPolarHBondContact O-CB 3.27Å; A13-S17 PolarHBondContact O-N 3.02Å; A13-S17 PolarHBondContact O-OG 3.01Å; A13-S17 VanDerWaalsContact O-OG 3.06Å |
| 14 | I | 92.8 | Very high | 91.6 | Very high | 114 Ų | 114 | 83.5 Ų | 83.5 | 59% | 0.585 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -67 | -42.9 | 176.7 | -65.9 | 165.4 | 0 | 0 | 0 | 110.6 | A10 V11 S17 A18 | A10-I14 VanDerWaalsContact O-CG1 3.31Å; A10-I14 WeakPolarHBondContact O-CG1 3.42Å; A10-I14 PolarHBondContact O-N 3.49Å; V11-I14 PolarHBondContact O-N 3.43Å; I14-S17 WeakPolarHBondContact CA-OG 3.45Å; I14-S17 PolarHBondContact O-N 3.4Å; I14-S17 PolarHBondContact O-OG 3.04Å; I14-A18 WeakPolarHBondContact O-CB 3.2Å; I14-A18 PolarHBondContact O-N 3.37Å |
| 15 | S | 93.2 | Very high | 92.4 | Very high | 48 Ų | 48 | 84.3 Ų | 84.3 | 34% | 0.336 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -66.3 | -41.5 | 178.9 | 65.2 | 0 | 0 | 0 | 0 | 112.3 | V11 L12 A18 I19 | V11-S15 PolarHBondContact O-N 3.32Å; V11-S15 PolarHBondContact O-OG 2.86Å; L12-S15 WeakPolarHBondContact CA-OG 3.46Å; L12-S15 PolarHBondContact O-N 3.41Å; L12-S15 PolarHBondContact O-OG 3.45Å; S15-A18 PolarHBondContact O-N 2.93Å; S15-I19 VanDerWaalsContact O-CG1 3.29Å; S15-I19 WeakPolarHBondContact O-CG1 3.28Å; S15-I19 PolarHBondContact O-N 3.41Å |
| 16 | L | 92.8 | Very high | 93.1 | Very high | 118 Ų | 118 | 83.4 Ų | 83.4 | 62% | 0.618 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -63.4 | -41.4 | 174.8 | -72 | 171.9 | 0 | 0 | 0 | 112.3 | L12 I19 A20 | L12-L16 WeakPolarHBondContact O-CB 3.43Å; L12-L16 WeakPolarHBondContact O-CG 3.4Å; L12-L16 PolarHBondContact O-N 3.48Å; L16-I19 PolarHBondContact O-N 3.3Å; L16-A20 WeakPolarHBondContact O-CB 3.38Å; L16-A20 PolarHBondContact O-N 3.24Å |
| 17 | S | 94.3 | Very high | 93.7 | Very high | 59 Ų | 59 | 83.1 Ų | 83.1 | 41% | 0.413 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -66.9 | -39.2 | 176.4 | 60.6 | 0 | 0 | 0 | 0 | 112 | A13 I14 A20 I21 | A13-S17 WeakPolarHBondContact O-CB 3.27Å; A13-S17 PolarHBondContact O-N 3.02Å; A13-S17 PolarHBondContact O-OG 3.01Å; A13-S17 VanDerWaalsContact O-OG 3.06Å; I14-S17 WeakPolarHBondContact CA-OG 3.45Å; I14-S17 PolarHBondContact O-N 3.4Å; I14-S17 PolarHBondContact O-OG 3.04Å; S17-A20 PolarHBondContact O-N 2.91Å; S17-I21 WeakPolarHBondContact O-CD1 3.19Å; S17-I21 VanDerWaalsContact O-CG1 3.24Å; S17-I21 WeakPolarHBondContact O-CG1 3.38Å; S17-I21 PolarHBondContact O-N 3.29Å |
| 18 | A | 95.3 | Very high | 94.2 | Very high | 47 Ų | 47 | 82.1 Ų | 82.1 | 39% | 0.388 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -61.2 | -45.2 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | I14 S15 A20 I21 V22 | I14-A18 WeakPolarHBondContact O-CB 3.2Å; I14-A18 PolarHBondContact O-N 3.37Å; S15-A18 PolarHBondContact O-N 2.93Å; A18-A20 VanDerWaalsContact C-N 3.32Å; A18-A20 PolarHBondContact O-N 3.03Å; A18-I21 PolarHBondContact O-N 3.34Å; A18-V22 WeakPolarHBondContact O-CG2 3.46Å; A18-V22 PolarHBondContact O-N 2.97Å |
| 19 | I | 94.9 | Very high | 94.6 | Very high | 117 Ų | 117 | 83.5 Ų | 83.5 | 60% | 0.6 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -61.3 | -42.2 | 176.4 | -67.1 | 163.4 | 0 | 0 | 0 | 110.8 | S15 L16 V22 G23 | S15-I19 VanDerWaalsContact O-CG1 3.29Å; S15-I19 WeakPolarHBondContact O-CG1 3.28Å; S15-I19 PolarHBondContact O-N 3.41Å; L16-I19 PolarHBondContact O-N 3.3Å; I19-V22 PolarHBondContact O-N 2.95Å; I19-G23 PolarHBondContact O-N 3.39Å |
| 20 | A | 95.3 | Very high | 94.8 | Very high | 57 Ų | 57 | 83.9 Ų | 83.9 | 47% | 0.471 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -63.1 | -41.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | L16 S17 A18 G23 T24 | L16-A20 WeakPolarHBondContact O-CB 3.38Å; L16-A20 PolarHBondContact O-N 3.24Å; S17-A20 PolarHBondContact O-N 2.91Å; A18-A20 VanDerWaalsContact C-N 3.32Å; A18-A20 PolarHBondContact O-N 3.03Å; A20-G23 PolarHBondContact O-N 3.4Å; A20-T24 WeakPolarHBondContact O-CG2 3.49Å; A20-T24 PolarHBondContact O-N 3.42Å; A20-T24 PolarHBondContact O-OG1 3.12Å; A20-T24 VanDerWaalsContact O-OG1 3.13Å |
| 21 | I | 95.9 | Very high | 95.1 | Very high | 99 Ų | 99 | 85.9 Ų | 85.9 | 51% | 0.508 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.8 | -45.8 | 176.2 | -66.5 | 162.4 | 0 | 0 | 0 | 110.7 | S17 A18 G23 T24 L25 | S17-I21 WeakPolarHBondContact O-CD1 3.19Å; S17-I21 VanDerWaalsContact O-CG1 3.24Å; S17-I21 WeakPolarHBondContact O-CG1 3.38Å; S17-I21 PolarHBondContact O-N 3.29Å; A18-I21 PolarHBondContact O-N 3.34Å; I21-G23 VanDerWaalsContact C-N 3.33Å; I21-G23 PolarHBondContact O-N 2.97Å; I21-T24 WeakPolarHBondContact CA-OG1 3.44Å; I21-T24 PolarHBondContact O-N 3.32Å; I21-T24 PolarHBondContact O-OG1 3.47Å; I21-L25 HydrophobicContact CG2-CD1 4.01Å; I21-L25 HydrophobicContact CG2-CG 4.41Å; I21-L25 WeakPolarHBondContact O-CG 3.35Å; I21-L25 PolarHBondContact O-N 2.95Å |
| 22 | V | 96.4 | Very high | 95.3 | Very high | 100 Ų | 100 | 85 Ų | 85 | 61% | 0.606 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -62.2 | -41.8 | 176.9 | 174.1 | 0 | 0 | 0 | 0 | 111.2 | A18 I19 L25 S26 | A18-V22 WeakPolarHBondContact O-CG2 3.46Å; A18-V22 PolarHBondContact O-N 2.97Å; I19-V22 PolarHBondContact O-N 2.95Å; V22-L25 PolarHBondContact O-N 3.45Å; V22-S26 WeakPolarHBondContact O-CB 3.29Å; V22-S26 PolarHBondContact O-N 3.3Å |
| 23 | G | 95.9 | Very high | 95.5 | Very high | 38 Ų | 38 | 83.9 Ų | 83.9 | 39% | 0.392 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -60 | -48.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | I19 A20 I21 S26 T27 | I19-G23 PolarHBondContact O-N 3.39Å; A20-G23 PolarHBondContact O-N 3.4Å; I21-G23 VanDerWaalsContact C-N 3.33Å; I21-G23 PolarHBondContact O-N 2.97Å; G23-S26 WeakPolarHBondContact O-CB 3.47Å; G23-S26 PolarHBondContact O-N 2.97Å; G23-T27 WeakPolarHBondContact O-CG2 3.33Å; G23-T27 PolarHBondContact O-N 2.96Å |
| 24 | T | 95.8 | Very high | 95.6 | Very high | 79 Ų | 79 | 90.9 Ų | 90.9 | 49% | 0.485 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -62.7 | -44.8 | 177.3 | 53.2 | 0 | 0 | 0 | 0 | 112.4 | A20 I21 S26 T27 V28 | A20-T24 WeakPolarHBondContact O-CG2 3.49Å; A20-T24 PolarHBondContact O-N 3.42Å; A20-T24 PolarHBondContact O-OG1 3.12Å; A20-T24 VanDerWaalsContact O-OG1 3.13Å; I21-T24 WeakPolarHBondContact CA-OG1 3.44Å; I21-T24 PolarHBondContact O-N 3.32Å; I21-T24 PolarHBondContact O-OG1 3.47Å; T24-S26 VanDerWaalsContact C-N 3.31Å; T24-S26 PolarHBondContact O-N 3.49Å; T24-T27 PolarHBondContact O-N 3.41Å; T24-T27 PolarHBondContact O-OG1 3.32Å; T24-V28 WeakPolarHBondContact O-CG2 3.38Å; T24-V28 PolarHBondContact O-N 3.4Å |
| 25 | L | 96.4 | Very high | 95.7 | Very high | 113 Ų | 113 | 90.8 Ų | 90.8 | 59% | 0.592 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -60.2 | -40 | 175.9 | -70.9 | 174.6 | 0 | 0 | 0 | 112.4 | I21 V22 V28 F29 | I21-L25 HydrophobicContact CG2-CD1 4.01Å; I21-L25 HydrophobicContact CG2-CG 4.41Å; I21-L25 WeakPolarHBondContact O-CG 3.35Å; I21-L25 PolarHBondContact O-N 2.95Å; V22-L25 PolarHBondContact O-N 3.45Å; L25-V28 PolarHBondContact O-N 3.03Å; L25-F29 WeakPolarHBondContact O-CB 3.39Å; L25-F29 PolarHBondContact O-N 2.88Å |
| 26 | S | 96.3 | Very high | 95.9 | Very high | 65 Ų | 65 | 95.6 Ų | 95.6 | 46% | 0.455 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -61.9 | -45.4 | 174.8 | -174.5 | 0 | 0 | 0 | 0 | 111.7 | V22 G23 T24 V28 F29 L30 | V22-S26 WeakPolarHBondContact O-CB 3.29Å; V22-S26 PolarHBondContact O-N 3.3Å; G23-S26 WeakPolarHBondContact O-CB 3.47Å; G23-S26 PolarHBondContact O-N 2.97Å; T24-S26 VanDerWaalsContact C-N 3.31Å; T24-S26 PolarHBondContact O-N 3.49Å; S26-V28 PolarHBondContact O-N 3.29Å; S26-F29 PolarHBondContact O-N 3.38Å; S26-L30 WeakPolarHBondContact O-CG 3.15Å; S26-L30 PolarHBondContact O-N 3.35Å |
| 27 | T | 96.4 | Very high | 96.1 | Very high | 80 Ų | 80 | 93.9 Ų | 93.9 | 49% | 0.491 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.9 | -41.6 | 176.6 | 60.8 | 0 | 0 | 0 | 0 | 112.6 | G23 T24 F29 L30 V31 | G23-T27 WeakPolarHBondContact O-CG2 3.33Å; G23-T27 PolarHBondContact O-N 2.96Å; T24-T27 PolarHBondContact O-N 3.41Å; T24-T27 PolarHBondContact O-OG1 3.32Å; T27-F29 VanDerWaalsContact C-N 3.34Å; T27-F29 PolarHBondContact O-N 2.96Å; T27-L30 PolarHBondContact O-N 2.98Å; T27-V31 WeakPolarHBondContact O-CG2 3.28Å; T27-V31 PolarHBondContact O-N 2.99Å |
| 28 | V | 97 | Very high | 96.1 | Very high | 83 Ų | 83 | 95.7 Ų | 95.7 | 50% | 0.503 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -62.2 | -43.1 | 175.7 | 172.3 | 0 | 0 | 0 | 0 | 110.3 | T24 L25 S26 L30 V31 C32 | T24-V28 WeakPolarHBondContact O-CG2 3.38Å; T24-V28 PolarHBondContact O-N 3.4Å; L25-V28 PolarHBondContact O-N 3.03Å; S26-V28 PolarHBondContact O-N 3.29Å; V28-L30 PolarHBondContact O-N 3.35Å; V28-V31 PolarHBondContact O-N 3Å; V28-C32 VanDerWaalsContact O-CB 3.29Å; V28-C32 WeakPolarHBondContact O-CB 3.26Å; V28-C32 PolarHBondContact O-N 3.33Å; V28-C32 PolarHBondContact O-SG 3.49Å |
| 29 | F | 97.1 | Very high | 96.2 | Very high | 142 Ų | 142 | 102 Ų | 102 | 62% | 0.623 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -60.7 | -44.5 | 176.5 | -177 | -98.1 | 0 | 0 | 0 | 112.2 | L25 S26 T27 C32 N33 | L25-F29 WeakPolarHBondContact O-CB 3.39Å; L25-F29 PolarHBondContact O-N 2.88Å; S26-F29 PolarHBondContact O-N 3.38Å; T27-F29 VanDerWaalsContact C-N 3.34Å; T27-F29 PolarHBondContact O-N 2.96Å; F29-C32 PolarHBondContact O-N 2.85Å; F29-N33 VanDerWaalsContact O-CB 3.28Å; F29-N33 WeakPolarHBondContact O-CB 3.33Å; F29-N33 PolarHBondContact O-N 3.31Å |
| 30 | L | 97.4 | Very high | 96.3 | Very high | 108 Ų | 108 | 99.7 Ų | 99.7 | 57% | 0.565 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -63.3 | -42.4 | 177 | -69.3 | 174.5 | 0 | 0 | 0 | 112.4 | S26 T27 V28 R34 | S26-L30 WeakPolarHBondContact O-CG 3.15Å; S26-L30 PolarHBondContact O-N 3.35Å; T27-L30 PolarHBondContact O-N 2.98Å; V28-L30 PolarHBondContact O-N 3.35Å; L30-R34 WeakPolarHBondContact O-CB 3.26Å; L30-R34 PolarHBondContact O-N 3.33Å |
| 31 | V | 96.7 | Very high | 96.3 | Very high | 90 Ų | 90 | 104.1 Ų | 104.1 | 55% | 0.545 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -65.7 | -45.7 | 176.5 | 173.8 | 0 | 0 | 0 | 0 | 110.7 | T27 V28 N33 R34 Q35 | T27-V31 WeakPolarHBondContact O-CG2 3.28Å; T27-V31 PolarHBondContact O-N 2.99Å; V28-V31 PolarHBondContact O-N 3Å; V31-N33 PolarHBondContact O-N 2.98Å; V31-R34 PolarHBondContact O-N 3.48Å; V31-Q35 HydrophobicContact CG1-CG 4.37Å; V31-Q35 WeakPolarHBondContact O-CB 3.36Å; V31-Q35 VanDerWaalsContact O-CG 3.3Å; V31-Q35 WeakPolarHBondContact O-CG 3.32Å; V31-Q35 PolarHBondContact O-N 3.28Å |
| 32 | C | 96 | Very high | 96.4 | Very high | 76 Ų | 76 | 103 Ų | 103 | 51% | 0.514 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -61.1 | -43.5 | 176.8 | -76.5 | 0 | 0 | 0 | 0 | 111.9 | V28 F29 Q35 W36 | V28-C32 VanDerWaalsContact O-CB 3.29Å; V28-C32 WeakPolarHBondContact O-CB 3.26Å; V28-C32 PolarHBondContact O-N 3.33Å; V28-C32 PolarHBondContact O-SG 3.49Å; F29-C32 PolarHBondContact O-N 2.85Å; C32-Q35 PolarHBondContact O-N 3.49Å; C32-W36 WeakPolarHBondContact O-CB 3.43Å; C32-W36 PolarHBondContact O-N 3.03Å |
| 33 | N | 96.4 | Very high | 96.4 | Very high | 72 Ų | 72 | 101.2 Ų | 101.2 | 39% | 0.385 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.7 | -43.1 | 177.5 | -169.9 | 30.8 | 0 | 0 | 0 | 111.5 | F29 V31 W36 N37 | F29-N33 VanDerWaalsContact O-CB 3.28Å; F29-N33 WeakPolarHBondContact O-CB 3.33Å; F29-N33 PolarHBondContact O-N 3.31Å; V31-N33 PolarHBondContact O-N 2.98Å; N33-W36 PolarHBondContact O-N 3.48Å; N33-N37 PolarHBondContact O-N 3.18Å; N33-N37 PolarHBondContact O-ND2 3.3Å |
| 34 | R | 96.2 | Very high | 96.4 | Very high | 204 Ų | 204 | 106 Ų | 106 | 77% | 0.77 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -63.9 | -42.4 | 175.6 | -172.7 | 174.8 | 176.5 | 168.1 | -0.5 | 112.2 | L30 V31 L38 | L30-R34 WeakPolarHBondContact O-CB 3.26Å; L30-R34 PolarHBondContact O-N 3.33Å; V31-R34 PolarHBondContact O-N 3.48Å; R34-L38 WeakPolarHBondContact O-CB 3.47Å; R34-L38 PolarHBondContact O-N 3.38Å |
| 35 | Q | 95 | Very high | 96.4 | Very high | 111 Ų | 111 | 107.5 Ų | 107.5 | 52% | 0.519 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.6 | -43.4 | 175.2 | -77 | -73.4 | -20.7 | 0 | 0 | 111.6 | V31 C32 L38 R39 | V31-Q35 HydrophobicContact CG1-CG 4.37Å; V31-Q35 WeakPolarHBondContact O-CB 3.36Å; V31-Q35 VanDerWaalsContact O-CG 3.3Å; V31-Q35 WeakPolarHBondContact O-CG 3.32Å; V31-Q35 PolarHBondContact O-N 3.28Å; C32-Q35 PolarHBondContact O-N 3.49Å; Q35-L38 PolarHBondContact O-N 2.96Å; Q35-R39 WeakPolarHBondContact O-CG 3.5Å; Q35-R39 PolarHBondContact O-N 2.88Å |
| 36 | W | 95.7 | Very high | 96.4 | Very high | 149 Ų | 149 | 106.2 Ų | 106.2 | 56% | 0.564 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -63.5 | -45.8 | 178.6 | -171.8 | 77.3 | 0 | 0 | 0 | 111.9 | C32 N33 L38 R39 N40 | C32-W36 WeakPolarHBondContact O-CB 3.43Å; C32-W36 PolarHBondContact O-N 3.03Å; N33-W36 PolarHBondContact O-N 3.48Å; W36-L38 VanDerWaalsContact C-N 3.32Å; W36-L38 PolarHBondContact O-N 3.38Å; W36-R39 PolarHBondContact O-N 3.43Å; W36-N40 VanDerWaalsContact CD2-ND2 3.34Å; W36-N40 VanDerWaalsContact CE3-ND2 3.33Å; W36-N40 WeakPolarHBondContact CH2-ND2 3.44Å; W36-N40 WeakPolarHBondContact CZ2-ND2 3.37Å; W36-N40 VanDerWaalsContact CZ3-ND2 3.27Å; W36-N40 WeakPolarHBondContact CZ3-ND2 3.43Å; W36-N40 PolarHBondContact O-N 3.38Å |
| 37 | N | 97 | Very high | 96.5 | Very high | 82 Ų | 82 | 107.5 Ų | 107.5 | 44% | 0.439 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -60.1 | -41.7 | 174.8 | -75.1 | -24.8 | 0 | 0 | 0 | 112.3 | N33 N40 Y41 | N33-N37 PolarHBondContact O-N 3.18Å; N33-N37 PolarHBondContact O-ND2 3.3Å; N37-N40 PolarHBondContact O-N 2.97Å; N37-Y41 WeakPolarHBondContact O-CB 3.3Å; N37-Y41 PolarHBondContact O-N 3.25Å |
| 38 | L | 95.9 | Very high | 96.5 | Very high | 97 Ų | 97 | 109.3 Ų | 109.3 | 51% | 0.508 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -65.8 | -40.9 | 177.1 | -170.3 | 66.4 | 0 | 0 | 0 | 111.9 | R34 Q35 W36 Y41 V42 | R34-L38 WeakPolarHBondContact O-CB 3.47Å; R34-L38 PolarHBondContact O-N 3.38Å; Q35-L38 PolarHBondContact O-N 2.96Å; W36-L38 VanDerWaalsContact C-N 3.32Å; W36-L38 PolarHBondContact O-N 3.38Å; L38-Y41 PolarHBondContact O-N 3.33Å; L38-V42 VanDerWaalsContact O-CG2 3.32Å; L38-V42 WeakPolarHBondContact O-CG2 3.33Å; L38-V42 PolarHBondContact O-N 3.16Å |
| 39 | R | 96.3 | Very high | 96.4 | Very high | 181 Ų | 181 | 112.4 Ų | 112.4 | 68% | 0.683 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -62.7 | -42.4 | 175.7 | -72.7 | -179.4 | 85.5 | -153.5 | 5.2 | 111.8 | Q35 W36 V42 S43 | Q35-R39 WeakPolarHBondContact O-CG 3.5Å; Q35-R39 PolarHBondContact O-N 2.88Å; W36-R39 PolarHBondContact O-N 3.43Å; R39-V42 PolarHBondContact O-N 3.27Å; R39-S43 WeakPolarHBondContact O-CB 3.32Å; R39-S43 PolarHBondContact O-N 2.91Å |
| 40 | N | 96.7 | Very high | 96.4 | Very high | 68 Ų | 68 | 113.5 Ų | 113.5 | 36% | 0.364 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -64.6 | -43.5 | 176.8 | -71.1 | -18.3 | 0 | 0 | 0 | 111.7 | W36 N37 S43 Q44 | W36-N40 VanDerWaalsContact CD2-ND2 3.34Å; W36-N40 VanDerWaalsContact CE3-ND2 3.33Å; W36-N40 WeakPolarHBondContact CH2-ND2 3.44Å; W36-N40 WeakPolarHBondContact CZ2-ND2 3.37Å; W36-N40 VanDerWaalsContact CZ3-ND2 3.27Å; W36-N40 WeakPolarHBondContact CZ3-ND2 3.43Å; W36-N40 PolarHBondContact O-N 3.38Å; N37-N40 PolarHBondContact O-N 2.97Å; N40-S43 PolarHBondContact O-N 3.32Å; N40-Q44 PolarHBondContact O-N 3.42Å |
| 41 | Y | 96.2 | Very high | 96.4 | Very high | 149 Ų | 149 | 111.1 Ų | 111.1 | 58% | 0.584 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -59.4 | -48.3 | 175.7 | -178.7 | -94.7 | 0 | 0 | 0 | 112 | N37 L38 S43 Q44 E45 | N37-Y41 WeakPolarHBondContact O-CB 3.3Å; N37-Y41 PolarHBondContact O-N 3.25Å; L38-Y41 PolarHBondContact O-N 3.33Å; Y41-S43 VanDerWaalsContact C-N 3.34Å; Y41-S43 PolarHBondContact O-N 2.86Å; Y41-Q44 PolarHBondContact O-N 3Å; Y41-E45 PolarHBondContact O-N 3.31Å; Y41-E45 VanDerWaalsContact O-N 3.12Å |
| 42 | V | 97.1 | Very high | 96.4 | Very high | 77 Ų | 77 | 112 Ų | 112 | 47% | 0.467 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -64.4 | -39.1 | 177.6 | 173.5 | 0 | 0 | 0 | 0 | 111.5 | L38 R39 Q44 E45 V46 | L38-V42 VanDerWaalsContact O-CG2 3.32Å; L38-V42 WeakPolarHBondContact O-CG2 3.33Å; L38-V42 PolarHBondContact O-N 3.16Å; R39-V42 PolarHBondContact O-N 3.27Å; V42-Q44 VanDerWaalsContact C-N 3.34Å; V42-Q44 PolarHBondContact O-N 3.23Å; V42-E45 PolarHBondContact O-N 3.36Å; V42-V46 HydrophobicContact CG1-CG2 4.4Å; V42-V46 WeakPolarHBondContact O-CG2 3.37Å; V42-V46 PolarHBondContact O-N 2.78Å |
| 43 | S | 96.2 | Very high | 96.4 | Very high | 62 Ų | 62 | 111.3 Ų | 111.3 | 43% | 0.434 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -60.2 | -45.4 | 176.2 | -165.7 | 0 | 0 | 0 | 0 | 111.4 | R39 N40 Y41 E45 V46 D47 | R39-S43 WeakPolarHBondContact O-CB 3.32Å; R39-S43 PolarHBondContact O-N 2.91Å; N40-S43 PolarHBondContact O-N 3.32Å; Y41-S43 VanDerWaalsContact C-N 3.34Å; Y41-S43 PolarHBondContact O-N 2.86Å; S43-E45 VanDerWaalsContact C-N 3.33Å; S43-E45 PolarHBondContact O-N 2.82Å; S43-V46 PolarHBondContact O-N 3.34Å; S43-D47 PolarHBondContact O-N 2.95Å |
| 44 | Q | 96.4 | Very high | 96.4 | Very high | 138 Ų | 138 | 111.9 Ų | 111.9 | 65% | 0.645 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -60.4 | -41.6 | 177.9 | -176.2 | 179.3 | -6.8 | 0 | 0 | 112 | N40 Y41 V42 D47 H48 | N40-Q44 PolarHBondContact O-N 3.42Å; Y41-Q44 PolarHBondContact O-N 3Å; V42-Q44 VanDerWaalsContact C-N 3.34Å; V42-Q44 PolarHBondContact O-N 3.23Å; Q44-D47 PolarHBondContact O-N 3.46Å; Q44-H48 PolarHBondContact O-N 2.92Å |
| 45 | E | 96.1 | Very high | 96.5 | Very high | 110 Ų | 110 | 109.1 Ų | 109.1 | 51% | 0.514 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -66.7 | -40.5 | 178.7 | -163.7 | 64.5 | -166.5 | 0 | 0 | 112 | Y41 V42 S43 H48 F49 | Y41-E45 PolarHBondContact O-N 3.31Å; Y41-E45 VanDerWaalsContact O-N 3.12Å; V42-E45 PolarHBondContact O-N 3.36Å; S43-E45 VanDerWaalsContact C-N 3.33Å; S43-E45 PolarHBondContact O-N 2.82Å; E45-H48 PolarHBondContact O-N 3.35Å; E45-F49 PolarHBondContact O-N 3.41Å |
| 46 | V | 97 | Very high | 96.5 | Very high | 86 Ų | 86 | 108.7 Ų | 108.7 | 52% | 0.521 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.3 | -42 | 175.8 | 171.3 | 0 | 0 | 0 | 0 | 111.1 | V42 S43 H48 F49 R50 | V42-V46 HydrophobicContact CG1-CG2 4.4Å; V42-V46 WeakPolarHBondContact O-CG2 3.37Å; V42-V46 PolarHBondContact O-N 2.78Å; S43-V46 PolarHBondContact O-N 3.34Å; V46-H48 VanDerWaalsContact C-N 3.35Å; V46-F49 PolarHBondContact O-N 2.8Å; V46-R50 VanDerWaalsContact O-CB 3.3Å; V46-R50 WeakPolarHBondContact O-CB 3.35Å; V46-R50 PolarHBondContact O-N 3.39Å |
| 47 | D | 96.8 | Very high | 96.6 | Very high | 92 Ų | 92 | 106 Ų | 106 | 49% | 0.492 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -65.3 | -38.8 | 177 | -71.1 | -34.2 | 0 | 0 | 0 | 111.7 | S43 Q44 R50 A51 | S43-D47 PolarHBondContact O-N 2.95Å; Q44-D47 PolarHBondContact O-N 3.46Å; D47-R50 PolarHBondContact O-N 2.87Å; D47-A51 WeakPolarHBondContact O-CB 3.3Å; D47-A51 PolarHBondContact O-N 2.93Å |
| 48 | H | 96.6 | Very high | 96.5 | Very high | 119 Ų | 119 | 108 Ų | 108 | 55% | 0.551 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -62.4 | -48.7 | 174.1 | -170.1 | 73 | 0 | 0 | 0 | 111.8 | Q44 E45 V46 R50 A51 Q52 | Q44-H48 PolarHBondContact O-N 2.92Å; E45-H48 PolarHBondContact O-N 3.35Å; V46-H48 VanDerWaalsContact C-N 3.35Å; H48-R50 VanDerWaalsContact C-N 3.3Å; H48-R50 PolarHBondContact O-N 3.48Å; H48-A51 PolarHBondContact O-N 2.93Å; H48-Q52 PolarHBondContact O-N 3.36Å |
| 49 | F | 96.2 | Very high | 96.5 | Very high | 148 Ų | 148 | 106.5 Ų | 106.5 | 65% | 0.649 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -61.1 | -40.7 | 177 | -173.3 | -95.8 | 0 | 0 | 0 | 111.7 | E45 V46 Q52 S53 | E45-F49 PolarHBondContact O-N 3.41Å; V46-F49 PolarHBondContact O-N 2.8Å; F49-Q52 PolarHBondContact O-N 3.5Å; F49-S53 WeakPolarHBondContact O-CB 3.4Å; F49-S53 PolarHBondContact O-N 3.43Å |
| 50 | R | 97.1 | Very high | 96.4 | Very high | 164 Ų | 164 | 103 Ų | 103 | 62% | 0.619 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -63.8 | -43.3 | 176.8 | -170.3 | 175.4 | -172 | 155.3 | 1.4 | 111.8 | V46 D47 H48 S53 N54 | V46-R50 VanDerWaalsContact O-CB 3.3Å; V46-R50 WeakPolarHBondContact O-CB 3.35Å; V46-R50 PolarHBondContact O-N 3.39Å; D47-R50 PolarHBondContact O-N 2.87Å; H48-R50 VanDerWaalsContact C-N 3.3Å; H48-R50 PolarHBondContact O-N 3.48Å; R50-S53 PolarHBondContact O-N 2.99Å; R50-N54 WeakPolarHBondContact O-CB 3.37Å; R50-N54 PolarHBondContact O-N 3.27Å; R50-N54 PolarHBondContact O-ND2 3.03Å |
| 51 | A | 96.6 | Very high | 96.2 | Very high | 59 Ų | 59 | 103.9 Ų | 103.9 | 49% | 0.488 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.1 | -43.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | D47 H48 N54 K55 | D47-A51 WeakPolarHBondContact O-CB 3.3Å; D47-A51 PolarHBondContact O-N 2.93Å; H48-A51 PolarHBondContact O-N 2.93Å; A51-N54 PolarHBondContact O-N 3.41Å; A51-K55 PolarHBondContact O-N 2.97Å |
| 52 | Q | 96.7 | Very high | 95.9 | Very high | 109 Ų | 109 | 104.6 Ų | 104.6 | 51% | 0.509 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.9 | -44.2 | 176.9 | -171.9 | 177.4 | -14.2 | 0 | 0 | 111.9 | H48 F49 N54 K55 L56 | H48-Q52 PolarHBondContact O-N 3.36Å; F49-Q52 PolarHBondContact O-N 3.5Å; Q52-N54 PolarHBondContact O-N 2.92Å; Q52-K55 PolarHBondContact O-N 2.94Å; Q52-L56 WeakPolarHBondContact O-CG 3.34Å; Q52-L56 PolarHBondContact O-N 3.41Å |
| 53 | S | 96.8 | Very high | 95.5 | Very high | 60 Ų | 60 | 106.8 Ų | 106.8 | 42% | 0.42 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -62 | -42.1 | 176.5 | -175 | 0 | 0 | 0 | 0 | 112.1 | F49 R50 L56 L57 | F49-S53 WeakPolarHBondContact O-CB 3.4Å; F49-S53 PolarHBondContact O-N 3.43Å; R50-S53 PolarHBondContact O-N 2.99Å; S53-L56 PolarHBondContact O-N 2.89Å; S53-L57 WeakPolarHBondContact O-CB 3.29Å; S53-L57 PolarHBondContact O-N 2.91Å |
| 54 | N | 96.7 | Very high | 95.1 | Very high | 85 Ų | 85 | 110.3 Ų | 110.3 | 46% | 0.455 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -65.2 | -40.2 | 177.6 | -72.7 | -15 | 0 | 0 | 0 | 111.4 | R50 A51 Q52 L57 E58 | R50-N54 WeakPolarHBondContact O-CB 3.37Å; R50-N54 PolarHBondContact O-N 3.27Å; R50-N54 PolarHBondContact O-ND2 3.03Å; A51-N54 PolarHBondContact O-N 3.41Å; Q52-N54 PolarHBondContact O-N 2.92Å; N54-L57 PolarHBondContact O-N 3.23Å; N54-E58 WeakPolarHBondContact O-CG 3.41Å; N54-E58 PolarHBondContact O-N 2.86Å |
| 55 | K | 96.7 | Very high | 94.5 | Very high | 145 Ų | 145 | 105.3 Ų | 105.3 | 63% | 0.63 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -61.9 | -45.5 | 176 | -172.1 | 177.8 | 179.2 | -177.2 | 0 | 111.9 | A51 Q52 L57 E58 D59 | A51-K55 PolarHBondContact O-N 2.97Å; Q52-K55 PolarHBondContact O-N 2.94Å; K55-L57 VanDerWaalsContact C-N 3.29Å; K55-L57 PolarHBondContact O-N 2.89Å; K55-E58 PolarHBondContact O-N 3.39Å; K55-D59 PolarHBondContact O-N 3.31Å |
| 56 | L | 96.7 | Very high | 93.9 | Very high | 102 Ų | 102 | 104.9 Ų | 104.9 | 53% | 0.534 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -61.6 | -38 | 176 | -71.1 | 174.3 | 0 | 0 | 0 | 112.3 | Q52 S53 D59 L60 | Q52-L56 WeakPolarHBondContact O-CG 3.34Å; Q52-L56 PolarHBondContact O-N 3.41Å; S53-L56 PolarHBondContact O-N 2.89Å; L56-D59 PolarHBondContact O-N 2.89Å; L56-L60 WeakPolarHBondContact O-CB 3.46Å; L56-L60 PolarHBondContact O-N 2.72Å |
| 57 | L | 96.1 | Very high | 93 | Very high | 94 Ų | 94 | 103.5 Ų | 103.5 | 49% | 0.492 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -65.8 | -44.3 | 177.1 | -176.2 | 63.3 | 0 | 0 | 0 | 112 | S53 N54 K55 D59 L60 I61 | S53-L57 WeakPolarHBondContact O-CB 3.29Å; S53-L57 PolarHBondContact O-N 2.91Å; N54-L57 PolarHBondContact O-N 3.23Å; K55-L57 VanDerWaalsContact C-N 3.29Å; K55-L57 PolarHBondContact O-N 2.89Å; L57-D59 VanDerWaalsContact C-N 3.34Å; L57-D59 PolarHBondContact O-N 3.4Å; L57-L60 WeakPolarHBondContact O-CB 3.33Å; L57-L60 PolarHBondContact O-N 2.93Å; L57-I61 HydrophobicContact CD1-CD1 4.42Å; L57-I61 HydrophobicContact CG-CD1 4.07Å; L57-I61 WeakPolarHBondContact O-CG1 3.47Å; L57-I61 PolarHBondContact O-N 3.44Å |
| 58 | E | 95.4 | Very high | 91.8 | Very high | 123 Ų | 123 | 102.8 Ų | 102.8 | 58% | 0.575 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -61.2 | -42 | 175.3 | -73.3 | -64.4 | 148.8 | 0 | 0 | 111.9 | N54 K55 L60 I61 R62 | N54-E58 WeakPolarHBondContact O-CG 3.41Å; N54-E58 PolarHBondContact O-N 2.86Å; K55-E58 PolarHBondContact O-N 3.39Å; E58-L60 PolarHBondContact O-N 3.34Å; E58-I61 PolarHBondContact O-N 2.84Å; E58-R62 WeakPolarHBondContact O-CB 3.36Å; E58-R62 PolarHBondContact O-N 3.4Å |
| 59 | D | 95.5 | Very high | 90.5 | Very high | 66 Ų | 66 | 104.1 Ų | 104.1 | 35% | 0.353 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.8 | -40.9 | 175.9 | -71.5 | -26.3 | 0 | 0 | 0 | 111.3 | K55 L56 L57 R62 M63 | K55-D59 PolarHBondContact O-N 3.31Å; L56-D59 PolarHBondContact O-N 2.89Å; L57-D59 VanDerWaalsContact C-N 3.34Å; L57-D59 PolarHBondContact O-N 3.4Å; D59-R62 PolarHBondContact O-N 2.92Å; D59-M63 VanDerWaalsContact O-CG 3.23Å; D59-M63 WeakPolarHBondContact O-CG 3.42Å; D59-M63 PolarHBondContact O-N 3.25Å |
| 60 | L | 93.8 | Very high | 88.9 | Confident | 106 Ų | 106 | 101.5 Ų | 101.5 | 56% | 0.555 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -60.8 | -47.9 | 173.9 | -104.9 | 142.3 | 0 | 0 | 0 | 112.3 | L56 L57 E58 R62 M63 E64 | L56-L60 WeakPolarHBondContact O-CB 3.46Å; L56-L60 PolarHBondContact O-N 2.72Å; L57-L60 WeakPolarHBondContact O-CB 3.33Å; L57-L60 PolarHBondContact O-N 2.93Å; E58-L60 PolarHBondContact O-N 3.34Å; L60-R62 VanDerWaalsContact C-N 3.3Å; L60-R62 PolarHBondContact O-N 2.95Å; L60-M63 PolarHBondContact O-N 2.93Å; L60-E64 PolarHBondContact O-N 2.99Å |
| 61 | I | 92.8 | Very high | 87 | Confident | 88 Ų | 88 | 103.4 Ų | 103.4 | 45% | 0.451 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -61.7 | -40.9 | 177.9 | -68.2 | 166.4 | 0 | 0 | 0 | 110.4 | L57 E58 E64 G65 | L57-I61 HydrophobicContact CD1-CD1 4.42Å; L57-I61 HydrophobicContact CG-CD1 4.07Å; L57-I61 WeakPolarHBondContact O-CG1 3.47Å; L57-I61 PolarHBondContact O-N 3.44Å; E58-I61 PolarHBondContact O-N 2.84Å; I61-E64 PolarHBondContact O-N 3.44Å; I61-G65 PolarHBondContact O-N 3Å |
| 62 | R | 91.5 | Very high | 84.9 | Confident | 164 Ų | 164 | 103.9 Ų | 103.9 | 62% | 0.619 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -61.4 | -47 | 175.2 | -178.4 | -179.8 | -72.7 | 158.7 | -3 | 111.3 | E58 D59 L60 E64 G65 E66 | E58-R62 WeakPolarHBondContact O-CB 3.36Å; E58-R62 PolarHBondContact O-N 3.4Å; D59-R62 PolarHBondContact O-N 2.92Å; L60-R62 VanDerWaalsContact C-N 3.3Å; L60-R62 PolarHBondContact O-N 2.95Å; R62-E64 VanDerWaalsContact C-N 3.35Å; R62-E64 PolarHBondContact O-N 2.85Å; R62-G65 WeakPolarHBondContact O-CA 3.48Å; R62-G65 PolarHBondContact O-N 3.13Å; R62-G65 VanDerWaalsContact O-N 3.14Å; R62-E66 PolarHBondContact O-N 2.93Å |
| 63 | M | 88 | Confident | 82.8 | Confident | 123 Ų | 123 | 108.4 Ų | 108.4 | 61% | 0.606 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -61.4 | -41.3 | 178.2 | -71.2 | -63.5 | -67.6 | 0 | 0 | 111.9 | D59 L60 G65 E66 A67 | D59-M63 VanDerWaalsContact O-CG 3.23Å; D59-M63 WeakPolarHBondContact O-CG 3.42Å; D59-M63 PolarHBondContact O-N 3.25Å; L60-M63 PolarHBondContact O-N 2.93Å; M63-G65 VanDerWaalsContact C-N 3.35Å; M63-E66 PolarHBondContact O-N 3.3Å; M63-A67 WeakPolarHBondContact O-CB 3.22Å; M63-A67 PolarHBondContact O-N 3.34Å |
| 64 | E | 88.2 | Confident | 80.7 | Confident | 135 Ų | 135 | 116.7 Ų | 116.7 | 63% | 0.631 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -64.4 | -39.2 | 173.6 | -72.7 | -165.7 | 155.9 | 0 | 0 | 112.3 | L60 I61 R62 E66 A67 S68 | L60-E64 PolarHBondContact O-N 2.99Å; I61-E64 PolarHBondContact O-N 3.44Å; R62-E64 VanDerWaalsContact C-N 3.35Å; R62-E64 PolarHBondContact O-N 2.85Å; E64-E66 VanDerWaalsContact C-N 3.35Å; E64-E66 PolarHBondContact O-N 3.37Å; E64-A67 PolarHBondContact O-N 3.01Å; E64-S68 VanDerWaalsContact O-CB 3.26Å; E64-S68 WeakPolarHBondContact O-CB 3.39Å; E64-S68 PolarHBondContact O-N 3.5Å |
| 65 | G | 83.5 | Confident | 78.5 | Confident | 33 Ų | 33 | 116.5 Ų | 116.5 | 34% | 0.34 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -60.7 | -42.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | I61 R62 M63 S68 K69 | I61-G65 PolarHBondContact O-N 3Å; R62-G65 WeakPolarHBondContact O-CA 3.48Å; R62-G65 PolarHBondContact O-N 3.13Å; R62-G65 VanDerWaalsContact O-N 3.14Å; M63-G65 VanDerWaalsContact C-N 3.35Å; G65-S68 PolarHBondContact O-N 2.96Å; G65-K69 WeakPolarHBondContact O-CG 3.41Å; G65-K69 PolarHBondContact O-N 2.96Å |
| 66 | E | 83.6 | Confident | 76.3 | Confident | 102 Ų | 102 | 113.2 Ų | 113.2 | 48% | 0.477 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -70.6 | -40.3 | 175.9 | -70.1 | -178.8 | -177.9 | 0 | 0 | 112.7 | R62 M63 E64 S68 K69 T70 | R62-E66 PolarHBondContact O-N 2.93Å; M63-E66 PolarHBondContact O-N 3.3Å; E64-E66 VanDerWaalsContact C-N 3.35Å; E64-E66 PolarHBondContact O-N 3.37Å; E66-S68 VanDerWaalsContact C-N 3.26Å; E66-S68 PolarHBondContact O-N 3.41Å; E66-K69 PolarHBondContact O-N 2.98Å; E66-T70 PolarHBondContact O-N 2.92Å; E66-T70 PolarHBondContact O-OG1 3.5Å |
| 67 | A | 77.1 | Confident | 73.6 | Confident | 57 Ų | 57 | 114.7 Ų | 114.7 | 47% | 0.471 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -61.8 | -36.2 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.6 | M63 E64 T70 R71 | M63-A67 WeakPolarHBondContact O-CB 3.22Å; M63-A67 PolarHBondContact O-N 3.34Å; E64-A67 PolarHBondContact O-N 3.01Å; A67-T70 VanDerWaalsContact CA-OG1 3.31Å; A67-T70 WeakPolarHBondContact CA-OG1 3.26Å; A67-T70 PolarHBondContact O-OG1 2.93Å; A67-R71 VanDerWaalsContact O-CB 3.28Å; A67-R71 WeakPolarHBondContact O-CB 3.38Å; A67-R71 PolarHBondContact O-N 3.24Å |
| 68 | S | 71.7 | Confident | 71.3 | Confident | 77 Ų | 77 | 114.4 Ų | 114.4 | 54% | 0.538 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -70.4 | -42.1 | 174.9 | -168.2 | 0 | 0 | 0 | 0 | 111.7 | E64 G65 E66 T70 R71 S72 | E64-S68 VanDerWaalsContact O-CB 3.26Å; E64-S68 WeakPolarHBondContact O-CB 3.39Å; E64-S68 PolarHBondContact O-N 3.5Å; G65-S68 PolarHBondContact O-N 2.96Å; E66-S68 VanDerWaalsContact C-N 3.26Å; E66-S68 PolarHBondContact O-N 3.41Å; S68-T70 PolarHBondContact O-N 3.06Å; S68-R71 PolarHBondContact O-N 3.42Å; S68-S72 VanDerWaalsContact O-CB 3.26Å; S68-S72 WeakPolarHBondContact O-CB 3.15Å; S68-S72 PolarHBondContact O-N 3.49Å |
| 69 | K | 70.7 | Confident | 68.8 | Low | 147 Ų | 147 | 116.2 Ų | 116.2 | 64% | 0.639 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -61.1 | -42.8 | 174 | -75.9 | 172.7 | -176.5 | 174.1 | 0 | 112.1 | G65 E66 S72 R73 | G65-K69 WeakPolarHBondContact O-CG 3.41Å; G65-K69 PolarHBondContact O-N 2.96Å; E66-K69 PolarHBondContact O-N 2.98Å; K69-S72 PolarHBondContact O-N 3.04Å; K69-R73 PolarHBondContact O-N 3.35Å |
| 70 | T | 61.6 | Low | 66.1 | Low | 92 Ų | 92 | 118.5 Ų | 118.5 | 56% | 0.564 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -68.4 | -39.5 | 176.8 | 48 | 0 | 0 | 0 | 0 | 112.1 | E66 A67 S68 S72 R73 R74 | E66-T70 PolarHBondContact O-N 2.92Å; E66-T70 PolarHBondContact O-OG1 3.5Å; A67-T70 VanDerWaalsContact CA-OG1 3.31Å; A67-T70 WeakPolarHBondContact CA-OG1 3.26Å; A67-T70 PolarHBondContact O-OG1 2.93Å; S68-T70 PolarHBondContact O-N 3.06Å; T70-S72 VanDerWaalsContact C-N 3.34Å; T70-R73 PolarHBondContact O-N 2.84Å; T70-R74 PolarHBondContact O-N 3.42Å |
| 71 | R | 56.4 | Low | 63.8 | Low | 204 Ų | 204 | 119.8 Ų | 119.8 | 77% | 0.77 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -64.7 | -36.9 | 171.9 | -174.7 | 177.4 | -97 | 172.1 | -5.3 | 112.1 | A67 S68 R74 A75 | A67-R71 VanDerWaalsContact O-CB 3.28Å; A67-R71 WeakPolarHBondContact O-CB 3.38Å; A67-R71 PolarHBondContact O-N 3.24Å; S68-R71 PolarHBondContact O-N 3.42Å; R71-R74 PolarHBondContact O-N 2.98Å; R71-A75 PolarHBondContact O-N 3.4Å |
| 72 | S | 53.9 | Low | 61.4 | Low | 70 Ų | 70 | 121.4 Ų | 121.4 | 49% | 0.49 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -68.2 | -42.6 | 176.5 | -171.3 | 0 | 0 | 0 | 0 | 111.9 | S68 K69 T70 R74 A75 S76 | S68-S72 VanDerWaalsContact O-CB 3.26Å; S68-S72 WeakPolarHBondContact O-CB 3.15Å; S68-S72 PolarHBondContact O-N 3.49Å; K69-S72 PolarHBondContact O-N 3.04Å; T70-S72 VanDerWaalsContact C-N 3.34Å; S72-R74 VanDerWaalsContact C-N 3.28Å; S72-R74 PolarHBondContact O-N 3.1Å; S72-A75 CarbonylContact O-C 3.49Å; S72-A75 WeakPolarHBondContact O-CA 3.49Å; S72-A75 WeakPolarHBondContact O-CB 3.42Å; S72-A75 PolarHBondContact O-N 3.46Å; S72-S76 WeakPolarHBondContact O-CB 3.24Å; S72-S76 PolarHBondContact O-N 3.49Å; S72-S76 PolarHBondContact O-OG 3.18Å |
| 73 | R | 53 | Low | 59 | Low | 203 Ų | 203 | 121.1 Ų | 121.1 | 77% | 0.766 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -60.9 | -33.6 | 173.8 | -77.1 | -172.2 | -179.7 | -165 | 1 | 113.2 | K69 T70 A75 | K69-R73 PolarHBondContact O-N 3.35Å; T70-R73 PolarHBondContact O-N 2.84Å; R73-A75 VanDerWaalsContact C-N 3.3Å |
| 74 | R | 51 | Low | 57.3 | Low | 234 Ų | 234 | 124.2 Ų | 124.2 | 88% | 0.883 | 65% | 0.652 | S | S | * | * | H | α-helix | trans | -68.7 | -26.9 | 171 | -85.2 | -174.8 | -174.5 | 161.3 | 3.7 | 113.2 | T70 R71 S72 | T70-R74 PolarHBondContact O-N 3.42Å; R71-R74 PolarHBondContact O-N 2.98Å; S72-R74 VanDerWaalsContact C-N 3.28Å; S72-R74 PolarHBondContact O-N 3.1Å |
| 75 | A | 51.5 | Low | 55.4 | Low | 82 Ų | 82 | 125.4 Ų | 125.4 | 68% | 0.678 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -88.2 | -23 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | R71 S72 R73 | R71-A75 PolarHBondContact O-N 3.4Å; S72-A75 CarbonylContact O-C 3.49Å; S72-A75 WeakPolarHBondContact O-CA 3.49Å; S72-A75 WeakPolarHBondContact O-CB 3.42Å; S72-A75 PolarHBondContact O-N 3.46Å; R73-A75 VanDerWaalsContact C-N 3.3Å |
| 76 | S | 49.7 | Very low | 53.5 | Low | 76 Ų | 76 | 131.5 Ų | 131.5 | 53% | 0.531 | 68% | 0.683 | S | S | . | * | S | Bend | trans | -98.1 | 21.6 | -173.3 | 78.3 | 0 | 0 | 0 | 0 | 114.4 | S72 P78 | S72-S76 WeakPolarHBondContact O-CB 3.24Å; S72-S76 PolarHBondContact O-N 3.49Å; S72-S76 PolarHBondContact O-OG 3.18Å; S76-P78 WeakPolarHBondContact O-CD 3.44Å |
| 77 | N | 41.3 | Very low | 51.8 | Low | 132 Ų | 132 | 132.3 Ų | 132.3 | 71% | 0.706 | 70% | 0.695 | S | S | * | * | trans | -102.6 | 55.5 | 161.7 | -160.9 | 26.1 | 0 | 0 | 0 | 111.7 | Q79 | N77-Q79 PolarHBondContact O-N 3.48Š| ||
| 78 | P | 46.9 | Very low | 50.2 | Low | 89 Ų | 89 | 135.3 Ų | 135.3 | 58% | 0.578 | 71% | 0.711 | S | S | * | * | trans | -73.7 | 111.9 | 156.5 | 32.1 | -25.8 | 0 | 0 | 0 | 105.6 | S76 C80 | S76-P78 WeakPolarHBondContact O-CD 3.44Å; P78-C80 PolarHBondContact O-N 2.93Å | ||
| 79 | Q | 42.8 | Very low | 48.9 | Very low | 160 Ų | 160 | 137.1 Ų | 137.1 | 75% | 0.748 | 72% | 0.721 | S | S | * | * | trans | -52.7 | 105.9 | 165.4 | -72.8 | -175 | -28.9 | 0 | 0 | 107.5 | N77 I81 | N77-Q79 PolarHBondContact O-N 3.48Å; Q79-I81 VanDerWaalsContact C-N 3.29Å; Q79-I81 PolarHBondContact O-N 2.89Å | ||
| 80 | C | 39.6 | Very low | 47.6 | Very low | 115 Ų | 115 | 135.9 Ų | 135.9 | 78% | 0.777 | 73% | 0.73 | S | S | * | * | trans | -68 | 94.8 | 169.5 | -69.6 | 0 | 0 | 0 | 0 | 106.9 | P78 C82 | P78-C80 PolarHBondContact O-N 2.93Å; C80-C82 PolarHBondContact O-N 3.07Å | ||
| 81 | I | 46 | Very low | 46.9 | Very low | 132 Ų | 132 | 134.4 Ų | 134.4 | 68% | 0.677 | 73% | 0.733 | S | S | * | * | trans | -74.5 | 106.2 | 167.3 | -53.6 | 173.9 | 0 | 0 | 0 | 105.2 | Q79 H83 | Q79-I81 VanDerWaalsContact C-N 3.29Å; Q79-I81 PolarHBondContact O-N 2.89Å; I81-H83 PolarHBondContact O-N 3.07Å; I81-H83 VanDerWaalsContact O-N 3.07Å | ||
| 82 | C | 40.9 | Very low | 46.3 | Very low | 123 Ų | 123 | 130.8 Ų | 130.8 | 83% | 0.831 | 74% | 0.737 | S | S | * | * | trans | -62.1 | 109.2 | 173.4 | -60.4 | 0 | 0 | 0 | 0 | 108.3 | C80 | C80-C82 PolarHBondContact O-N 3.07Š| ||
| 83 | H | 41.4 | Very low | 45.7 | Very low | 158 Ų | 158 | 137.7 Ų | 137.7 | 73% | 0.731 | 75% | 0.752 | S | S | * | * | trans | -77.3 | 136.9 | 166.9 | -92.2 | -93.1 | 0 | 0 | 0 | 109.3 | I81 E85 | I81-H83 PolarHBondContact O-N 3.07Å; I81-H83 VanDerWaalsContact O-N 3.07Å; H83-E85 PolarHBondContact O-N 2.92Å | ||
| 84 | E | 52.9 | Low | 45.1 | Very low | 187 Ų | 187 | 130.9 Ų | 130.9 | 87% | 0.874 | 75% | 0.745 | S | S | * | * | S | Bend | trans | -66.5 | -22.6 | -173.8 | -169 | 150.7 | -173.2 | 0 | 0 | 113.3 | N86 | E84-N86 PolarHBondContact O-N 3.03Š|
| 85 | E | 47.9 | Very low | 44.5 | Very low | 160 Ų | 160 | 129.4 Ų | 129.4 | 75% | 0.748 | 75% | 0.745 | S | S | * | * | S | Bend | trans | -84.6 | 108.6 | 170.4 | -65.9 | 179 | 178.2 | 0 | 0 | 108.2 | H83 V87 | H83-E85 PolarHBondContact O-N 2.92Å; E85-V87 PolarHBondContact O-N 3Å |
| 86 | N | 44.4 | Very low | 44.1 | Very low | 162 Ų | 162 | 130.6 Ų | 130.6 | 87% | 0.866 | 75% | 0.745 | S | S | * | * | trans | -63.8 | 44.1 | 178.8 | -71.2 | -72.3 | 0 | 0 | 0 | 113.8 | E84 | E84-N86 PolarHBondContact O-N 3.03Š| ||
| 87 | V | 47.1 | Very low | 43.4 | Very low | 119 Ų | 119 | 129.2 Ų | 129.2 | 72% | 0.721 | 74% | 0.744 | S | S | * | * | trans | -108.1 | 91.4 | 170 | -174.5 | 0 | 0 | 0 | 0 | 106.4 | E85 P89 | E85-V87 PolarHBondContact O-N 3Å; V87-P89 VanDerWaalsContact O-CD 3.23Å; V87-P89 WeakPolarHBondContact O-CD 3.41Å; V87-P89 VanDerWaalsContact O-N 3.17Å | ||
| 88 | C | 43.4 | Very low | 43.3 | Very low | 119 Ų | 119 | 134.6 Ų | 134.6 | 80% | 0.804 | 75% | 0.754 | S | S | * | * | trans | -63 | 115.9 | 174.2 | -67.3 | 0 | 0 | 0 | 0 | 108.6 | S90 | C88-S90 PolarHBondContact O-N 3.2Š| ||
| 89 | P | 44 | Very low | 42.9 | Very low | 116 Ų | 116 | 141.6 Ų | 141.6 | 75% | 0.753 | 77% | 0.769 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 134.1 | 173.9 | 24.9 | -31 | 0 | 0 | 0 | 108 | V87 G91 | V87-P89 VanDerWaalsContact O-CD 3.23Å; V87-P89 WeakPolarHBondContact O-CD 3.41Å; V87-P89 VanDerWaalsContact O-N 3.17Å; P89-G91 PolarHBondContact O-N 3.24Å; P89-G91 VanDerWaalsContact O-N 3.08Å |
| 90 | S | 44.7 | Very low | 42.6 | Very low | 120 Ų | 120 | 136.4 Ų | 136.4 | 84% | 0.839 | 76% | 0.758 | S | S | * | * | P | Polyproline II helix | trans | -48.1 | 122.1 | 174.5 | -48.3 | 0 | 0 | 0 | 0 | 108.3 | C88 | C88-S90 PolarHBondContact O-N 3.2Š|
| 91 | G | 46.3 | Very low | 42.3 | Very low | 61 Ų | 61 | 136.8 Ų | 136.8 | 63% | 0.629 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -49.1 | 147.7 | -175.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | P89 R93 | P89-G91 PolarHBondContact O-N 3.24Å; P89-G91 VanDerWaalsContact O-N 3.08Å; G91-R93 PolarHBondContact O-N 2.81Å |
| 92 | P | 43 | Very low | 42 | Very low | 129 Ų | 129 | 136.3 Ų | 136.3 | 84% | 0.838 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -54.7 | 129.2 | -171.7 | 21.8 | -32.8 | 0 | 0 | 0 | 110.2 | G94 | P92-G94 PolarHBondContact O-N 3.48Š|
| 93 | R | 42.8 | Very low | 41.8 | Very low | 215 Ų | 215 | 133.2 Ų | 133.2 | 81% | 0.811 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -46.7 | 126.1 | 176.4 | -173.6 | 177.2 | 79.1 | 174.7 | 2.1 | 108.8 | G91 | G91-R93 PolarHBondContact O-N 2.81Š|
| 94 | G | 40.3 | Very low | 41.7 | Very low | 60 Ų | 60 | 135.2 Ų | 135.2 | 62% | 0.619 | 76% | 0.762 | S | S | * | * | P | Polyproline II helix | trans | -48.2 | 142.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | P92 | P92-G94 PolarHBondContact O-N 3.48Š|
| 95 | K | 37.1 | Very low | 41.3 | Very low | 203 Ų | 203 | 132.3 Ų | 132.3 | 88% | 0.883 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 132.9 | -178.9 | -66.5 | -177.4 | -179.1 | -178.3 | 0 | 109 | G97 | K95-G97 PolarHBondContact O-N 3.4Š|
| 96 | P | 42.5 | Very low | 41 | Very low | 106 Ų | 106 | 127.5 Ų | 127.5 | 69% | 0.688 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -50.1 | 138.7 | 174.2 | -26.5 | 33.9 | 0 | 0 | 0 | 110.7 | ||
| 97 | G | 36.5 | Very low | 40.7 | Very low | 48 Ų | 48 | 129.7 Ų | 129.7 | 50% | 0.495 | 75% | 0.754 | S | S | . | * | P | Polyproline II helix | trans | -54.1 | 152.2 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | K95 R99 | K95-G97 PolarHBondContact O-N 3.4Å; G97-R99 PolarHBondContact O-N 2.8Å |
| 98 | R | 37.8 | Very low | 40.3 | Very low | 244 Ų | 244 | 133.2 Ų | 133.2 | 92% | 0.921 | 76% | 0.76 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 135.7 | 178.1 | -69.5 | -174.6 | 179.2 | -129.3 | 3.6 | 109.4 | G100 | R98-G100 PolarHBondContact O-N 3.39Š|
| 99 | R | 39.3 | Very low | 40.1 | Very low | 236 Ų | 236 | 130.5 Ų | 130.5 | 89% | 0.891 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -55 | 123.1 | 174 | -169.5 | 179 | -57 | -171.3 | 3.7 | 108.2 | G97 | G97-R99 PolarHBondContact O-N 2.8Š|
| 100 | G | 36.6 | Very low | 39.7 | Very low | 51 Ų | 51 | 136 Ų | 136 | 53% | 0.526 | 76% | 0.757 | S | S | . | * | P | Polyproline II helix | trans | -56.1 | 146.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | R98 | R98-G100 PolarHBondContact O-N 3.39Š|
| 101 | C | 32.9 | Very low | 39.2 | Very low | 123 Ų | 123 | 139.8 Ų | 139.8 | 83% | 0.831 | 76% | 0.759 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 141.4 | 175.8 | -61.5 | 0 | 0 | 0 | 0 | 110.1 | G103 | C101-G103 PolarHBondContact O-N 3.5Š|
| 102 | P | 39.3 | Very low | 38.7 | Very low | 123 Ų | 123 | 140.2 Ų | 140.2 | 80% | 0.799 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -50.2 | 136.3 | 173.8 | -24.4 | 32.2 | 0 | 0 | 0 | 110.9 | ||
| 103 | G | 38.4 | Very low | 38.3 | Very low | 57 Ų | 57 | 142.6 Ų | 142.6 | 59% | 0.588 | 76% | 0.763 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 143.6 | 173.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | C101 | C101-G103 PolarHBondContact O-N 3.5Š|
| 104 | K | 39.2 | Very low | 37.9 | Very low | 200 Ų | 200 | 143.6 Ų | 143.6 | 87% | 0.87 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -56.5 | 140.2 | 176 | -64.7 | -175.9 | 179.9 | -174.9 | 0 | 109.2 | G106 | K104-G106 PolarHBondContact O-N 3.31Š|
| 105 | P | 43.1 | Very low | 37.5 | Very low | 126 Ų | 126 | 144.2 Ų | 144.2 | 82% | 0.818 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -49.3 | 136.5 | 175.3 | -27.8 | 34.5 | 0 | 0 | 0 | 111.4 | ||
| 106 | G | 42.2 | Very low | 37.2 | Very low | 59 Ų | 59 | 144 Ų | 144 | 61% | 0.608 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -55.5 | 140.7 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | K104 K108 | K104-G106 PolarHBondContact O-N 3.31Å; G106-K108 PolarHBondContact O-N 3.38Å |
| 107 | K | 37.2 | Very low | 36.7 | Very low | 208 Ų | 208 | 145.2 Ų | 145.2 | 90% | 0.904 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 136.8 | 176 | -68.4 | -179.2 | 179.2 | 177.8 | 0 | 109.2 | G109 | K107-G109 PolarHBondContact O-N 2.69Š|
| 108 | K | 40.1 | Very low | 36.4 | Very low | 194 Ų | 194 | 146.2 Ų | 146.2 | 84% | 0.843 | 79% | 0.791 | S | S | * | * | P | Polyproline II helix | trans | -46.9 | 126.7 | 175.5 | -175.2 | 175.8 | -179.4 | 176.4 | 0 | 109.7 | G106 R110 | G106-K108 PolarHBondContact O-N 3.38Å; K108-R110 PolarHBondContact O-N 3.21Å |
| 109 | G | 38.3 | Very low | 36.5 | Very low | 61 Ų | 61 | 140.6 Ų | 140.6 | 63% | 0.629 | 79% | 0.786 | S | S | * | * | P | Polyproline II helix | trans | -53.4 | 134.4 | -177.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | K107 | K107-G109 PolarHBondContact O-N 2.69Š|
| 110 | R | 36.4 | Very low | 36.1 | Very low | 231 Ų | 231 | 138.9 Ų | 138.9 | 87% | 0.872 | 78% | 0.784 | S | S | * | * | P | Polyproline II helix | trans | -69.9 | 144.4 | 173.7 | -67.4 | -177.3 | 117.8 | -174.3 | -0 | 109.3 | K108 G112 | K108-R110 PolarHBondContact O-N 3.21Å; R110-G112 PolarHBondContact O-N 3.45Å |
| 111 | K | 34.6 | Very low | 36.2 | Very low | 200 Ų | 200 | 144 Ų | 144 | 87% | 0.87 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 127.1 | 171.4 | -175.5 | 178.1 | 179.7 | -179.5 | 0 | 108.3 | E113 | K111-E113 PolarHBondContact O-N 3.31Š|
| 112 | G | 34.6 | Very low | 36.7 | Very low | 70 Ų | 70 | 144.6 Ų | 144.6 | 72% | 0.722 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 122.2 | -172.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | R110 | R110-G112 PolarHBondContact O-N 3.45Š|
| 113 | E | 35.6 | Very low | 36.8 | Very low | 180 Ų | 180 | 144.5 Ų | 144.5 | 84% | 0.841 | 80% | 0.799 | S | S | * | * | P | Polyproline II helix | trans | -87.9 | 143.5 | 169.7 | -67.3 | -175.4 | 157.8 | 0 | 0 | 109.6 | K111 G115 | K111-E113 PolarHBondContact O-N 3.31Å; E113-G115 PolarHBondContact O-N 3.08Å |
| 114 | R | 34.3 | Very low | 36.7 | Very low | 235 Ų | 235 | 149.6 Ų | 149.6 | 89% | 0.887 | 81% | 0.811 | S | S | * | * | P | Polyproline II helix | trans | -60.5 | 128.8 | 179.8 | 172.3 | 167 | 41.1 | -153.1 | -8.8 | 110 | ||
| 115 | G | 31.4 | Very low | 36.7 | Very low | 73 Ų | 73 | 146.2 Ų | 146.2 | 75% | 0.753 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 135.3 | -169.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | E113 | E113-G115 PolarHBondContact O-N 3.08Š|
| 116 | K | 31.1 | Very low | 36.5 | Very low | 200 Ų | 200 | 145.9 Ų | 145.9 | 87% | 0.87 | 80% | 0.804 | S | S | * | * | P | Polyproline II helix | trans | -98.6 | 136.2 | 167.3 | -68.3 | -175.4 | -179.5 | -177.3 | 0 | 109 | ||
| 117 | P | 32.9 | Very low | 36.3 | Very low | 131 Ų | 131 | 152.8 Ų | 152.8 | 85% | 0.851 | 82% | 0.818 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 155.3 | 179.2 | -24.6 | 34 | 0 | 0 | 0 | 114 | ||
| 118 | G | 29.3 | Very low | 36.8 | Very low | 69 Ų | 69 | 148.3 Ų | 148.3 | 71% | 0.711 | 81% | 0.81 | S | S | * | * | trans | -72.8 | -168.3 | -164.7 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||||
| 119 | P | 39.1 | Very low | 36.8 | Very low | 126 Ų | 126 | 143.8 Ų | 143.8 | 82% | 0.818 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | -98.7 | 162.4 | -128.7 | 34.9 | -28.9 | 0 | 0 | 0 | 113.8 | |||
| 120 | K | 31.6 | Very low | 36.6 | Very low | 199 Ų | 199 | 148.6 Ų | 148.6 | 87% | 0.865 | 81% | 0.807 | S | S | * | * | P | Polyproline II helix | trans | -90.5 | 132.7 | 173.9 | -63.6 | 178.3 | 179 | -179.3 | 0 | 109.7 | ||
| 121 | D | 39.4 | Very low | 36.3 | Very low | 160 Ų | 160 | 144 Ų | 144 | 86% | 0.856 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 130.3 | 173.4 | -59.8 | -50.1 | 0 | 0 | 0 | 110.8 | ||
| 122 | V | 41.8 | Very low | 36.2 | Very low | 134 Ų | 134 | 140.8 Ų | 140.8 | 81% | 0.812 | 80% | 0.796 | S | S | * | * | trans | -108.7 | 124.2 | 173 | -86.4 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 123 | P | 41.2 | Very low | 36.1 | Very low | 121 Ų | 121 | 146.1 Ų | 146.1 | 79% | 0.786 | 80% | 0.8 | S | S | * | * | trans | -73.5 | 141.4 | 179.6 | -15 | 29.4 | 0 | 0 | 0 | 113.1 | ||||
| 124 | I | 36.3 | Very low | 36 | Very low | 164 Ų | 164 | 146.1 Ų | 146.1 | 84% | 0.841 | 80% | 0.797 | S | S | * | * | trans | -78.3 | 127.6 | 175.3 | -61.4 | 165.3 | 0 | 0 | 0 | 108.7 | ||||
| 125 | V | 40.4 | Very low | 35.8 | Very low | 130 Ų | 130 | 141.3 Ų | 141.3 | 79% | 0.788 | 80% | 0.797 | S | S | * | * | trans | -125 | 127.9 | 165.5 | -173.1 | 0 | 0 | 0 | 0 | 109 | ||||
| 126 | P | 39 | Very low | 36.3 | Very low | 118 Ų | 118 | 144.3 Ų | 144.3 | 77% | 0.766 | 80% | 0.797 | S | S | * | * | trans | -85.4 | 153.3 | -168.8 | 16.2 | -0.1 | 0 | 0 | 0 | 112.2 | ||||
| 127 | K | 36.9 | Very low | 37.1 | Very low | 205 Ų | 205 | 138.9 Ų | 138.9 | 89% | 0.891 | 79% | 0.789 | S | S | * | * | trans | -109.2 | 140.6 | -179.6 | -146.3 | 167.1 | -173.4 | 156.5 | 0 | 111.1 | ||||
| 128 | P | 47.4 | Very low | 37.6 | Very low | 114 Ų | 114 | 138.7 Ų | 138.7 | 74% | 0.74 | 79% | 0.787 | S | S | * | * | trans | -90 | 175.8 | -167.9 | 1.5 | 21.1 | 0 | 0 | 0 | 113.5 | ||||
| 129 | P | 41.6 | Very low | 38.3 | Very low | 99 Ų | 99 | 142.6 Ų | 142.6 | 64% | 0.643 | 79% | 0.785 | S | S | * | * | trans | -105.9 | 165.5 | -152.5 | 41.3 | -35.1 | 0 | 0 | 0 | 115.6 | ||||
| 130 | Q | 33 | Very low | 38.8 | Very low | 162 Ų | 162 | 139 Ų | 139 | 76% | 0.757 | 77% | 0.771 | S | S | * | * | trans | 63.1 | 150.9 | 145.9 | -70.4 | 162.7 | -8.6 | 0 | 0 | 117.3 | ||||
| 131 | E | 31.3 | Very low | 39.4 | Very low | 135 Ų | 135 | 135 Ų | 135 | 63% | 0.631 | 77% | 0.765 | S | S | * | * | cis | -168.9 | 150.8 | 2.5 | -112.2 | 165.3 | -152 | 0 | 0 | 106.2 | ||||
| 132 | C | 31.1 | Very low | 39.8 | Very low | 131 Ų | 131 | 132.5 Ų | 132.5 | 89% | 0.885 | 76% | 0.758 | S | S | * | * | trans | -164.9 | 114.2 | 148.3 | -111 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 133 | F | 33 | Very low | 39.9 | Very low | 182 Ų | 182 | 128.5 Ų | 128.5 | 80% | 0.798 | 74% | 0.744 | S | S | * | * | trans | -73.8 | 122.3 | 173.5 | -79.2 | -103.3 | 0 | 0 | 0 | 110.6 | ||||
| 134 | K | 33.4 | Very low | 40.1 | Very low | 181 Ų | 181 | 131.6 Ų | 131.6 | 79% | 0.787 | 75% | 0.748 | S | S | * | * | trans | -132 | 125.2 | 157.8 | -74.3 | -173 | 179.9 | 174.9 | 0 | 108.8 | D136 | K134-D136 VanDerWaalsContact C-N 3.3Å; K134-D136 PolarHBondContact O-N 3.19Å | ||
| 135 | C | 30.5 | Very low | 40.5 | Very low | 133 Ų | 133 | 128.2 Ų | 128.2 | 90% | 0.899 | 74% | 0.736 | S | S | * | * | trans | -73.4 | 80.7 | -176.8 | -58.3 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 136 | D | 42.6 | Very low | 40.7 | Very low | 137 Ų | 137 | 124.2 Ų | 124.2 | 73% | 0.733 | 72% | 0.721 | S | S | * | * | trans | -110.4 | 124.5 | 165.8 | -68.5 | -49.7 | 0 | 0 | 0 | 107.6 | K134 | K134-D136 VanDerWaalsContact C-N 3.3Å; K134-D136 PolarHBondContact O-N 3.19Å | ||
| 137 | A | 48.1 | Very low | 40.8 | Very low | 85 Ų | 85 | 124.6 Ų | 124.6 | 70% | 0.702 | 72% | 0.724 | S | S | * | * | trans | -40.9 | 133.6 | -178.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | K139 | A137-K139 PolarHBondContact O-N 3.17Š| ||
| 138 | P | 43.5 | Very low | 41.2 | Very low | 127 Ų | 127 | 122.5 Ų | 122.5 | 83% | 0.825 | 71% | 0.71 | S | S | * | * | trans | -55.3 | 106.7 | -163.8 | 20.5 | -31.8 | 0 | 0 | 0 | 109.8 | G140 | P138-G140 PolarHBondContact O-N 3.4Å; P138-G140 VanDerWaalsContact O-N 3.1Å | ||
| 139 | K | 42.8 | Very low | 41.1 | Very low | 151 Ų | 151 | 119.2 Ų | 119.2 | 66% | 0.657 | 70% | 0.697 | S | S | * | * | P | Polyproline II helix | trans | -47.5 | 121.5 | 169 | -166 | 174.1 | -174.6 | 173.6 | 0 | 105.8 | A137 | A137-K139 PolarHBondContact O-N 3.17Š|
| 140 | G | 50.3 | Low | 41.2 | Very low | 52 Ų | 52 | 120.1 Ų | 120.1 | 54% | 0.536 | 70% | 0.703 | S | S | . | * | P | Polyproline II helix | trans | -47.1 | 140.7 | -177.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | P138 | P138-G140 PolarHBondContact O-N 3.4Å; P138-G140 VanDerWaalsContact O-N 3.1Å |
| 141 | P | 44.5 | Very low | 42 | Very low | 113 Ų | 113 | 117.5 Ų | 117.5 | 73% | 0.734 | 70% | 0.7 | S | S | * | * | P | Polyproline II helix | trans | -51.8 | 141.7 | -170.3 | 20.8 | -32.9 | 0 | 0 | 0 | 110.2 | G143 | P141-G143 PolarHBondContact O-N 3.37Š|
| 142 | P | 46.7 | Very low | 42.7 | Very low | 108 Ų | 108 | 113.5 Ų | 113.5 | 70% | 0.701 | 70% | 0.695 | S | S | * | * | P | Polyproline II helix | trans | -47 | 135 | 176.3 | -27.1 | 33.6 | 0 | 0 | 0 | 110.6 | Q144 | P142-Q144 PolarHBondContact O-N 3.19Š|
| 143 | G | 44.8 | Very low | 43.4 | Very low | 50 Ų | 50 | 112 Ų | 112 | 52% | 0.515 | 69% | 0.691 | S | S | . | * | P | Polyproline II helix | trans | -54.7 | 136.3 | 175.4 | 0 | 0 | 0 | 0 | 0 | 109.9 | P141 | P141-G143 PolarHBondContact O-N 3.37Š|
| 144 | Q | 44 | Very low | 44.1 | Very low | 186 Ų | 186 | 109.9 Ų | 109.9 | 87% | 0.869 | 68% | 0.682 | S | S | * | * | P | Polyproline II helix | trans | -57.3 | 140 | 179.8 | -69.7 | -176.1 | 17.5 | 0 | 0 | 110.1 | P142 G146 | P142-Q144 PolarHBondContact O-N 3.19Å; Q144-G146 PolarHBondContact O-N 3.43Å |
| 145 | P | 45.7 | Very low | 44.7 | Very low | 93 Ų | 93 | 103.1 Ų | 103.1 | 60% | 0.604 | 66% | 0.664 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 134.2 | 172.8 | -26.1 | 34.2 | 0 | 0 | 0 | 110.7 | ||
| 146 | G | 43.8 | Very low | 45.5 | Very low | 46 Ų | 46 | 101.8 Ų | 101.8 | 47% | 0.474 | 65% | 0.653 | S | S | . | * | P | Polyproline II helix | trans | -61.4 | 151.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | Q144 | Q144-G146 PolarHBondContact O-N 3.43Š|
| 147 | P | 42.5 | Very low | 45.7 | Very low | 126 Ų | 126 | 100.7 Ų | 100.7 | 82% | 0.818 | 65% | 0.654 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 147.5 | 179.7 | 25.6 | -34 | 0 | 0 | 0 | 111 | G149 | P147-G149 PolarHBondContact O-N 3.1Š|
| 148 | R | 45.8 | Very low | 45.7 | Very low | 162 Ų | 162 | 98.5 Ų | 98.5 | 61% | 0.611 | 64% | 0.64 | S | S | * | * | P | Polyproline II helix | trans | -55.3 | 131.8 | 173.6 | -176.5 | -179.3 | 177.6 | 178.2 | 2.4 | 109.3 | P251 | R148-P251 VanDerWaalsContact NH2-CB 3.3Š|
| 149 | G | 44.7 | Very low | 45.8 | Very low | 44 Ų | 44 | 97.8 Ų | 97.8 | 45% | 0.454 | 64% | 0.635 | S | S | . | * | P | Polyproline II helix | trans | -61.2 | 153.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | P147 | P147-G149 PolarHBondContact O-N 3.1Š|
| 150 | P | 43 | Very low | 46 | Very low | 118 Ų | 118 | 95.2 Ų | 95.2 | 77% | 0.766 | 63% | 0.634 | S | S | * | * | P | Polyproline II helix | trans | -62 | 154.3 | -179.3 | 26.5 | -34.2 | 0 | 0 | 0 | 111.6 | ||
| 151 | P | 49.6 | Very low | 45.9 | Very low | 108 Ų | 108 | 94.1 Ų | 94.1 | 70% | 0.701 | 62% | 0.623 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 144.6 | 173.6 | -24.6 | 34.3 | 0 | 0 | 0 | 112.3 | ||
| 152 | G | 47.2 | Very low | 46 | Very low | 51 Ų | 51 | 96 Ų | 96 | 53% | 0.526 | 63% | 0.627 | S | S | . | * | P | Polyproline II helix | trans | -66.8 | 149.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||
| 153 | A | 44.1 | Very low | 46 | Very low | 98 Ų | 98 | 96.2 Ų | 96.2 | 81% | 0.81 | 62% | 0.622 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 148.3 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | G155 | A153-G155 PolarHBondContact O-N 2.78Š|
| 154 | K | 48.2 | Very low | 46.2 | Very low | 139 Ų | 139 | 95.7 Ų | 95.7 | 60% | 0.604 | 62% | 0.617 | S | S | * | * | P | Polyproline II helix | trans | -59.7 | 134.7 | 174.7 | -176.3 | 168.4 | -175.5 | 144.4 | 0 | 110.5 | D248 | K154-D248 WeakPolarHBondContact CD-OD1 3.23Å; K154-D248 WeakPolarHBondContact CE-OD1 3.42Å; K154-D248 WeakPolarHBondContact CG-OD1 3.31Å; K154-D248 IonicContact NZ-OD1 2.92Å; K154-D248 PolarHBondContact NZ-OD1 2.96Å |
| 155 | G | 47.4 | Very low | 46.4 | Very low | 39 Ų | 39 | 96.3 Ų | 96.3 | 40% | 0.402 | 62% | 0.616 | S | S | . | * | P | Polyproline II helix | trans | -67.4 | 154.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | A153 | A153-G155 PolarHBondContact O-N 2.78Š|
| 156 | P | 45.7 | Very low | 46.6 | Very low | 104 Ų | 104 | 98.3 Ų | 98.3 | 68% | 0.675 | 62% | 0.617 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 158 | 179.5 | 28.1 | -34.9 | 0 | 0 | 0 | 112 | ||
| 157 | P | 46.7 | Very low | 46.9 | Very low | 114 Ų | 114 | 97.7 Ų | 97.7 | 74% | 0.74 | 61% | 0.611 | S | S | * | * | P | Polyproline II helix | trans | -54.1 | 147.9 | 172.6 | -24.6 | 34.3 | 0 | 0 | 0 | 112.8 | ||
| 158 | G | 48.1 | Very low | 47.2 | Very low | 40 Ų | 40 | 99.1 Ų | 99.1 | 41% | 0.412 | 61% | 0.612 | S | S | . | * | P | Polyproline II helix | trans | -68.9 | 159.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||
| 159 | P | 45.7 | Very low | 47.4 | Very low | 111 Ų | 111 | 99.2 Ų | 99.2 | 72% | 0.721 | 61% | 0.612 | S | S | * | * | P | Polyproline II helix | trans | -65.7 | 156.4 | 177.8 | 28.3 | -34.4 | 0 | 0 | 0 | 111.8 | ||
| 160 | P | 47 | Very low | 47.8 | Very low | 97 Ų | 97 | 98.9 Ų | 98.9 | 63% | 0.63 | 61% | 0.608 | S | S | * | * | P | Polyproline II helix | trans | -56.2 | 148.8 | 173.4 | -24 | 34.1 | 0 | 0 | 0 | 112.8 | ||
| 161 | G | 48.9 | Very low | 48.2 | Very low | 30 Ų | 30 | 97.7 Ų | 97.7 | 31% | 0.309 | 61% | 0.609 | S | S | . | * | P | Polyproline II helix | trans | -66.9 | 153.3 | 173 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||
| 162 | N | 46.1 | Very low | 48.4 | Very low | 152 Ų | 152 | 96.3 Ų | 96.3 | 81% | 0.813 | 61% | 0.606 | S | S | * | * | P | Polyproline II helix | trans | -71 | 153 | 177.3 | -65.3 | -18.6 | 0 | 0 | 0 | 111.2 | ||
| 163 | D | 47.4 | Very low | 48.7 | Very low | 113 Ų | 113 | 95.5 Ų | 95.5 | 60% | 0.604 | 60% | 0.598 | S | S | * | * | P | Polyproline II helix | trans | -65.5 | 148.1 | 176 | -61.9 | -27.5 | 0 | 0 | 0 | 111.2 | K239 | D163-K239 VanDerWaalsContact OD1-CD 3.31Å; D163-K239 WeakPolarHBondContact OD1-CD 3.33Å; D163-K239 WeakPolarHBondContact OD1-CE 3.3Å; D163-K239 WeakPolarHBondContact OD1-CG 3.41Å; D163-K239 IonicContact OD1-NZ 3.83Å |
| 164 | G | 47.9 | Very low | 49.4 | Very low | 39 Ų | 39 | 96.5 Ų | 96.5 | 40% | 0.402 | 60% | 0.596 | S | S | . | * | P | Polyproline II helix | trans | -65.9 | 149 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||
| 165 | K | 49.8 | Very low | 49.9 | Very low | 198 Ų | 198 | 93.8 Ų | 93.8 | 86% | 0.861 | 60% | 0.6 | S | S | * | * | P | Polyproline II helix | trans | -66.7 | 147.6 | 176 | -68.2 | -173.9 | 176 | -176.6 | 0 | 110.7 | ||
| 166 | Q | 49.2 | Very low | 50.2 | Low | 135 Ų | 135 | 93.7 Ų | 93.7 | 63% | 0.631 | 60% | 0.599 | S | S | * | * | P | Polyproline II helix | trans | -58.7 | 135.6 | 170.4 | -176.4 | 175.9 | -7.3 | 0 | 0 | 109.6 | ||
| 167 | G | 50.5 | Low | 50.7 | Low | 33 Ų | 33 | 94.1 Ų | 94.1 | 34% | 0.34 | 60% | 0.603 | S | S | . | * | P | Polyproline II helix | trans | -69.8 | 149.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||
| 168 | D | 48.5 | Very low | 51.3 | Low | 157 Ų | 157 | 93.9 Ų | 93.9 | 84% | 0.84 | 60% | 0.602 | S | S | * | * | P | Polyproline II helix | trans | -65.3 | 152.3 | -179.3 | -64.5 | -43 | 0 | 0 | 0 | 112.1 | G170 | D168-G170 PolarHBondContact O-N 3.35Š|
| 169 | R | 50.6 | Low | 51.8 | Low | 164 Ų | 164 | 93.6 Ų | 93.6 | 62% | 0.619 | 60% | 0.599 | S | S | * | * | B | Isolated β-bridge | trans | -64.9 | 131.9 | 176.6 | -178.1 | 168.9 | -174.2 | 166.9 | 3.7 | 110.7 | D233 | R169-D233 WeakPolarHBondContact CB-OD1 3.02Å; R169-D233 VanDerWaalsContact CD-OD1 3.3Å; R169-D233 WeakPolarHBondContact CD-OD1 3.31Å; R169-D233 WeakPolarHBondContact CG-OD1 3.19Å; R169-D233 IonicContact NE-OD1 3.82Å |
| 170 | G | 51.5 | Low | 52.5 | Low | 36 Ų | 36 | 94.1 Ų | 94.1 | 37% | 0.371 | 60% | 0.602 | S | S | . | * | P | Polyproline II helix | trans | -62 | 146 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113 | D168 | D168-G170 PolarHBondContact O-N 3.35Š|
| 171 | A | 51.8 | Low | 53.2 | Low | 93 Ų | 93 | 96.7 Ų | 96.7 | 77% | 0.769 | 60% | 0.603 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 152.9 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||
| 172 | A | 53.4 | Low | 53.7 | Low | 79 Ų | 79 | 96.6 Ų | 96.6 | 65% | 0.653 | 60% | 0.603 | S | S | * | * | B | Isolated β-bridge | trans | -63.5 | 136.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||
| 173 | G | 54.4 | Low | 54.4 | Low | 34 Ų | 34 | 95.1 Ų | 95.1 | 35% | 0.351 | 60% | 0.601 | S | S | . | * | P | Polyproline II helix | trans | -66.9 | 155 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | ||
| 174 | P | 59.3 | Low | 55.2 | Low | 119 Ų | 119 | 95.2 Ų | 95.2 | 77% | 0.773 | 61% | 0.605 | S | S | * | * | P | Polyproline II helix | trans | -63 | 156.3 | -179.4 | 26.6 | -33.9 | 0 | 0 | 0 | 112.2 | ||
| 175 | A | 57.4 | Low | 55.7 | Low | 82 Ų | 82 | 94.9 Ų | 94.9 | 68% | 0.678 | 60% | 0.602 | S | S | * | * | B | Isolated β-bridge | trans | -63 | 140.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||
| 176 | G | 55.4 | Low | 56.4 | Low | 37 Ų | 37 | 90.7 Ų | 90.7 | 38% | 0.381 | 60% | 0.595 | S | S | . | * | P | Polyproline II helix | trans | -67.1 | 146.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | ||
| 177 | C | 56.3 | Low | 57.1 | Low | 114 Ų | 114 | 89.3 Ų | 89.3 | 77% | 0.77 | 60% | 0.598 | S | S | * | * | P | Polyproline II helix | trans | -60.4 | 149.5 | 177.3 | -59.6 | 0 | 0 | 0 | 0 | 111.8 | G179 | C177-G179 PolarHBondContact O-N 3.38Š|
| 178 | P | 59.3 | Low | 57.8 | Low | 109 Ų | 109 | 89.6 Ų | 89.6 | 71% | 0.708 | 60% | 0.601 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 138 | 171.3 | -23.6 | 33.7 | 0 | 0 | 0 | 111.7 | ||
| 179 | G | 57.7 | Low | 58.5 | Low | 34 Ų | 34 | 87.9 Ų | 87.9 | 35% | 0.351 | 60% | 0.598 | S | S | . | * | P | Polyproline II helix | trans | -66.3 | 154.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | C177 | C177-G179 PolarHBondContact O-N 3.38Š|
| 180 | P | 60.8 | Low | 59.2 | Low | 121 Ų | 121 | 84.4 Ų | 84.4 | 79% | 0.786 | 60% | 0.604 | S | S | * | * | P | Polyproline II helix | trans | -62 | 153 | 179.4 | 26.5 | -33.9 | 0 | 0 | 0 | 111.6 | G182 | P180-G182 PolarHBondContact O-N 3.32Š|
| 181 | K | 60.5 | Low | 59.7 | Low | 151 Ų | 151 | 84.8 Ų | 84.8 | 66% | 0.657 | 61% | 0.608 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 133.4 | 175.5 | -172.1 | 176.9 | -179.7 | 177.3 | 0 | 109.8 | ||
| 182 | G | 59.6 | Low | 60.1 | Low | 29 Ų | 29 | 87.3 Ų | 87.3 | 30% | 0.299 | 61% | 0.609 | S | S | . | * | P | Polyproline II helix | trans | -62.1 | 153.8 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | P180 | P180-G182 PolarHBondContact O-N 3.32Š|
| 183 | P | 61.5 | Low | 60.5 | Low | 121 Ų | 121 | 89.1 Ų | 89.1 | 79% | 0.786 | 61% | 0.614 | S | S | * | * | P | Polyproline II helix | trans | -61.7 | 153.8 | 179.7 | 26.1 | -33.6 | 0 | 0 | 0 | 111.6 | G185 | P183-G185 PolarHBondContact O-N 3.37Š|
| 184 | V | 63.5 | Low | 60.6 | Low | 114 Ų | 114 | 89.9 Ų | 89.9 | 69% | 0.691 | 62% | 0.622 | S | S | * | * | P | Polyproline II helix | trans | -62.6 | 131.1 | 173.6 | 179.6 | 0 | 0 | 0 | 0 | 108.5 | ||
| 185 | G | 59.8 | Low | 60.3 | Low | 32 Ų | 32 | 89 Ų | 89 | 33% | 0.33 | 63% | 0.625 | S | S | . | * | P | Polyproline II helix | trans | -61.4 | 153.9 | -179.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | P183 | P183-G185 PolarHBondContact O-N 3.37Š|
| 186 | P | 63.3 | Low | 60.3 | Low | 111 Ų | 111 | 92.7 Ų | 92.7 | 72% | 0.721 | 63% | 0.633 | S | S | * | * | P | Polyproline II helix | trans | -59.9 | 153.1 | 179.6 | 26 | -33.7 | 0 | 0 | 0 | 111.1 | G188 | P186-G188 PolarHBondContact O-N 3.46Š|
| 187 | P | 65 | Low | 60.2 | Low | 105 Ų | 105 | 94 Ų | 94 | 68% | 0.682 | 65% | 0.647 | S | S | * | * | P | Polyproline II helix | trans | -52.7 | 140.8 | 172.3 | -24 | 33.7 | 0 | 0 | 0 | 111.2 | ||
| 188 | G | 64 | Low | 59.7 | Low | 39 Ų | 39 | 96.2 Ų | 96.2 | 40% | 0.402 | 65% | 0.649 | S | S | . | * | P | Polyproline II helix | trans | -59.8 | 155.8 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | P186 | P186-G188 PolarHBondContact O-N 3.46Š|
| 189 | P | 64.6 | Low | 59 | Low | 121 Ų | 121 | 95.1 Ų | 95.1 | 79% | 0.786 | 65% | 0.65 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 151.1 | 177.6 | 25.1 | -32.9 | 0 | 0 | 0 | 111 | ||
| 190 | A | 65 | Low | 58.5 | Low | 91 Ų | 91 | 103.7 Ų | 103.7 | 75% | 0.752 | 67% | 0.673 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 139.6 | 174.5 | 0 | 0 | 0 | 0 | 0 | 109.8 | ||
| 191 | G | 60.8 | Low | 57.9 | Low | 44 Ų | 44 | 108.1 Ų | 108.1 | 45% | 0.454 | 68% | 0.68 | S | S | . | * | P | Polyproline II helix | trans | -62.3 | 145.9 | 178 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||
| 192 | D | 60.3 | Low | 57.4 | Low | 146 Ų | 146 | 103.8 Ų | 103.8 | 78% | 0.781 | 68% | 0.678 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 146.7 | -178.8 | -67.4 | -45 | 0 | 0 | 0 | 111.5 | G194 | D192-G194 PolarHBondContact O-N 3.36Š|
| 193 | P | 61.6 | Low | 56.9 | Low | 117 Ų | 117 | 112.6 Ų | 112.6 | 76% | 0.76 | 71% | 0.708 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 135.6 | 173.7 | -24 | 33.8 | 0 | 0 | 0 | 111.2 | ||
| 194 | G | 58.1 | Low | 56.6 | Low | 51 Ų | 51 | 110 Ų | 110 | 53% | 0.526 | 70% | 0.703 | S | S | . | * | P | Polyproline II helix | trans | -57.7 | 141.2 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | D192 | D192-G194 PolarHBondContact O-N 3.36Š|
| 195 | A | 52.1 | Low | 56 | Low | 101 Ų | 101 | 114.3 Ų | 114.3 | 84% | 0.835 | 71% | 0.712 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 140.8 | -176.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | G197 | A195-G197 PolarHBondContact O-N 3.35Š|
| 196 | D | 57.7 | Low | 55.8 | Low | 158 Ų | 158 | 124.2 Ų | 124.2 | 85% | 0.845 | 74% | 0.74 | S | S | * | * | P | Polyproline II helix | trans | -57.7 | 126.8 | 177.8 | -69.5 | -36.9 | 0 | 0 | 0 | 110.6 | I198 | D196-I198 PolarHBondContact O-N 3.44Š|
| 197 | G | 52.6 | Low | 55.4 | Low | 64 Ų | 64 | 121 Ų | 121 | 66% | 0.66 | 73% | 0.726 | S | S | * | * | P | Polyproline II helix | trans | -64.4 | 128.3 | 179.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | A195 A199 | A195-G197 PolarHBondContact O-N 3.35Å; G197-A199 PolarHBondContact O-N 3.39Å |
| 198 | I | 46.4 | Very low | 54.7 | Low | 161 Ų | 161 | 121.9 Ų | 121.9 | 83% | 0.826 | 73% | 0.732 | S | S | * | * | P | Polyproline II helix | trans | -61.4 | 117.9 | -178.5 | -45.6 | 170.5 | 0 | 0 | 0 | 108.9 | D196 Y200 | D196-I198 PolarHBondContact O-N 3.44Å; I198-Y200 PolarHBondContact O-N 3.44Å |
| 199 | A | 43.7 | Very low | 54.2 | Low | 87 Ų | 87 | 126.1 Ų | 126.1 | 72% | 0.719 | 75% | 0.754 | S | S | * | * | trans | -77 | 105 | -169.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | G197 | G197-A199 PolarHBondContact O-N 3.39Š| ||
| 200 | Y | 47.6 | Very low | 53.7 | Low | 214 Ų | 214 | 122.1 Ų | 122.1 | 84% | 0.839 | 74% | 0.735 | S | S | * | * | S | Bend | trans | -111.5 | 106.9 | 155.2 | -88.6 | -88.5 | 0 | 0 | 0 | 108.6 | I198 | I198-Y200 PolarHBondContact O-N 3.44Š|
| 201 | K | 48.2 | Very low | 53.3 | Low | 214 Ų | 214 | 122.1 Ų | 122.1 | 93% | 0.93 | 74% | 0.735 | S | S | * | * | S | Bend | trans | 40.2 | 77.9 | 168.6 | -68.3 | -173.6 | 179 | -177.5 | 0 | 115.6 | ||
| 202 | G | 49.7 | Very low | 53.3 | Low | 59 Ų | 59 | 129 Ų | 129 | 61% | 0.608 | 75% | 0.753 | S | S | * | * | S | Bend | trans | 143.2 | 131.1 | 167.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | G204 | G202-G204 PolarHBondContact O-N 3.49Š|
| 203 | K | 49.5 | Very low | 53.2 | Low | 215 Ų | 215 | 123.4 Ų | 123.4 | 94% | 0.935 | 73% | 0.73 | S | S | * | * | trans | -43 | 105.7 | -178.5 | -82.7 | 168.3 | 170.3 | 173.2 | 0 | 111.5 | K205 | K203-K205 PolarHBondContact O-N 3.24Š| ||
| 204 | G | 55.1 | Low | 53.1 | Low | 67 Ų | 67 | 123.6 Ų | 123.6 | 69% | 0.691 | 73% | 0.731 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 123.8 | 173.6 | 0 | 0 | 0 | 0 | 0 | 109.7 | G202 | G202-G204 PolarHBondContact O-N 3.49Š|
| 205 | K | 51.2 | Low | 53.3 | Low | 203 Ų | 203 | 125.7 Ų | 125.7 | 88% | 0.883 | 74% | 0.743 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 131.8 | 175 | -67.8 | -176.8 | 179.3 | -178.3 | 0 | 108.6 | K203 G207 | K203-K205 PolarHBondContact O-N 3.24Å; K205-G207 PolarHBondContact O-N 3.47Å |
| 206 | R | 55 | Low | 53.7 | Low | 241 Ų | 241 | 122.4 Ų | 122.4 | 91% | 0.909 | 72% | 0.719 | S | S | * | * | P | Polyproline II helix | trans | -48.6 | 126.5 | 172.7 | -174.4 | 176.3 | 75.6 | -171.4 | 4 | 109.3 | ||
| 207 | G | 54.3 | Low | 53.8 | Low | 42 Ų | 42 | 124.2 Ų | 124.2 | 43% | 0.433 | 72% | 0.72 | S | S | . | * | P | Polyproline II helix | trans | -59.2 | 154.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112 | K205 | K205-G207 PolarHBondContact O-N 3.47Š|
| 208 | P | 51.5 | Low | 54.2 | Low | 124 Ų | 124 | 124.3 Ų | 124.3 | 81% | 0.805 | 71% | 0.714 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 147.6 | 177.8 | 25.6 | -32.9 | 0 | 0 | 0 | 111 | G210 | P208-G210 PolarHBondContact O-N 3.41Š|
| 209 | C | 52.3 | Low | 54.8 | Low | 128 Ų | 128 | 118.1 Ų | 118.1 | 87% | 0.865 | 69% | 0.69 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 136.3 | 176.9 | -165.5 | 0 | 0 | 0 | 0 | 110 | ||
| 210 | G | 54.9 | Low | 55.6 | Low | 37 Ų | 37 | 118.2 Ų | 118.2 | 38% | 0.381 | 69% | 0.691 | S | S | . | * | P | Polyproline II helix | trans | -57.8 | 144.7 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | P208 | P208-G210 PolarHBondContact O-N 3.41Š|
| 211 | A | 56.1 | Low | 56.1 | Low | 92 Ų | 92 | 113.1 Ų | 113.1 | 76% | 0.76 | 69% | 0.686 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 145.7 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | G213 | A211-G213 PolarHBondContact O-N 2.92Š|
| 212 | K | 60.5 | Low | 56.6 | Low | 188 Ų | 188 | 104.5 Ų | 104.5 | 82% | 0.817 | 66% | 0.658 | S | S | * | * | P | Polyproline II helix | trans | -56.6 | 126.4 | 173.9 | -176.5 | 176.7 | 180 | 177.6 | 0 | 109.2 | ||
| 213 | G | 59.6 | Low | 57.1 | Low | 29 Ų | 29 | 110.7 Ų | 110.7 | 30% | 0.299 | 67% | 0.669 | S | S | . | * | P | Polyproline II helix | trans | -58.6 | 153.1 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | A211 | A211-G213 PolarHBondContact O-N 2.92Š|
| 214 | P | 59.9 | Low | 57.7 | Low | 120 Ų | 120 | 105.7 Ų | 105.7 | 78% | 0.779 | 66% | 0.658 | S | S | * | * | P | Polyproline II helix | trans | -61.1 | 154.5 | -179.4 | 25.7 | -33.8 | 0 | 0 | 0 | 111.9 | ||
| 215 | A | 61.6 | Low | 57.8 | Low | 96 Ų | 96 | 104.2 Ų | 104.2 | 79% | 0.793 | 64% | 0.643 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 139.3 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111 | ||
| 216 | G | 59.8 | Low | 58.2 | Low | 31 Ų | 31 | 104.1 Ų | 104.1 | 32% | 0.32 | 64% | 0.642 | S | S | . | * | P | Polyproline II helix | trans | -58.5 | 144.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 217 | K | 61.1 | Low | 58.4 | Low | 197 Ų | 197 | 97.4 Ų | 97.4 | 86% | 0.857 | 63% | 0.632 | S | S | * | * | P | Polyproline II helix | trans | -61.3 | 147.3 | 177.1 | -67.2 | -174.8 | 179.2 | 179.7 | 0 | 110.4 | G219 | K217-G219 PolarHBondContact O-N 3.43Š|
| 218 | A | 60.3 | Low | 58.5 | Low | 65 Ų | 65 | 97.1 Ų | 97.1 | 54% | 0.537 | 63% | 0.629 | S | S | . | * | P | Polyproline II helix | trans | -57.6 | 136 | 174.4 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||
| 219 | G | 59.4 | Low | 58.8 | Low | 31 Ų | 31 | 100.3 Ų | 100.3 | 32% | 0.32 | 63% | 0.631 | S | S | . | * | P | Polyproline II helix | trans | -60.6 | 148 | 176 | 0 | 0 | 0 | 0 | 0 | 112 | K217 | K217-G219 PolarHBondContact O-N 3.43Š|
| 220 | A | 59.6 | Low | 59 | Low | 90 Ų | 90 | 98.1 Ų | 98.1 | 74% | 0.744 | 62% | 0.615 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 150.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 221 | S | 59.2 | Low | 58.9 | Low | 106 Ų | 106 | 97.7 Ų | 97.7 | 74% | 0.741 | 61% | 0.61 | S | S | * | * | P | Polyproline II helix | trans | -58 | 138.3 | 173.8 | -57 | 0 | 0 | 0 | 0 | 110.9 | ||
| 222 | G | 57.5 | Low | 58.6 | Low | 34 Ų | 34 | 98.5 Ų | 98.5 | 35% | 0.351 | 61% | 0.61 | S | S | . | * | P | Polyproline II helix | trans | -59.7 | 146.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||
| 223 | K | 60 | Low | 58.2 | Low | 189 Ų | 189 | 93.8 Ų | 93.8 | 82% | 0.822 | 59% | 0.594 | S | S | * | * | P | Polyproline II helix | trans | -63.7 | 148.3 | 176.3 | -66.2 | -174.4 | 179.4 | -173.9 | 0 | 110.2 | ||
| 224 | P | 61.8 | Low | 57.8 | Low | 110 Ų | 110 | 93.9 Ų | 93.9 | 71% | 0.714 | 60% | 0.596 | S | S | * | * | P | Polyproline II helix | trans | -53.4 | 142.6 | 173.1 | -25.6 | 34.3 | 0 | 0 | 0 | 111.9 | ||
| 225 | G | 58.2 | Low | 57 | Low | 36 Ų | 36 | 94 Ų | 94 | 37% | 0.371 | 60% | 0.597 | S | S | . | * | P | Polyproline II helix | trans | -60.4 | 148.6 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||
| 226 | K | 59.2 | Low | 56.4 | Low | 200 Ų | 200 | 92.9 Ų | 92.9 | 87% | 0.87 | 59% | 0.589 | S | S | * | * | P | Polyproline II helix | trans | -65.2 | 146.8 | 175.9 | -66.2 | -177.3 | 179.1 | -179.6 | 0 | 110.2 | ||
| 227 | S | 60.4 | Low | 55.9 | Low | 100 Ų | 100 | 93 Ų | 93 | 70% | 0.699 | 59% | 0.59 | S | S | * | * | B | Isolated β-bridge | trans | -56.1 | 141.1 | 174.5 | -48.6 | 0 | 0 | 0 | 0 | 111.3 | ||
| 228 | G | 55.9 | Low | 55.1 | Low | 36 Ų | 36 | 89.4 Ų | 89.4 | 37% | 0.371 | 59% | 0.587 | S | S | . | * | P | Polyproline II helix | trans | -59.3 | 146.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 229 | K | 56.7 | Low | 54.6 | Low | 192 Ų | 192 | 92.9 Ų | 92.9 | 84% | 0.835 | 59% | 0.589 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 147.3 | 176.2 | -66.2 | -173 | 179.9 | -171.2 | 0 | 110 | ||
| 230 | P | 57 | Low | 54 | Low | 81 Ų | 81 | 92.9 Ų | 92.9 | 53% | 0.526 | 59% | 0.589 | S | S | . | * | B | Isolated β-bridge | trans | -55.5 | 143.1 | 171.9 | -24.2 | 33.8 | 0 | 0 | 0 | 111.6 | ||
| 231 | G | 53.9 | Low | 53.3 | Low | 28 Ų | 28 | 94 Ų | 94 | 29% | 0.289 | 59% | 0.589 | S | S | . | * | P | Polyproline II helix | trans | -59.7 | 148.8 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||
| 232 | S | 49.4 | Very low | 52.8 | Low | 109 Ų | 109 | 94.4 Ų | 94.4 | 76% | 0.762 | 59% | 0.589 | S | S | * | * | P | Polyproline II helix | trans | -68.5 | 150.3 | 173.4 | 49.1 | 0 | 0 | 0 | 0 | 111.1 | ||
| 233 | D | 52 | Low | 52.3 | Low | 89 Ų | 89 | 94.8 Ų | 94.8 | 48% | 0.476 | 59% | 0.593 | S | S | . | * | B | Isolated β-bridge | trans | -59.7 | 141 | 175.5 | -62.7 | -24.3 | 0 | 0 | 0 | 110.6 | R169 | R169-D233 WeakPolarHBondContact CB-OD1 3.02Å; R169-D233 VanDerWaalsContact CD-OD1 3.3Å; R169-D233 WeakPolarHBondContact CD-OD1 3.31Å; R169-D233 WeakPolarHBondContact CG-OD1 3.19Å; R169-D233 IonicContact NE-OD1 3.82Å |
| 234 | G | 50.8 | Low | 51.5 | Low | 32 Ų | 32 | 93.3 Ų | 93.3 | 33% | 0.33 | 59% | 0.594 | S | S | . | * | P | Polyproline II helix | trans | -65.4 | 140.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||
| 235 | C | 43.3 | Very low | 50.8 | Low | 121 Ų | 121 | 92.8 Ų | 92.8 | 82% | 0.818 | 59% | 0.59 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 144.7 | 174 | -68.6 | 0 | 0 | 0 | 0 | 110.5 | G237 | C235-G237 PolarHBondContact O-N 3.27Š|
| 236 | A | 49.4 | Very low | 50.3 | Low | 74 Ų | 74 | 92.8 Ų | 92.8 | 61% | 0.612 | 59% | 0.59 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 133.6 | 172.1 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||
| 237 | G | 48.4 | Very low | 49.5 | Very low | 33 Ų | 33 | 92.6 Ų | 92.6 | 34% | 0.34 | 59% | 0.589 | S | S | . | * | P | Polyproline II helix | trans | -62.3 | 152.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | C235 | C235-G237 PolarHBondContact O-N 3.27Š|
| 238 | P | 45.4 | Very low | 48.9 | Very low | 122 Ų | 122 | 93 Ų | 93 | 79% | 0.792 | 58% | 0.583 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 147.8 | 179.9 | 25.7 | -33.9 | 0 | 0 | 0 | 111 | G240 | P238-G240 PolarHBondContact O-N 3.21Š|
| 239 | K | 48.2 | Very low | 48.4 | Very low | 137 Ų | 137 | 93.1 Ų | 93.1 | 60% | 0.596 | 59% | 0.585 | S | S | * | * | P | Polyproline II helix | trans | -54.4 | 131.3 | 173.7 | -178 | 166.8 | -171.4 | 162.4 | 0 | 110 | D163 | D163-K239 VanDerWaalsContact OD1-CD 3.31Å; D163-K239 WeakPolarHBondContact OD1-CD 3.33Å; D163-K239 WeakPolarHBondContact OD1-CE 3.3Å; D163-K239 WeakPolarHBondContact OD1-CG 3.41Å; D163-K239 IonicContact OD1-NZ 3.83Å |
| 240 | G | 48.2 | Very low | 47.7 | Very low | 31 Ų | 31 | 92.6 Ų | 92.6 | 32% | 0.32 | 59% | 0.586 | S | S | . | * | P | Polyproline II helix | trans | -59.9 | 151.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | P238 | P238-G240 PolarHBondContact O-N 3.21Š|
| 241 | P | 45.5 | Very low | 47.4 | Very low | 113 Ų | 113 | 92.3 Ų | 92.3 | 73% | 0.734 | 58% | 0.583 | S | S | * | * | P | Polyproline II helix | trans | -60.2 | 154.6 | -179.9 | 25.9 | -34.1 | 0 | 0 | 0 | 111.4 | G243 | P241-G243 PolarHBondContact O-N 3.47Š|
| 242 | P | 46.9 | Very low | 46.9 | Very low | 115 Ų | 115 | 92.4 Ų | 92.4 | 75% | 0.747 | 59% | 0.585 | S | S | * | * | P | Polyproline II helix | trans | -52 | 139.8 | 173.3 | -25.1 | 33.9 | 0 | 0 | 0 | 111.8 | ||
| 243 | G | 47 | Very low | 46.6 | Very low | 42 Ų | 42 | 94.9 Ų | 94.9 | 43% | 0.433 | 59% | 0.589 | S | S | . | * | P | Polyproline II helix | trans | -59.1 | 144.4 | 176 | 0 | 0 | 0 | 0 | 0 | 111.4 | P241 | P241-G243 PolarHBondContact O-N 3.47Š|
| 244 | L | 44.1 | Very low | 46.3 | Very low | 159 Ų | 159 | 97 Ų | 97 | 83% | 0.832 | 60% | 0.596 | S | S | * | * | P | Polyproline II helix | trans | -57.1 | 146.3 | 178.6 | -67.5 | 175.3 | 0 | 0 | 0 | 111.2 | G246 | L244-G246 PolarHBondContact O-N 3.44Š|
| 245 | P | 47.4 | Very low | 46 | Very low | 99 Ų | 99 | 97.4 Ų | 97.4 | 64% | 0.643 | 60% | 0.601 | S | S | * | * | P | Polyproline II helix | trans | -51.7 | 138.1 | 173.4 | -26.3 | 34.3 | 0 | 0 | 0 | 111.7 | ||
| 246 | G | 46.7 | Very low | 45.9 | Very low | 35 Ų | 35 | 101.5 Ų | 101.5 | 36% | 0.361 | 61% | 0.605 | S | S | . | * | P | Polyproline II helix | trans | -57.4 | 140.1 | 173.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | L244 | L244-G246 PolarHBondContact O-N 3.44Š|
| 247 | K | 42.9 | Very low | 45.6 | Very low | 196 Ų | 196 | 101.5 Ų | 101.5 | 85% | 0.852 | 61% | 0.605 | S | S | * | * | P | Polyproline II helix | trans | -60.8 | 145.1 | 175.4 | -57 | -174.1 | 178 | -176.4 | 0 | 109.5 | G249 | K247-G249 PolarHBondContact O-N 3.35Š|
| 248 | D | 47.3 | Very low | 45.3 | Very low | 108 Ų | 108 | 102 Ų | 102 | 58% | 0.578 | 61% | 0.61 | S | S | * | * | P | Polyproline II helix | trans | -55.9 | 139.5 | 176.7 | -62.3 | -25.5 | 0 | 0 | 0 | 109.9 | K154 | K154-D248 WeakPolarHBondContact CD-OD1 3.23Å; K154-D248 WeakPolarHBondContact CE-OD1 3.42Å; K154-D248 WeakPolarHBondContact CG-OD1 3.31Å; K154-D248 IonicContact NZ-OD1 2.92Å; K154-D248 PolarHBondContact NZ-OD1 2.96Å |
| 249 | G | 45.2 | Very low | 45.1 | Very low | 40 Ų | 40 | 104.9 Ų | 104.9 | 41% | 0.412 | 61% | 0.613 | S | S | . | * | P | Polyproline II helix | trans | -62.4 | 143.7 | 178.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | K247 | K247-G249 PolarHBondContact O-N 3.35Š|
| 250 | Q | 43.4 | Very low | 45 | Very low | 181 Ų | 181 | 102.5 Ų | 102.5 | 85% | 0.846 | 61% | 0.611 | S | S | * | * | P | Polyproline II helix | trans | -60.4 | 144.1 | 174.5 | -72.9 | -171.1 | -7.7 | 0 | 0 | 110.3 | G252 | Q250-G252 PolarHBondContact O-N 3.37Š|
| 251 | P | 49.4 | Very low | 44.6 | Very low | 74 Ų | 74 | 102.9 Ų | 102.9 | 48% | 0.481 | 62% | 0.615 | S | S | . | * | P | Polyproline II helix | trans | -52.9 | 138.3 | 174.4 | -25.3 | 34 | 0 | 0 | 0 | 111 | R148 | R148-P251 VanDerWaalsContact NH2-CB 3.3Š|
| 252 | G | 44.9 | Very low | 44.5 | Very low | 31 Ų | 31 | 103.2 Ų | 103.2 | 32% | 0.32 | 62% | 0.617 | S | S | . | * | P | Polyproline II helix | trans | -60.2 | 148.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q250 | Q250-G252 PolarHBondContact O-N 3.37Š|
| 253 | D | 42.9 | Very low | 44.4 | Very low | 160 Ų | 160 | 102.3 Ų | 102.3 | 86% | 0.856 | 61% | 0.611 | S | S | * | * | P | Polyproline II helix | trans | -58.6 | 144.9 | 177.6 | -65.1 | -39.3 | 0 | 0 | 0 | 111 | G255 | D253-G255 PolarHBondContact O-N 3.49Š|
| 254 | Q | 44.8 | Very low | 44.1 | Very low | 134 Ų | 134 | 103.4 Ų | 103.4 | 63% | 0.626 | 62% | 0.622 | S | S | * | * | P | Polyproline II helix | trans | -60.1 | 129.7 | 175.9 | -176.5 | 173.3 | -20.3 | 0 | 0 | 109.8 | ||
| 255 | G | 43.9 | Very low | 43.8 | Very low | 41 Ų | 41 | 102.3 Ų | 102.3 | 42% | 0.423 | 62% | 0.623 | S | S | . | * | P | Polyproline II helix | trans | -57.4 | 142 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | D253 | D253-G255 PolarHBondContact O-N 3.49Š|
| 256 | K | 41.9 | Very low | 43.6 | Very low | 207 Ų | 207 | 104.5 Ų | 104.5 | 90% | 0.9 | 63% | 0.629 | S | S | * | * | P | Polyproline II helix | trans | -61.9 | 145.6 | 177 | -66.9 | -168.4 | 176.4 | -172.3 | 0 | 110.2 | G258 | K256-G258 PolarHBondContact O-N 3.5Š|
| 257 | A | 44.1 | Very low | 43.6 | Very low | 74 Ų | 74 | 106.3 Ų | 106.3 | 61% | 0.612 | 65% | 0.648 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 137.1 | 173.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||
| 258 | G | 40.8 | Very low | 43.1 | Very low | 43 Ų | 43 | 105.5 Ų | 105.5 | 44% | 0.443 | 65% | 0.647 | S | S | . | * | P | Polyproline II helix | trans | -63.4 | 148.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 110.5 | K256 | K256-G258 PolarHBondContact O-N 3.5Š|
| 259 | E | 42.3 | Very low | 42.5 | Very low | 183 Ų | 183 | 110.3 Ų | 110.3 | 86% | 0.855 | 66% | 0.659 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 143.7 | 177.7 | -65.4 | -168.9 | 139 | 0 | 0 | 110.8 | G261 | E259-G261 PolarHBondContact O-N 3.43Š|
| 260 | P | 44.9 | Very low | 41.9 | Very low | 86 Ų | 86 | 113.2 Ų | 113.2 | 56% | 0.558 | 67% | 0.671 | S | S | * | * | P | Polyproline II helix | trans | -53.7 | 137 | 174.5 | -24.9 | 34 | 0 | 0 | 0 | 111.1 | ||
| 261 | G | 41.4 | Very low | 41.8 | Very low | 39 Ų | 39 | 109.3 Ų | 109.3 | 40% | 0.402 | 66% | 0.662 | S | S | . | * | P | Polyproline II helix | trans | -59.9 | 156.1 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | E259 | E259-G261 PolarHBondContact O-N 3.43Š|
| 262 | P | 41.6 | Very low | 41 | Very low | 120 Ų | 120 | 111.2 Ų | 111.2 | 78% | 0.779 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -59 | 149.5 | 177.6 | 25.5 | -33.5 | 0 | 0 | 0 | 110.8 | ||
| 263 | P | 45.5 | Very low | 40.7 | Very low | 96 Ų | 96 | 115.3 Ų | 115.3 | 62% | 0.623 | 70% | 0.697 | S | S | * | * | P | Polyproline II helix | trans | -50.8 | 140.3 | 174 | -25.1 | 34 | 0 | 0 | 0 | 111.6 | ||
| 264 | G | 40.7 | Very low | 40.6 | Very low | 65 Ų | 65 | 119 Ų | 119 | 67% | 0.67 | 70% | 0.699 | S | S | * | * | P | Polyproline II helix | trans | -60.6 | 141.7 | 172.4 | 0 | 0 | 0 | 0 | 0 | 110 | D266 | G264-D266 PolarHBondContact O-N 3.45Š|
| 265 | T | 38.8 | Very low | 40.3 | Very low | 137 Ų | 137 | 121.8 Ų | 121.8 | 84% | 0.84 | 71% | 0.708 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 130 | 177.1 | 51 | 0 | 0 | 0 | 0 | 109.7 | G267 | T265-G267 PolarHBondContact O-N 3.5Š|
| 266 | D | 43.2 | Very low | 40.2 | Very low | 145 Ų | 145 | 127.4 Ų | 127.4 | 78% | 0.775 | 73% | 0.729 | S | S | * | * | P | Polyproline II helix | trans | -47.5 | 122.7 | 176.9 | -58.3 | -38.9 | 0 | 0 | 0 | 110.4 | G264 Q268 | G264-D266 PolarHBondContact O-N 3.45Å; D266-Q268 PolarHBondContact O-N 3.45Å |
| 267 | G | 45.2 | Very low | 40.3 | Very low | 73 Ų | 73 | 127 Ų | 127 | 75% | 0.753 | 73% | 0.727 | S | S | * | * | trans | -62.3 | 109.8 | 170.6 | 0 | 0 | 0 | 0 | 0 | 107.9 | T265 Y269 | T265-G267 PolarHBondContact O-N 3.5Å; G267-Y269 PolarHBondContact O-N 3.41Å | ||
| 268 | Q | 33.9 | Very low | 40.1 | Very low | 179 Ų | 179 | 132.9 Ų | 132.9 | 84% | 0.836 | 74% | 0.739 | S | S | * | * | trans | -57.5 | 106.4 | 176.4 | -78.3 | 175.3 | -1.1 | 0 | 0 | 108.9 | D266 C270 | D266-Q268 PolarHBondContact O-N 3.45Å; Q268-C270 PolarHBondContact O-N 3.48Å | ||
| 269 | Y | 33.8 | Very low | 40.3 | Very low | 209 Ų | 209 | 140.4 Ų | 140.4 | 82% | 0.82 | 76% | 0.76 | S | S | * | * | trans | -66.6 | 102.5 | 168.6 | -157.5 | -95.9 | 0 | 0 | 0 | 107 | G267 P271 | G267-Y269 PolarHBondContact O-N 3.41Å; Y269-P271 WeakPolarHBondContact O-CD 3.2Å | ||
| 270 | C | 33.3 | Very low | 40 | Very low | 100 Ų | 100 | 143.2 Ų | 143.2 | 68% | 0.676 | 78% | 0.779 | S | S | * | * | trans | -94 | 100.5 | 167.5 | -80.3 | 0 | 0 | 0 | 0 | 108.3 | Q268 C272 | Q268-C270 PolarHBondContact O-N 3.48Å; C270-C272 PolarHBondContact O-N 3.27Å | ||
| 271 | P | 41.5 | Very low | 39.8 | Very low | 100 Ų | 100 | 146.1 Ų | 146.1 | 65% | 0.649 | 79% | 0.79 | S | S | * | * | trans | -67.6 | 102.6 | 168 | 27.1 | -30.7 | 0 | 0 | 0 | 108.2 | Y269 P273 | Y269-P271 WeakPolarHBondContact O-CD 3.2Å; P271-P273 WeakPolarHBondContact O-CD 3.43Å | ||
| 272 | C | 32.2 | Very low | 39.7 | Very low | 113 Ų | 113 | 151.7 Ų | 151.7 | 76% | 0.764 | 81% | 0.81 | S | S | * | * | trans | -62 | 121.8 | 169.6 | -80.7 | 0 | 0 | 0 | 0 | 109 | C270 R274 | C270-C272 PolarHBondContact O-N 3.27Å; C272-R274 PolarHBondContact O-N 3.32Å; C272-R274 VanDerWaalsContact O-N 3.16Å | ||
| 273 | P | 39 | Very low | 39.6 | Very low | 118 Ų | 118 | 153.4 Ų | 153.4 | 77% | 0.766 | 81% | 0.812 | S | S | * | * | trans | -67.6 | 117.2 | 176.8 | 25.3 | -30.2 | 0 | 0 | 0 | 108.9 | P271 K275 | P271-P273 WeakPolarHBondContact O-CD 3.43Å; P273-K275 PolarHBondContact O-N 3.39Å | ||
| 274 | R | 39.1 | Very low | 39.3 | Very low | 238 Ų | 238 | 156.8 Ų | 156.8 | 90% | 0.898 | 82% | 0.823 | S | S | * | * | trans | -52.8 | 106.4 | 168.9 | -77 | -178.6 | 155.1 | 165.7 | -5.2 | 108.4 | C272 N276 | C272-R274 PolarHBondContact O-N 3.32Å; C272-R274 VanDerWaalsContact O-N 3.16Å; R274-N276 PolarHBondContact O-N 3.18Å; R274-N276 VanDerWaalsContact O-N 3.1Å | ||
| 275 | K | 38.6 | Very low | 39.2 | Very low | 192 Ų | 192 | 162.6 Ų | 162.6 | 84% | 0.835 | 83% | 0.833 | S | S | * | * | trans | -66.6 | 111.2 | 167.7 | -75.7 | -174.3 | 179.2 | 178.9 | 0 | 107 | P273 F277 | P273-K275 PolarHBondContact O-N 3.39Å; K275-F277 PolarHBondContact O-N 2.93Å | ||
| 276 | N | 41.9 | Very low | 39.2 | Very low | 158 Ų | 158 | 164.3 Ų | 164.3 | 85% | 0.845 | 83% | 0.832 | S | S | * | * | trans | -46.4 | 104.5 | 168.2 | -74.5 | -42.5 | 0 | 0 | 0 | 109.5 | R274 K278 | R274-N276 PolarHBondContact O-N 3.18Å; R274-N276 VanDerWaalsContact O-N 3.1Å; N276-K278 PolarHBondContact O-N 3.23Å | ||
| 277 | F | 44.7 | Very low | 38.9 | Very low | 199 Ų | 199 | 165.6 Ų | 165.6 | 87% | 0.873 | 84% | 0.836 | S | S | * | * | trans | -67.7 | 100 | 163.1 | -95.3 | -94.4 | 0 | 0 | 0 | 106.9 | K275 K279 | K275-F277 PolarHBondContact O-N 2.93Å; F277-K279 PolarHBondContact O-N 3.27Å; F277-K279 VanDerWaalsContact O-N 3.09Å | ||
| 278 | K | 39.7 | Very low | 38.4 | Very low | 198 Ų | 198 | 172.8 Ų | 172.8 | 86% | 0.861 | 84% | 0.843 | S | S | * | * | trans | -54.8 | 111.1 | 156.5 | -98.8 | 179.5 | 170.1 | -177.1 | 0 | 106.5 | N276 L280 | N276-K278 PolarHBondContact O-N 3.23Å; K278-L280 PolarHBondContact O-N 3.35Å | ||
| 279 | K | 45.1 | Very low | 38.8 | Very low | 201 Ų | 201 | 172.3 Ų | 172.3 | 87% | 0.874 | 84% | 0.843 | S | S | * | * | trans | -60.7 | 120.1 | 162.4 | -78.1 | -178.6 | 173.5 | -178 | 0 | 107.1 | F277 | F277-K279 PolarHBondContact O-N 3.27Å; F277-K279 VanDerWaalsContact O-N 3.09Å | ||
| 280 | L | 37 | Very low | 39.3 | Very low | 241 Ų | 241 | 168.9 Ų | 168.9 | 100% | 1.262 | 85% | 0.846 | S | S | * | * | trans | -51.6 | 0 | 149.9 | -79.3 | 121.4 | 0 | 0 | 0 | 109.6 | K278 | K278-L280 PolarHBondContact O-N 3.35Š|
Retrieved 280 of 280 residues in 108 ms
(Link to these results)