| 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 | 39.3 | Very low | 49.5 | Very low | 230 Ų | 230 | 141.7 Ų | 141.7 | 100% | 1.133 | 82% | 0.824 | S | S | * | * | 0 | 110.2 | 0 | 167.8 | 177.8 | 169 | 0 | 0 | 107.5 | |||||
| 2 | V | 46.3 | Very low | 50.6 | Low | 130 Ų | 130 | 150.5 Ų | 150.5 | 79% | 0.788 | 83% | 0.833 | S | S | * | * | trans | 61.5 | 142.4 | 177.8 | -169.5 | 0 | 0 | 0 | 0 | 114.4 | F4 | V2-F4 HydrophobicContact CG1-CD2 4.21Å; V2-F4 HydrophobicContact CG1-CE2 4.24Å | ||
| 3 | G | 49 | Very low | 51 | Low | 61 Ų | 61 | 146.4 Ų | 146.4 | 63% | 0.629 | 81% | 0.808 | S | S | * | * | cis | 158.5 | 170.1 | -7.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 4 | F | 47.2 | Very low | 52.6 | Low | 200 Ų | 200 | 141.2 Ų | 141.2 | 88% | 0.877 | 79% | 0.785 | S | S | * | * | trans | 64.1 | 92.4 | 171.9 | -57.4 | -76.5 | 0 | 0 | 0 | 118.2 | V2 | V2-F4 HydrophobicContact CG1-CD2 4.21Å; V2-F4 HydrophobicContact CG1-CE2 4.24Å | ||
| 5 | G | 50.6 | Low | 54.2 | Low | 75 Ų | 75 | 136.5 Ų | 136.5 | 77% | 0.773 | 77% | 0.765 | S | S | * | * | trans | -74.1 | 127.8 | 151.2 | 0 | 0 | 0 | 0 | 0 | 110.7 | N7 | G5-N7 PolarHBondContact O-N 3.06Š| ||
| 6 | A | 45.7 | Very low | 55.8 | Low | 111 Ų | 111 | 137.9 Ų | 137.9 | 92% | 0.917 | 76% | 0.761 | S | S | * | * | trans | -82.5 | 58.5 | -177.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 7 | N | 48.5 | Very low | 57.6 | Low | 137 Ų | 137 | 134.6 Ų | 134.6 | 73% | 0.733 | 74% | 0.741 | S | S | * | * | trans | -77.6 | 135.5 | 178.2 | -140.6 | -17.4 | 0 | 0 | 0 | 110.4 | G5 | G5-N7 PolarHBondContact O-N 3.06Š| ||
| 8 | R | 54.8 | Low | 59.2 | Low | 221 Ų | 221 | 132 Ų | 132 | 83% | 0.834 | 73% | 0.725 | S | S | * | * | trans | 65.8 | 73.6 | 168 | -48.1 | 170.5 | -169.9 | -91.8 | -0.9 | 117.8 | ||||
| 9 | R | 54 | Low | 60.7 | Low | 257 Ų | 257 | 130.3 Ų | 130.3 | 97% | 0.97 | 71% | 0.714 | S | S | * | * | trans | -100 | 65.3 | 137.6 | -92.3 | -169.7 | 173.2 | -177.3 | -0.2 | 110.1 | G11 | R9-G11 PolarHBondContact O-N 3.45Š| ||
| 10 | G | 52.8 | Low | 62 | Low | 71 Ų | 71 | 126.2 Ų | 126.2 | 73% | 0.732 | 70% | 0.698 | S | S | * | * | trans | -67.7 | 100.9 | 169.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | R12 | G10-R12 PolarHBondContact O-N 2.8Š| ||
| 11 | G | 56.3 | Low | 63.4 | Low | 66 Ų | 66 | 124.1 Ų | 124.1 | 68% | 0.68 | 69% | 0.686 | S | S | * | * | trans | -57 | 122.4 | 173.3 | 0 | 0 | 0 | 0 | 0 | 109.5 | R9 L13 | R9-G11 PolarHBondContact O-N 3.45Å; G11-L13 PolarHBondContact O-N 3.4Å | ||
| 12 | R | 62.8 | Low | 65.7 | Low | 247 Ų | 247 | 119.3 Ų | 119.3 | 93% | 0.932 | 66% | 0.662 | S | S | * | * | trans | -74.5 | 75.5 | -178 | -170.9 | 175.3 | 180 | 171.8 | -1.1 | 109.5 | G10 | G10-R12 PolarHBondContact O-N 2.8Š| ||
| 13 | L | 56.1 | Low | 67.9 | Low | 97 Ų | 97 | 116.9 Ų | 116.9 | 51% | 0.508 | 65% | 0.647 | S | S | . | * | trans | -48.4 | 129.4 | 174.3 | -71.2 | 170.1 | 0 | 0 | 0 | 108.9 | G11 S15 L18 | G11-L13 PolarHBondContact O-N 3.4Å; L13-S15 PolarHBondContact O-N 3.11Å; L13-L18 HydrophobicContact CB-CD2 4.32Å; L13-L18 HydrophobicContact CB-CG 4.25Å; L13-L18 HydrophobicContact CD1-CD2 3.85Å | ||
| 14 | P | 73.3 | Confident | 70 | Confident | 74 Ų | 74 | 118.3 Ų | 118.3 | 48% | 0.481 | 64% | 0.64 | S | S | . | * | trans | -51.2 | 133.9 | 173.8 | -26.7 | 33.2 | 0 | 0 | 0 | 110.3 | F16 I17 L18 | P14-F16 PolarHBondContact O-N 3.32Å; P14-F16 VanDerWaalsContact O-N 3.09Å; P14-I17 HydrophobicContact CB-CD1 4.46Å; P14-I17 HydrophobicContact CB-CG1 4.27Å; P14-I17 HydrophobicContact CG-CD1 4.12Å; P14-I17 HydrophobicContact CG-CG1 4.47Å; P14-I17 WeakPolarHBondContact O-CB 3.44Å; P14-I17 PolarHBondContact O-N 2.84Å; P14-L18 PolarHBondContact O-N 3.24Å | ||
| 15 | S | 76 | Confident | 72.1 | Confident | 70 Ų | 70 | 113.1 Ų | 113.1 | 49% | 0.49 | 62% | 0.62 | S | S | . | * | H | α-helix | trans | -52.6 | -36.7 | -177.1 | 43.4 | 0 | 0 | 0 | 0 | 112.3 | L13 I17 L18 I19 | L13-S15 PolarHBondContact O-N 3.11Å; S15-I17 VanDerWaalsContact C-N 3.31Å; S15-I17 PolarHBondContact O-N 2.98Å; S15-L18 PolarHBondContact O-N 2.86Å; S15-I19 VanDerWaalsContact O-CG1 3.31Å; S15-I19 WeakPolarHBondContact O-CG1 3.23Å; S15-I19 PolarHBondContact O-N 3.44Å |
| 16 | F | 80.9 | Confident | 74.1 | Confident | 159 Ų | 159 | 112.4 Ų | 112.4 | 70% | 0.697 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -60.6 | -32.5 | 175.1 | -55.8 | -69.9 | 0 | 0 | 0 | 114.2 | P14 I19 A20 | P14-F16 PolarHBondContact O-N 3.32Å; P14-F16 VanDerWaalsContact O-N 3.09Å; F16-I19 PolarHBondContact O-N 3.38Å; F16-A20 VanDerWaalsContact O-CB 3.31Å; F16-A20 WeakPolarHBondContact O-CB 3.36Å; F16-A20 PolarHBondContact O-N 2.84Å |
| 17 | I | 86 | Confident | 76.4 | Confident | 83 Ų | 83 | 111.6 Ų | 111.6 | 43% | 0.426 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -72.5 | -38.9 | 176 | -61.7 | -174.4 | 0 | 0 | 0 | 110.4 | P14 S15 A20 L21 | P14-I17 HydrophobicContact CB-CD1 4.46Å; P14-I17 HydrophobicContact CB-CG1 4.27Å; P14-I17 HydrophobicContact CG-CD1 4.12Å; P14-I17 HydrophobicContact CG-CG1 4.47Å; P14-I17 WeakPolarHBondContact O-CB 3.44Å; P14-I17 PolarHBondContact O-N 2.84Å; S15-I17 VanDerWaalsContact C-N 3.31Å; S15-I17 PolarHBondContact O-N 2.98Å; I17-A20 PolarHBondContact O-N 2.88Å; I17-L21 HydrophobicContact CG2-CD1 4.14Å; I17-L21 WeakPolarHBondContact O-CB 3.26Å; I17-L21 WeakPolarHBondContact O-CG 3.24Å; I17-L21 PolarHBondContact O-N 3.1Å |
| 18 | L | 85.3 | Confident | 78.6 | Confident | 87 Ų | 87 | 110.3 Ų | 110.3 | 46% | 0.455 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -64.6 | -41 | 173.6 | -64 | 175.6 | 0 | 0 | 0 | 111.3 | L13 P14 S15 L21 M22 | L13-L18 HydrophobicContact CB-CD2 4.32Å; L13-L18 HydrophobicContact CB-CG 4.25Å; L13-L18 HydrophobicContact CD1-CD2 3.85Å; P14-L18 PolarHBondContact O-N 3.24Å; S15-L18 PolarHBondContact O-N 2.86Å; L18-L21 PolarHBondContact O-N 3.05Å; L18-M22 VanDerWaalsContact O-CG 3.29Å; L18-M22 WeakPolarHBondContact O-CG 3.28Å; L18-M22 PolarHBondContact O-N 2.84Å |
| 19 | I | 87.9 | Confident | 80.4 | Confident | 99 Ų | 99 | 103 Ų | 103 | 51% | 0.508 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -63.8 | -45.8 | 174.9 | -66.6 | 162.4 | 0 | 0 | 0 | 110.9 | S15 F16 L21 M22 V23 | S15-I19 VanDerWaalsContact O-CG1 3.31Å; S15-I19 WeakPolarHBondContact O-CG1 3.23Å; S15-I19 PolarHBondContact O-N 3.44Å; F16-I19 PolarHBondContact O-N 3.38Å; I19-L21 PolarHBondContact O-N 3.4Å; I19-M22 PolarHBondContact O-N 3.41Å; I19-V23 WeakPolarHBondContact O-CG2 3.33Å; I19-V23 PolarHBondContact O-N 3.39Å |
| 20 | A | 88.2 | Confident | 82.4 | Confident | 49 Ų | 49 | 96.5 Ų | 96.5 | 41% | 0.405 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -61.8 | -42.4 | 177 | 0 | 0 | 0 | 0 | 0 | 112.1 | F16 I17 V23 I24 | F16-A20 VanDerWaalsContact O-CB 3.31Å; F16-A20 WeakPolarHBondContact O-CB 3.36Å; F16-A20 PolarHBondContact O-N 2.84Å; I17-A20 PolarHBondContact O-N 2.88Å; A20-V23 PolarHBondContact O-N 3.37Å; A20-I24 VanDerWaalsContact O-CG1 3.3Å; A20-I24 WeakPolarHBondContact O-CG1 3.27Å; A20-I24 PolarHBondContact O-N 3.38Å |
| 21 | L | 90 | Very high | 84.4 | Confident | 82 Ų | 82 | 97.1 Ų | 97.1 | 43% | 0.429 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -61.5 | -42.7 | 173.2 | -77.1 | 168.5 | 0 | 0 | 0 | 111.8 | I17 L18 I19 V23 I24 I25 | I17-L21 HydrophobicContact CG2-CD1 4.14Å; I17-L21 WeakPolarHBondContact O-CB 3.26Å; I17-L21 WeakPolarHBondContact O-CG 3.24Å; I17-L21 PolarHBondContact O-N 3.1Å; L18-L21 PolarHBondContact O-N 3.05Å; I19-L21 PolarHBondContact O-N 3.4Å; L21-V23 VanDerWaalsContact C-N 3.34Å; L21-V23 PolarHBondContact O-N 2.95Å; L21-I24 PolarHBondContact O-N 3.28Å; L21-I25 WeakPolarHBondContact O-CB 3.29Å; L21-I25 WeakPolarHBondContact O-CG1 3.47Å; L21-I25 PolarHBondContact O-N 2.83Å |
| 22 | M | 89.1 | Confident | 86.2 | Confident | 129 Ų | 129 | 102.3 Ų | 102.3 | 64% | 0.635 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -62.5 | -38.4 | 176 | -73.4 | -65.7 | -67.3 | 0 | 0 | 112.5 | L18 I19 I25 A26 | L18-M22 VanDerWaalsContact O-CG 3.29Å; L18-M22 WeakPolarHBondContact O-CG 3.28Å; L18-M22 PolarHBondContact O-N 2.84Å; I19-M22 PolarHBondContact O-N 3.41Å; M22-I25 PolarHBondContact O-N 3.31Å; M22-A26 WeakPolarHBondContact O-CB 3.2Å; M22-A26 PolarHBondContact O-N 3.38Å |
| 23 | V | 92.3 | Very high | 87.7 | Confident | 79 Ų | 79 | 97.5 Ų | 97.5 | 48% | 0.479 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -66.5 | -43.1 | 174.1 | 173.4 | 0 | 0 | 0 | 0 | 111.2 | I19 A20 L21 A26 I27 | I19-V23 WeakPolarHBondContact O-CG2 3.33Å; I19-V23 PolarHBondContact O-N 3.39Å; A20-V23 PolarHBondContact O-N 3.37Å; L21-V23 VanDerWaalsContact C-N 3.34Å; L21-V23 PolarHBondContact O-N 2.95Å; V23-A26 PolarHBondContact O-N 2.88Å; V23-I27 HydrophobicContact CG1-CD1 3.84Å; V23-I27 VanDerWaalsContact O-CG1 3.32Å; V23-I27 WeakPolarHBondContact O-CG1 3.39Å; V23-I27 PolarHBondContact O-N 3.36Å |
| 24 | I | 92.6 | Very high | 89.4 | Confident | 92 Ų | 92 | 94.7 Ų | 94.7 | 47% | 0.472 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -61.7 | -45.3 | 175.5 | -69.3 | 163.5 | 0 | 0 | 0 | 110.7 | A20 L21 A26 I27 L28 | A20-I24 VanDerWaalsContact O-CG1 3.3Å; A20-I24 WeakPolarHBondContact O-CG1 3.27Å; A20-I24 PolarHBondContact O-N 3.38Å; L21-I24 PolarHBondContact O-N 3.28Å; I24-A26 PolarHBondContact O-N 2.79Å; I24-I27 PolarHBondContact O-N 2.85Å; I24-L28 HydrophobicContact CG2-CD1 3.82Å; I24-L28 HydrophobicContact CG2-CG 4.33Å; I24-L28 WeakPolarHBondContact O-CB 3.48Å; I24-L28 VanDerWaalsContact O-CG 3.29Å; I24-L28 WeakPolarHBondContact O-CG 3.32Å; I24-L28 PolarHBondContact O-N 3.23Å |
| 25 | I | 91.7 | Very high | 90.4 | Very high | 90 Ų | 90 | 95.4 Ų | 95.4 | 46% | 0.462 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.3 | -45.8 | 176 | -68.9 | 165.6 | 0 | 0 | 0 | 110.2 | L21 M22 I27 L28 S29 | L21-I25 WeakPolarHBondContact O-CB 3.29Å; L21-I25 WeakPolarHBondContact O-CG1 3.47Å; L21-I25 PolarHBondContact O-N 2.83Å; M22-I25 PolarHBondContact O-N 3.31Å; I25-I27 PolarHBondContact O-N 3.35Å; I25-L28 PolarHBondContact O-N 2.82Å; I25-S29 WeakPolarHBondContact O-CB 3.4Å; I25-S29 PolarHBondContact O-N 2.83Å; I25-S29 PolarHBondContact O-OG 2.85Å |
| 26 | A | 92.8 | Very high | 91.2 | Very high | 60 Ų | 60 | 94.5 Ų | 94.5 | 50% | 0.496 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -60.7 | -43.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | M22 V23 I24 S29 F30 | M22-A26 WeakPolarHBondContact O-CB 3.2Å; M22-A26 PolarHBondContact O-N 3.38Å; V23-A26 PolarHBondContact O-N 2.88Å; I24-A26 PolarHBondContact O-N 2.79Å; A26-S29 PolarHBondContact O-N 2.68Å; A26-F30 WeakPolarHBondContact O-CB 3.44Å; A26-F30 PolarHBondContact O-N 2.96Å |
| 27 | I | 93.9 | Very high | 91.7 | Very high | 95 Ų | 95 | 91.4 Ų | 91.4 | 49% | 0.487 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -65.3 | -42.9 | 176.1 | -68 | 167.4 | 0 | 0 | 0 | 110.8 | V23 I24 I25 F30 N31 | V23-I27 HydrophobicContact CG1-CD1 3.84Å; V23-I27 VanDerWaalsContact O-CG1 3.32Å; V23-I27 WeakPolarHBondContact O-CG1 3.39Å; V23-I27 PolarHBondContact O-N 3.36Å; I24-I27 PolarHBondContact O-N 2.85Å; I25-I27 PolarHBondContact O-N 3.35Å; I27-F30 PolarHBondContact O-N 3.27Å; I27-N31 WeakPolarHBondContact CG2-ND2 3.21Å; I27-N31 WeakPolarHBondContact O-CB 3.28Å; I27-N31 PolarHBondContact O-N 3.47Å; I27-N31 PolarHBondContact O-ND2 2.85Å |
| 28 | L | 93.8 | Very high | 92 | Very high | 110 Ų | 110 | 94.3 Ų | 94.3 | 58% | 0.576 | 49% | 0.493 | S | S | * | . | H | α-helix | trans | -64.5 | -41.5 | 175.7 | -72.9 | 172.1 | 0 | 0 | 0 | 111.8 | I24 I25 N31 Y32 | I24-L28 HydrophobicContact CG2-CD1 3.82Å; I24-L28 HydrophobicContact CG2-CG 4.33Å; I24-L28 WeakPolarHBondContact O-CB 3.48Å; I24-L28 VanDerWaalsContact O-CG 3.29Å; I24-L28 WeakPolarHBondContact O-CG 3.32Å; I24-L28 PolarHBondContact O-N 3.23Å; I25-L28 PolarHBondContact O-N 2.82Å; L28-N31 PolarHBondContact O-N 3.38Å; L28-Y32 VanDerWaalsContact O-CB 3.26Å; L28-Y32 WeakPolarHBondContact O-CB 3.08Å; L28-Y32 PolarHBondContact O-N 2.92Å |
| 29 | S | 93.4 | Very high | 92.4 | Very high | 67 Ų | 67 | 94.9 Ų | 94.9 | 47% | 0.469 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.2 | -39.9 | 175.4 | -63.5 | 0 | 0 | 0 | 0 | 112 | I25 A26 W33 | I25-S29 WeakPolarHBondContact O-CB 3.4Å; I25-S29 PolarHBondContact O-N 2.83Å; I25-S29 PolarHBondContact O-OG 2.85Å; A26-S29 PolarHBondContact O-N 2.68Å; S29-W33 WeakPolarHBondContact O-CB 3.48Å; S29-W33 PolarHBondContact O-N 3.3Å |
| 30 | F | 94.6 | Very high | 92.6 | Very high | 120 Ų | 120 | 92 Ų | 92 | 53% | 0.526 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -68.7 | -41.1 | 176 | -177 | -96.7 | 0 | 0 | 0 | 112.5 | A26 I27 W33 T34 | A26-F30 WeakPolarHBondContact O-CB 3.44Å; A26-F30 PolarHBondContact O-N 2.96Å; I27-F30 PolarHBondContact O-N 3.27Å; F30-W33 HydrophobicContact CD2-CE3 4.11Å; F30-W33 HydrophobicContact CD2-CZ3 4.42Å; F30-W33 HydrophobicContact CE2-CE3 4.13Å; F30-W33 HydrophobicContact CE2-CZ3 4.05Å; F30-W33 PolarHBondContact O-N 2.89Å; F30-T34 HydrophobicContact CD1-CG2 4.32Å; F30-T34 HydrophobicContact CE1-CG2 3.89Å; F30-T34 HydrophobicContact CE2-CG2 4.17Å; F30-T34 HydrophobicContact CZ-CG2 3.81Å; F30-T34 WeakPolarHBondContact O-CB 3.48Å; F30-T34 WeakPolarHBondContact O-CG2 3.46Å; F30-T34 PolarHBondContact O-N 3.21Å; F30-T34 PolarHBondContact O-OG1 3.36Å |
| 31 | N | 94.8 | Very high | 92.7 | Very high | 84 Ų | 84 | 97.9 Ų | 97.9 | 45% | 0.449 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -65.4 | -44.1 | 173.5 | -79.2 | -75.7 | 0 | 0 | 0 | 111.4 | I27 L28 W33 T34 V35 | I27-N31 WeakPolarHBondContact CG2-ND2 3.21Å; I27-N31 WeakPolarHBondContact O-CB 3.28Å; I27-N31 PolarHBondContact O-N 3.47Å; I27-N31 PolarHBondContact O-ND2 2.85Å; L28-N31 PolarHBondContact O-N 3.38Å; N31-W33 PolarHBondContact O-N 2.89Å; N31-T34 PolarHBondContact O-N 3.07Å; N31-T34 PolarHBondContact O-OG1 3.06Å; N31-V35 WeakPolarHBondContact O-CB 3.4Å; N31-V35 VanDerWaalsContact O-CG2 3.28Å; N31-V35 WeakPolarHBondContact O-CG2 3.47Å; N31-V35 PolarHBondContact O-N 2.83Å |
| 32 | Y | 94.6 | Very high | 92.9 | Very high | 175 Ų | 175 | 98.4 Ų | 98.4 | 69% | 0.686 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -60.7 | -43.9 | 174.2 | -178.5 | -98.3 | 0 | 0 | 0 | 111.7 | L28 V35 S36 | L28-Y32 VanDerWaalsContact O-CB 3.26Å; L28-Y32 WeakPolarHBondContact O-CB 3.08Å; L28-Y32 PolarHBondContact O-N 2.92Å; Y32-V35 PolarHBondContact O-N 2.9Å; Y32-S36 WeakPolarHBondContact O-CB 3.29Å; Y32-S36 PolarHBondContact O-N 3.44Å |
| 33 | W | 94.1 | Very high | 93 | Very high | 146 Ų | 146 | 96.8 Ų | 96.8 | 55% | 0.553 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -64.7 | -44.4 | 178 | 179.4 | 60.6 | 0 | 0 | 0 | 112.5 | S29 F30 N31 S36 N37 | S29-W33 WeakPolarHBondContact O-CB 3.48Å; S29-W33 PolarHBondContact O-N 3.3Å; F30-W33 HydrophobicContact CD2-CE3 4.11Å; F30-W33 HydrophobicContact CD2-CZ3 4.42Å; F30-W33 HydrophobicContact CE2-CE3 4.13Å; F30-W33 HydrophobicContact CE2-CZ3 4.05Å; F30-W33 PolarHBondContact O-N 2.89Å; N31-W33 PolarHBondContact O-N 2.89Å; W33-S36 PolarHBondContact O-N 2.9Å; W33-N37 WeakPolarHBondContact O-CB 3.42Å; W33-N37 PolarHBondContact O-N 2.88Å |
| 34 | T | 92.4 | Very high | 93.1 | Very high | 38 Ų | 38 | 98.7 Ų | 98.7 | 23% | 0.233 | 50% | 0.503 | C | S | . | . | H | α-helix | trans | -70.8 | -31 | 178.4 | 51.6 | 0 | 0 | 0 | 0 | 113.3 | F30 N31 K38 | F30-T34 HydrophobicContact CD1-CG2 4.32Å; F30-T34 HydrophobicContact CE1-CG2 3.89Å; F30-T34 HydrophobicContact CE2-CG2 4.17Å; F30-T34 HydrophobicContact CZ-CG2 3.81Å; F30-T34 WeakPolarHBondContact O-CB 3.48Å; F30-T34 WeakPolarHBondContact O-CG2 3.46Å; F30-T34 PolarHBondContact O-N 3.21Å; F30-T34 PolarHBondContact O-OG1 3.36Å; N31-T34 PolarHBondContact O-N 3.07Å; N31-T34 PolarHBondContact O-OG1 3.06Å; T34-K38 WeakPolarHBondContact O-CG 3.18Å; T34-K38 PolarHBondContact O-N 2.88Å |
| 35 | V | 94.6 | Very high | 93.2 | Very high | 89 Ų | 89 | 97.7 Ų | 97.7 | 54% | 0.539 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -71.9 | -43.2 | 169 | 171.1 | 0 | 0 | 0 | 0 | 111 | N31 Y32 N37 K38 Q39 | N31-V35 WeakPolarHBondContact O-CB 3.4Å; N31-V35 VanDerWaalsContact O-CG2 3.28Å; N31-V35 WeakPolarHBondContact O-CG2 3.47Å; N31-V35 PolarHBondContact O-N 2.83Å; Y32-V35 PolarHBondContact O-N 2.9Å; V35-N37 PolarHBondContact O-N 3.46Å; V35-K38 WeakPolarHBondContact O-CB 3.32Å; V35-K38 PolarHBondContact O-N 3.31Å; V35-K38 VanDerWaalsContact O-N 3.17Å; V35-Q39 WeakPolarHBondContact O-CB 3.18Å; V35-Q39 PolarHBondContact O-N 3.43Å |
| 36 | S | 92.1 | Very high | 93.3 | Very high | 52 Ų | 52 | 98.6 Ų | 98.6 | 36% | 0.364 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -65.2 | -37.4 | 179.4 | -170.2 | 0 | 0 | 0 | 0 | 112.4 | Y32 W33 Q39 G40 | Y32-S36 WeakPolarHBondContact O-CB 3.29Å; Y32-S36 PolarHBondContact O-N 3.44Å; W33-S36 PolarHBondContact O-N 2.9Å; S36-Q39 PolarHBondContact O-N 3.18Å; S36-G40 PolarHBondContact O-N 3.45Å |
| 37 | N | 91 | Very high | 93.2 | Very high | 93 Ų | 93 | 97.9 Ų | 97.9 | 50% | 0.497 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.4 | -40.7 | 172.2 | -90.9 | 0.4 | 0 | 0 | 0 | 111.8 | W33 V35 G40 R41 | W33-N37 WeakPolarHBondContact O-CB 3.42Å; W33-N37 PolarHBondContact O-N 2.88Å; V35-N37 PolarHBondContact O-N 3.46Å; N37-G40 PolarHBondContact O-N 3.39Å; N37-R41 PolarHBondContact O-N 3.15Å |
| 38 | K | 93.5 | Very high | 93.3 | Very high | 144 Ų | 144 | 98.7 Ų | 98.7 | 63% | 0.626 | 50% | 0.497 | S | S | * | . | H | α-helix | trans | -65.9 | -44.1 | 175 | -70.5 | 170 | -176.2 | 178.8 | 0 | 111.3 | T34 V35 G40 R41 L42 | T34-K38 WeakPolarHBondContact O-CG 3.18Å; T34-K38 PolarHBondContact O-N 2.88Å; V35-K38 WeakPolarHBondContact O-CB 3.32Å; V35-K38 PolarHBondContact O-N 3.31Å; V35-K38 VanDerWaalsContact O-N 3.17Å; K38-G40 VanDerWaalsContact C-N 3.33Å; K38-G40 PolarHBondContact O-N 3.41Å; K38-R41 PolarHBondContact O-N 3.29Å; K38-L42 WeakPolarHBondContact O-CB 3.39Å; K38-L42 WeakPolarHBondContact O-CG 3.44Å; K38-L42 PolarHBondContact O-N 3Å |
| 39 | Q | 92.8 | Very high | 93.3 | Very high | 100 Ų | 100 | 97.3 Ų | 97.3 | 47% | 0.467 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -63.1 | -39.3 | 176.4 | -170.9 | 63.3 | 23.4 | 0 | 0 | 111.7 | V35 S36 L42 L43 | V35-Q39 WeakPolarHBondContact O-CB 3.18Å; V35-Q39 PolarHBondContact O-N 3.43Å; S36-Q39 PolarHBondContact O-N 3.18Å; Q39-L42 PolarHBondContact O-N 2.91Å; Q39-L43 HydrophobicContact CG-CD1 4.21Å; Q39-L43 WeakPolarHBondContact O-CB 3.49Å; Q39-L43 VanDerWaalsContact O-CG 3.25Å; Q39-L43 WeakPolarHBondContact O-CG 3.07Å; Q39-L43 PolarHBondContact O-N 3.49Å |
| 40 | G | 91.5 | Very high | 93.3 | Very high | 38 Ų | 38 | 99 Ų | 99 | 39% | 0.392 | 49% | 0.494 | S | S | . | . | H | α-helix | trans | -59.2 | -48.6 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | S36 N37 K38 L42 L43 D44 | S36-G40 PolarHBondContact O-N 3.45Å; N37-G40 PolarHBondContact O-N 3.39Å; K38-G40 VanDerWaalsContact C-N 3.33Å; K38-G40 PolarHBondContact O-N 3.41Å; G40-L42 PolarHBondContact O-N 2.93Å; G40-L43 PolarHBondContact O-N 2.84Å; G40-D44 PolarHBondContact O-N 2.95Å |
| 41 | R | 92.2 | Very high | 93.1 | Very high | 173 Ų | 173 | 95.9 Ų | 95.9 | 65% | 0.653 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -63.1 | -40.1 | 177 | -152.2 | -171.8 | 96.2 | 161 | 10.2 | 112.6 | N37 K38 L43 D44 E45 | N37-R41 PolarHBondContact O-N 3.15Å; K38-R41 PolarHBondContact O-N 3.29Å; R41-L43 VanDerWaalsContact C-N 3.35Å; R41-D44 PolarHBondContact O-N 2.86Å; R41-E45 IonicContact CZ-OE1 3.07Å; R41-E45 IonicContact NE-OE1 2.69Å; R41-E45 PolarHBondContact NE-OE1 3.41Å; R41-E45 IonicContact NH2-OE1 2.67Å; R41-E45 PolarHBondContact NH2-OE1 2.83Å; R41-E45 WeakPolarHBondContact O-CB 3.23Å; R41-E45 WeakPolarHBondContact O-CG 3.47Å; R41-E45 PolarHBondContact O-N 3.19Å |
| 42 | L | 93 | Very high | 93 | Very high | 92 Ų | 92 | 96.2 Ų | 96.2 | 48% | 0.482 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -67.6 | -32.7 | 176.8 | -72 | 168.8 | 0 | 0 | 0 | 112.7 | K38 Q39 G40 L46 | K38-L42 WeakPolarHBondContact O-CB 3.39Å; K38-L42 WeakPolarHBondContact O-CG 3.44Å; K38-L42 PolarHBondContact O-N 3Å; Q39-L42 PolarHBondContact O-N 2.91Å; G40-L42 PolarHBondContact O-N 2.93Å; L42-L46 VanDerWaalsContact O-CB 3.24Å; L42-L46 WeakPolarHBondContact O-CB 3.32Å; L42-L46 PolarHBondContact O-N 2.95Å |
| 43 | L | 92.4 | Very high | 93.1 | Very high | 96 Ų | 96 | 91 Ų | 91 | 50% | 0.503 | 47% | 0.47 | S | S | . | . | H | α-helix | trans | -71.5 | -36.3 | 173.2 | -74 | 168.8 | 0 | 0 | 0 | 111.9 | Q39 G40 R41 L46 A47 | Q39-L43 HydrophobicContact CG-CD1 4.21Å; Q39-L43 WeakPolarHBondContact O-CB 3.49Å; Q39-L43 VanDerWaalsContact O-CG 3.25Å; Q39-L43 WeakPolarHBondContact O-CG 3.07Å; Q39-L43 PolarHBondContact O-N 3.49Å; G40-L43 PolarHBondContact O-N 2.84Å; R41-L43 VanDerWaalsContact C-N 3.35Å; L43-L46 PolarHBondContact O-N 3.25Å; L43-A47 WeakPolarHBondContact O-CB 3.49Å; L43-A47 PolarHBondContact O-N 3.4Å |
| 44 | D | 93 | Very high | 93.1 | Very high | 119 Ų | 119 | 89.8 Ų | 89.8 | 64% | 0.636 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -69.3 | -45.4 | 175.6 | -157.9 | 37.4 | 0 | 0 | 0 | 111.3 | G40 R41 L46 A47 E48 | G40-D44 PolarHBondContact O-N 2.95Å; R41-D44 PolarHBondContact O-N 2.86Å; D44-L46 VanDerWaalsContact C-N 3.33Å; D44-L46 PolarHBondContact O-N 3.49Å; D44-A47 PolarHBondContact O-N 2.9Å; D44-E48 PolarHBondContact O-N 3.2Å |
| 45 | E | 94.8 | Very high | 93.1 | Very high | 70 Ų | 70 | 96.5 Ų | 96.5 | 33% | 0.327 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -57.2 | -43.4 | 170.5 | -75.8 | 170.4 | -159.7 | 0 | 0 | 112 | R41 E48 V49 | R41-E45 IonicContact CZ-OE1 3.07Å; R41-E45 IonicContact NE-OE1 2.69Å; R41-E45 PolarHBondContact NE-OE1 3.41Å; R41-E45 IonicContact NH2-OE1 2.67Å; R41-E45 PolarHBondContact NH2-OE1 2.83Å; R41-E45 WeakPolarHBondContact O-CB 3.23Å; R41-E45 WeakPolarHBondContact O-CG 3.47Å; R41-E45 PolarHBondContact O-N 3.19Å; E45-E48 PolarHBondContact O-N 2.8Å; E45-V49 WeakPolarHBondContact O-CB 3.36Å; E45-V49 VanDerWaalsContact O-CG2 3.3Å; E45-V49 WeakPolarHBondContact O-CG2 3.38Å; E45-V49 PolarHBondContact O-N 3.31Å |
| 46 | L | 93.1 | Very high | 93.1 | Very high | 110 Ų | 110 | 96.1 Ų | 96.1 | 58% | 0.576 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -66.5 | -39 | 176.8 | -173.6 | 152.2 | 0 | 0 | 0 | 111.7 | L42 L43 D44 Q50 | L42-L46 VanDerWaalsContact O-CB 3.24Å; L42-L46 WeakPolarHBondContact O-CB 3.32Å; L42-L46 PolarHBondContact O-N 2.95Å; L43-L46 PolarHBondContact O-N 3.25Å; D44-L46 VanDerWaalsContact C-N 3.33Å; D44-L46 PolarHBondContact O-N 3.49Å; L46-Q50 WeakPolarHBondContact O-CB 3.4Å; L46-Q50 PolarHBondContact O-N 2.86Å |
| 47 | A | 92.6 | Very high | 93.2 | Very high | 45 Ų | 45 | 97.7 Ų | 97.7 | 37% | 0.372 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -64.8 | -44.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | L43 D44 Q50 T51 | L43-A47 WeakPolarHBondContact O-CB 3.49Å; L43-A47 PolarHBondContact O-N 3.4Å; D44-A47 PolarHBondContact O-N 2.9Å; A47-Q50 PolarHBondContact O-N 2.89Å; A47-T51 WeakPolarHBondContact O-CG2 3.48Å; A47-T51 PolarHBondContact O-N 3.08Å |
| 48 | E | 94.2 | Very high | 93.3 | Very high | 111 Ų | 111 | 95.8 Ų | 95.8 | 52% | 0.519 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -59.8 | -53.4 | 176.1 | -160.4 | -159.8 | 150.1 | 0 | 0 | 110.6 | D44 E45 Q50 T51 Q52 | D44-E48 PolarHBondContact O-N 3.2Å; E45-E48 PolarHBondContact O-N 2.8Å; E48-Q50 VanDerWaalsContact C-N 3.26Å; E48-Q50 PolarHBondContact O-N 3.05Å; E48-T51 CarbonylContact O-C 3.57Å; E48-T51 WeakPolarHBondContact O-CA 3.29Å; E48-T51 PolarHBondContact O-N 2.86Å; E48-T51 PolarHBondContact O-OG1 3.28Å; E48-Q52 WeakPolarHBondContact O-CG 3.39Å; E48-Q52 PolarHBondContact O-N 3.48Å; E48-Q52 PolarHBondContact OE1-NE2 2.85Å |
| 49 | V | 94.4 | Very high | 93.3 | Very high | 81 Ų | 81 | 91.7 Ų | 91.7 | 49% | 0.491 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -56 | -40.4 | 176.8 | 170 | 0 | 0 | 0 | 0 | 111.2 | E45 T51 Q52 V53 | E45-V49 WeakPolarHBondContact O-CB 3.36Å; E45-V49 VanDerWaalsContact O-CG2 3.3Å; E45-V49 WeakPolarHBondContact O-CG2 3.38Å; E45-V49 PolarHBondContact O-N 3.31Å; V49-T51 VanDerWaalsContact C-N 3.33Å; V49-T51 PolarHBondContact O-N 2.88Å; V49-Q52 PolarHBondContact O-N 3.27Å; V49-V53 HydrophobicContact CG1-CG2 4.36Å; V49-V53 WeakPolarHBondContact O-CB 3.18Å; V49-V53 WeakPolarHBondContact O-CG2 3.25Å; V49-V53 PolarHBondContact O-N 2.92Å |
| 50 | Q | 93.4 | Very high | 93.5 | Very high | 102 Ų | 102 | 94.9 Ų | 94.9 | 48% | 0.477 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -64.2 | -34.9 | 175.5 | -158.3 | -162.7 | 48.9 | 0 | 0 | 112.6 | L46 A47 E48 K54 | L46-Q50 WeakPolarHBondContact O-CB 3.4Å; L46-Q50 PolarHBondContact O-N 2.86Å; A47-Q50 PolarHBondContact O-N 2.89Å; E48-Q50 VanDerWaalsContact C-N 3.26Å; E48-Q50 PolarHBondContact O-N 3.05Å; Q50-K54 VanDerWaalsContact CD-NZ 3.34Å; Q50-K54 WeakPolarHBondContact O-CD 3.43Å; Q50-K54 VanDerWaalsContact O-CG 3.26Å; Q50-K54 WeakPolarHBondContact O-CG 3.46Å; Q50-K54 PolarHBondContact O-N 3.19Å; Q50-K54 VanDerWaalsContact O-N 3.14Å |
| 51 | T | 91.6 | Very high | 93.7 | Very high | 55 Ų | 55 | 96.7 Ų | 96.7 | 34% | 0.337 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -73.5 | -35.1 | 172.6 | 68.8 | 0 | 0 | 0 | 0 | 112.8 | A47 E48 V49 K54 R55 | A47-T51 WeakPolarHBondContact O-CG2 3.48Å; A47-T51 PolarHBondContact O-N 3.08Å; E48-T51 CarbonylContact O-C 3.57Å; E48-T51 WeakPolarHBondContact O-CA 3.29Å; E48-T51 PolarHBondContact O-N 2.86Å; E48-T51 PolarHBondContact O-OG1 3.28Å; V49-T51 VanDerWaalsContact C-N 3.33Å; V49-T51 PolarHBondContact O-N 2.88Å; T51-K54 PolarHBondContact O-N 3.2Å; T51-R55 VanDerWaalsContact O-CG 3.28Å; T51-R55 WeakPolarHBondContact O-CG 3.48Å; T51-R55 PolarHBondContact O-N 3.06Å |
| 52 | Q | 92.9 | Very high | 93.8 | Very high | 91 Ų | 91 | 97.4 Ų | 97.4 | 43% | 0.425 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -62.7 | -48.6 | 173.6 | -66.4 | -172 | 14.2 | 0 | 0 | 110.4 | E48 V49 K54 R55 T56 | E48-Q52 WeakPolarHBondContact O-CG 3.39Å; E48-Q52 PolarHBondContact O-N 3.48Å; E48-Q52 PolarHBondContact OE1-NE2 2.85Å; V49-Q52 PolarHBondContact O-N 3.27Å; Q52-K54 PolarHBondContact O-N 3.08Å; Q52-R55 WeakPolarHBondContact O-CB 3.25Å; Q52-R55 PolarHBondContact O-N 3.09Å; Q52-R55 VanDerWaalsContact O-N 3.08Å; Q52-T56 PolarHBondContact O-N 3.24Å; Q52-T56 PolarHBondContact O-OG1 2.82Å |
| 53 | V | 95.3 | Very high | 94 | Very high | 67 Ų | 67 | 98.6 Ų | 98.6 | 41% | 0.406 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -56.1 | -49.1 | 175.6 | 169.6 | 0 | 0 | 0 | 0 | 111.4 | V49 R55 T56 D57 | V49-V53 HydrophobicContact CG1-CG2 4.36Å; V49-V53 WeakPolarHBondContact O-CB 3.18Å; V49-V53 WeakPolarHBondContact O-CG2 3.25Å; V49-V53 PolarHBondContact O-N 2.92Å; V53-R55 VanDerWaalsContact C-N 3.27Å; V53-R55 PolarHBondContact O-N 3.26Å; V53-T56 WeakPolarHBondContact CA-OG1 3.34Å; V53-T56 PolarHBondContact O-N 3.07Å; V53-T56 VanDerWaalsContact O-N 3.14Å; V53-T56 PolarHBondContact O-OG1 3.49Å; V53-D57 WeakPolarHBondContact CG1-OD2 3.31Å; V53-D57 WeakPolarHBondContact O-CB 3.47Å; V53-D57 VanDerWaalsContact O-CG 3.24Å; V53-D57 PolarHBondContact O-N 2.9Å |
| 54 | K | 94.7 | Very high | 94.2 | Very high | 119 Ų | 119 | 99.4 Ų | 99.4 | 52% | 0.517 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -58.9 | -35.5 | 176.5 | -73.3 | 165.6 | -178.8 | 167.1 | 0 | 113 | Q50 T51 Q52 A58 | Q50-K54 VanDerWaalsContact CD-NZ 3.34Å; Q50-K54 WeakPolarHBondContact O-CD 3.43Å; Q50-K54 VanDerWaalsContact O-CG 3.26Å; Q50-K54 WeakPolarHBondContact O-CG 3.46Å; Q50-K54 PolarHBondContact O-N 3.19Å; Q50-K54 VanDerWaalsContact O-N 3.14Å; T51-K54 PolarHBondContact O-N 3.2Å; Q52-K54 PolarHBondContact O-N 3.08Å; K54-A58 WeakPolarHBondContact O-CB 3.41Å; K54-A58 PolarHBondContact O-N 3.19Å |
| 55 | R | 93.2 | Very high | 94.4 | Very high | 179 Ų | 179 | 99.8 Ų | 99.8 | 68% | 0.675 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -71.2 | -42.7 | 175 | -70.9 | 167.1 | -179.4 | 163.3 | 2.1 | 111.7 | T51 Q52 V53 A58 A59 | T51-R55 VanDerWaalsContact O-CG 3.28Å; T51-R55 WeakPolarHBondContact O-CG 3.48Å; T51-R55 PolarHBondContact O-N 3.06Å; Q52-R55 WeakPolarHBondContact O-CB 3.25Å; Q52-R55 PolarHBondContact O-N 3.09Å; Q52-R55 VanDerWaalsContact O-N 3.08Å; V53-R55 VanDerWaalsContact C-N 3.27Å; V53-R55 PolarHBondContact O-N 3.26Å; R55-A58 PolarHBondContact O-N 3.01Å; R55-A59 PolarHBondContact O-N 2.99Å; R55-A59 VanDerWaalsContact O-N 3.08Å |
| 56 | T | 93.7 | Very high | 94.4 | Very high | 82 Ų | 82 | 104.8 Ų | 104.8 | 50% | 0.503 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -68.7 | -35.9 | 177.5 | 52.1 | 0 | 0 | 0 | 0 | 112.4 | Q52 V53 A59 R60 | Q52-T56 PolarHBondContact O-N 3.24Å; Q52-T56 PolarHBondContact O-OG1 2.82Å; V53-T56 WeakPolarHBondContact CA-OG1 3.34Å; V53-T56 PolarHBondContact O-N 3.07Å; V53-T56 VanDerWaalsContact O-N 3.14Å; V53-T56 PolarHBondContact O-OG1 3.49Å; T56-A59 PolarHBondContact O-N 2.76Å; T56-R60 VanDerWaalsContact O-CB 3.29Å; T56-R60 WeakPolarHBondContact O-CB 3.44Å; T56-R60 PolarHBondContact O-N 3.29Å |
| 57 | D | 94.1 | Very high | 94.6 | Very high | 84 Ų | 84 | 104.4 Ų | 104.4 | 45% | 0.449 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -68.2 | -40.1 | 176.6 | -69.2 | -22.1 | 0 | 0 | 0 | 111.5 | V53 A59 R60 S61 | V53-D57 WeakPolarHBondContact CG1-OD2 3.31Å; V53-D57 WeakPolarHBondContact O-CB 3.47Å; V53-D57 VanDerWaalsContact O-CG 3.24Å; V53-D57 PolarHBondContact O-N 2.9Å; D57-A59 VanDerWaalsContact C-N 3.33Å; D57-A59 PolarHBondContact O-N 3.49Å; D57-R60 PolarHBondContact O-N 2.84Å; D57-S61 WeakPolarHBondContact O-CB 3.39Å; D57-S61 PolarHBondContact O-N 2.94Å |
| 58 | A | 93.6 | Very high | 94.9 | Very high | 53 Ų | 53 | 105.3 Ų | 105.3 | 44% | 0.438 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.8 | -37.2 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | K54 R55 R62 | K54-A58 WeakPolarHBondContact O-CB 3.41Å; K54-A58 PolarHBondContact O-N 3.19Å; R55-A58 PolarHBondContact O-N 3.01Å; A58-R62 VanDerWaalsContact O-CG 3.31Å; A58-R62 WeakPolarHBondContact O-CG 3.5Å; A58-R62 PolarHBondContact O-N 3.28Å |
| 59 | A | 93.9 | Very high | 95 | Very high | 59 Ų | 59 | 103.8 Ų | 103.8 | 49% | 0.488 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -69 | -43.2 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112 | R55 T56 D57 R62 L63 | R55-A59 PolarHBondContact O-N 2.99Å; R55-A59 VanDerWaalsContact O-N 3.08Å; T56-A59 PolarHBondContact O-N 2.76Å; D57-A59 VanDerWaalsContact C-N 3.33Å; D57-A59 PolarHBondContact O-N 3.49Å; A59-R62 PolarHBondContact O-N 2.82Å; A59-L63 PolarHBondContact O-N 2.77Å |
| 60 | R | 95.6 | Very high | 95.2 | Very high | 167 Ų | 167 | 104.5 Ų | 104.5 | 63% | 0.63 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -59.6 | -49.6 | 176.2 | 178.5 | 179.1 | 175.4 | 152.3 | 3.7 | 111.3 | T56 D57 R62 L63 E64 | T56-R60 VanDerWaalsContact O-CB 3.29Å; T56-R60 WeakPolarHBondContact O-CB 3.44Å; T56-R60 PolarHBondContact O-N 3.29Å; D57-R60 PolarHBondContact O-N 2.84Å; R60-R62 VanDerWaalsContact C-N 3.3Å; R60-R62 PolarHBondContact O-N 3.45Å; R60-L63 CarbonylContact O-C 3.56Å; R60-L63 PolarHBondContact O-N 2.76Å; R60-E64 VanDerWaalsContact O-CB 3.29Å; R60-E64 WeakPolarHBondContact O-CB 3.35Å; R60-E64 PolarHBondContact O-N 3.3Å |
| 61 | S | 95.5 | Very high | 95.4 | Very high | 76 Ų | 76 | 105.6 Ų | 105.6 | 53% | 0.531 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -59.1 | -39.2 | 178.7 | 177.3 | 0 | 0 | 0 | 0 | 112.4 | D57 K65 | D57-S61 WeakPolarHBondContact O-CB 3.39Å; D57-S61 PolarHBondContact O-N 2.94Å; S61-K65 WeakPolarHBondContact O-CB 3.39Å; S61-K65 PolarHBondContact O-N 2.84Å |
| 62 | R | 95.4 | Very high | 95.7 | Very high | 188 Ų | 188 | 107.3 Ų | 107.3 | 71% | 0.709 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -65.6 | -39.5 | 173.5 | -71.7 | 170.3 | 177.1 | -168.1 | -2.3 | 112.7 | A58 A59 R60 R66 | A58-R62 VanDerWaalsContact O-CG 3.31Å; A58-R62 WeakPolarHBondContact O-CG 3.5Å; A58-R62 PolarHBondContact O-N 3.28Å; A59-R62 PolarHBondContact O-N 2.82Å; R60-R62 VanDerWaalsContact C-N 3.3Å; R60-R62 PolarHBondContact O-N 3.45Å; R62-R66 WeakPolarHBondContact O-CG 3.2Å; R62-R66 PolarHBondContact O-N 3.14Å |
| 63 | L | 96.2 | Very high | 95.9 | Very high | 117 Ų | 117 | 108 Ų | 108 | 61% | 0.613 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -70.6 | -41.4 | 177.2 | -172.2 | 150.7 | 0 | 0 | 0 | 111.3 | A59 R60 R66 N67 | A59-L63 PolarHBondContact O-N 2.77Å; R60-L63 CarbonylContact O-C 3.56Å; R60-L63 PolarHBondContact O-N 2.76Å; L63-R66 PolarHBondContact O-N 2.99Å; L63-N67 WeakPolarHBondContact O-CB 3.41Å; L63-N67 PolarHBondContact O-N 3.14Å |
| 64 | E | 96.3 | Very high | 96.1 | Very high | 112 Ų | 112 | 109.3 Ų | 109.3 | 52% | 0.523 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -63.2 | -42 | 176.8 | -172.5 | 163 | -166.7 | 0 | 0 | 111.7 | R60 N67 S68 | R60-E64 VanDerWaalsContact O-CB 3.29Å; R60-E64 WeakPolarHBondContact O-CB 3.35Å; R60-E64 PolarHBondContact O-N 3.3Å; E64-N67 PolarHBondContact O-N 2.97Å; E64-S68 PolarHBondContact O-N 3.43Å |
| 65 | K | 97.1 | Very high | 96.3 | Very high | 127 Ų | 127 | 107.1 Ų | 107.1 | 55% | 0.552 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -57.2 | -53.2 | 170.4 | -172.6 | 173.1 | -171.9 | -72.5 | 0 | 111.4 | S61 N67 S68 E69 | S61-K65 WeakPolarHBondContact O-CB 3.39Å; S61-K65 PolarHBondContact O-N 2.84Å; K65-N67 VanDerWaalsContact C-N 3.29Å; K65-N67 PolarHBondContact O-N 2.89Å; K65-S68 PolarHBondContact O-N 2.9Å; K65-S68 VanDerWaalsContact O-N 3.17Å; K65-S68 PolarHBondContact O-OG 3.25Å; K65-E69 IonicContact NZ-OE1 2.61Å; K65-E69 PolarHBondContact NZ-OE1 3.41Å; K65-E69 WeakPolarHBondContact O-CG 3.31Å; K65-E69 PolarHBondContact O-N 3.06Å |
| 66 | R | 96.6 | Very high | 96.5 | Very high | 175 Ų | 175 | 101.6 Ų | 101.6 | 66% | 0.66 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -59.7 | -37.4 | 176.8 | -71.9 | 179.2 | -176.4 | 167.3 | -0.5 | 113 | R62 L63 E69 L70 | R62-R66 WeakPolarHBondContact O-CG 3.2Å; R62-R66 PolarHBondContact O-N 3.14Å; L63-R66 PolarHBondContact O-N 2.99Å; R66-E69 WeakPolarHBondContact CA-OE2 3.43Å; R66-E69 PolarHBondContact O-N 2.88Å; R66-L70 WeakPolarHBondContact O-CB 3.42Å; R66-L70 VanDerWaalsContact O-CG 3.28Å; R66-L70 WeakPolarHBondContact O-CG 3.45Å; R66-L70 PolarHBondContact O-N 2.91Å |
| 67 | N | 97.5 | Very high | 96.7 | Very high | 102 Ų | 102 | 103 Ų | 103 | 55% | 0.545 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -66.1 | -41.3 | 177.6 | -163.9 | 19.9 | 0 | 0 | 0 | 111 | L63 E64 K65 L70 M71 | L63-N67 WeakPolarHBondContact O-CB 3.41Å; L63-N67 PolarHBondContact O-N 3.14Å; E64-N67 PolarHBondContact O-N 2.97Å; K65-N67 VanDerWaalsContact C-N 3.29Å; K65-N67 PolarHBondContact O-N 2.89Å; N67-L70 PolarHBondContact O-N 3.4Å; N67-M71 WeakPolarHBondContact O-CB 3.27Å; N67-M71 PolarHBondContact O-N 3.15Å |
| 68 | S | 97.4 | Very high | 97 | Very high | 65 Ų | 65 | 106.6 Ų | 106.6 | 46% | 0.455 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -65.3 | -37.4 | 173 | 73.2 | 0 | 0 | 0 | 0 | 112.9 | E64 K65 M71 V72 | E64-S68 PolarHBondContact O-N 3.43Å; K65-S68 PolarHBondContact O-N 2.9Å; K65-S68 VanDerWaalsContact O-N 3.17Å; K65-S68 PolarHBondContact O-OG 3.25Å; S68-M71 PolarHBondContact O-N 3.27Å; S68-V72 WeakPolarHBondContact O-CG2 3.35Å; S68-V72 PolarHBondContact O-N 3.14Å |
| 69 | E | 97.3 | Very high | 97.2 | Very high | 79 Ų | 79 | 110.7 Ų | 110.7 | 37% | 0.369 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -65 | -44.7 | 175.1 | -71 | 164.5 | 167.8 | 0 | 0 | 111.5 | K65 R66 V72 Q73 | K65-E69 IonicContact NZ-OE1 2.61Å; K65-E69 PolarHBondContact NZ-OE1 3.41Å; K65-E69 WeakPolarHBondContact O-CG 3.31Å; K65-E69 PolarHBondContact O-N 3.06Å; R66-E69 WeakPolarHBondContact CA-OE2 3.43Å; R66-E69 PolarHBondContact O-N 2.88Å; E69-V72 PolarHBondContact O-N 3.15Å; E69-Q73 WeakPolarHBondContact O-CG 3.39Å; E69-Q73 PolarHBondContact O-N 2.92Å |
| 70 | L | 98.1 | Very high | 97.4 | Very high | 96 Ų | 96 | 112.6 Ų | 112.6 | 50% | 0.503 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -64.3 | -38.8 | 174.4 | -73.8 | 167.9 | 0 | 0 | 0 | 112.3 | R66 N67 Q73 V74 | R66-L70 WeakPolarHBondContact O-CB 3.42Å; R66-L70 VanDerWaalsContact O-CG 3.28Å; R66-L70 WeakPolarHBondContact O-CG 3.45Å; R66-L70 PolarHBondContact O-N 2.91Å; N67-L70 PolarHBondContact O-N 3.4Å; L70-Q73 WeakPolarHBondContact O-CB 3.32Å; L70-Q73 PolarHBondContact O-N 3.23Å; L70-V74 WeakPolarHBondContact O-CG2 3.47Å; L70-V74 PolarHBondContact O-N 3.24Å |
| 71 | M | 97.2 | Very high | 97.5 | Very high | 124 Ų | 124 | 109.2 Ų | 109.2 | 61% | 0.611 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -62.7 | -43.9 | 175.7 | -171.4 | 173.1 | -176.9 | 0 | 0 | 111.5 | N67 S68 Q73 V74 D75 | N67-M71 WeakPolarHBondContact O-CB 3.27Å; N67-M71 PolarHBondContact O-N 3.15Å; S68-M71 PolarHBondContact O-N 3.27Å; M71-Q73 VanDerWaalsContact C-N 3.34Å; M71-Q73 PolarHBondContact O-N 2.99Å; M71-V74 PolarHBondContact O-N 3.48Å; M71-D75 PolarHBondContact O-N 2.7Å |
| 72 | V | 97.9 | Very high | 97.7 | Very high | 92 Ų | 92 | 109.8 Ų | 109.8 | 56% | 0.558 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -64.8 | -36.1 | 174.6 | 172.3 | 0 | 0 | 0 | 0 | 111.9 | S68 E69 T76 | S68-V72 WeakPolarHBondContact O-CG2 3.35Å; S68-V72 PolarHBondContact O-N 3.14Å; E69-V72 PolarHBondContact O-N 3.15Å; V72-T76 VanDerWaalsContact O-CB 3.3Å; V72-T76 WeakPolarHBondContact O-CB 3.44Å; V72-T76 PolarHBondContact O-N 3.49Å; V72-T76 PolarHBondContact O-OG1 3.12Å |
| 73 | Q | 98.3 | Very high | 97.8 | Very high | 106 Ų | 106 | 106.2 Ų | 106.2 | 50% | 0.495 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.3 | -44.9 | 172.6 | -72.4 | 173.3 | 14.8 | 0 | 0 | 111.8 | E69 L70 M71 T76 H77 | E69-Q73 WeakPolarHBondContact O-CG 3.39Å; E69-Q73 PolarHBondContact O-N 2.92Å; L70-Q73 WeakPolarHBondContact O-CB 3.32Å; L70-Q73 PolarHBondContact O-N 3.23Å; M71-Q73 VanDerWaalsContact C-N 3.34Å; M71-Q73 PolarHBondContact O-N 2.99Å; Q73-T76 PolarHBondContact O-N 2.93Å; Q73-H77 WeakPolarHBondContact O-CB 3.5Å; Q73-H77 PolarHBondContact O-CD2 3.46Å; Q73-H77 PolarHBondContact O-N 3.21Å |
| 74 | V | 98.4 | Very high | 97.9 | Very high | 94 Ų | 94 | 106.6 Ų | 106.6 | 57% | 0.57 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -60.9 | -46.2 | 176.4 | 169.3 | 0 | 0 | 0 | 0 | 111.3 | L70 M71 T76 H77 R78 | L70-V74 WeakPolarHBondContact O-CG2 3.47Å; L70-V74 PolarHBondContact O-N 3.24Å; M71-V74 PolarHBondContact O-N 3.48Å; V74-T76 VanDerWaalsContact C-N 3.27Å; V74-T76 PolarHBondContact O-N 2.86Å; V74-H77 PolarHBondContact O-N 3.27Å; V74-R78 VanDerWaalsContact O-CB 3.28Å; V74-R78 WeakPolarHBondContact O-CB 3.49Å; V74-R78 PolarHBondContact O-N 3.21Å |
| 75 | D | 98.3 | Very high | 98 | Very high | 73 Ų | 73 | 105.6 Ų | 105.6 | 39% | 0.39 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -63.3 | -33.3 | 175.6 | -79 | -17.4 | 0 | 0 | 0 | 112.6 | M71 K79 | M71-D75 PolarHBondContact O-N 2.7Å; D75-K79 WeakPolarHBondContact O-CD 3.38Å; D75-K79 VanDerWaalsContact O-CG 3.28Å; D75-K79 WeakPolarHBondContact O-CG 3.45Å; D75-K79 PolarHBondContact O-N 3.08Å; D75-K79 VanDerWaalsContact O-N 3.14Å |
| 76 | T | 98.4 | Very high | 98.1 | Very high | 62 Ų | 62 | 101 Ų | 101 | 38% | 0.38 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -72.3 | -45.8 | 177.1 | -58.9 | 0 | 0 | 0 | 0 | 111.2 | V72 Q73 V74 R78 K79 Q80 | V72-T76 VanDerWaalsContact O-CB 3.3Å; V72-T76 WeakPolarHBondContact O-CB 3.44Å; V72-T76 PolarHBondContact O-N 3.49Å; V72-T76 PolarHBondContact O-OG1 3.12Å; Q73-T76 PolarHBondContact O-N 2.93Å; V74-T76 VanDerWaalsContact C-N 3.27Å; V74-T76 PolarHBondContact O-N 2.86Å; T76-R78 VanDerWaalsContact C-N 3.32Å; T76-R78 PolarHBondContact O-N 3.36Å; T76-K79 PolarHBondContact O-N 3.33Å; T76-Q80 WeakPolarHBondContact O-CG 3.28Å; T76-Q80 PolarHBondContact O-N 2.89Å |
| 77 | H | 98.6 | Very high | 98.2 | Very high | 112 Ų | 112 | 96 Ų | 96 | 52% | 0.519 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63.7 | -39.6 | 176 | -76.3 | -144.9 | 0 | 0 | 0 | 111 | Q73 V74 Q80 I81 | Q73-H77 WeakPolarHBondContact O-CB 3.5Å; Q73-H77 PolarHBondContact O-CD2 3.46Å; Q73-H77 PolarHBondContact O-N 3.21Å; V74-H77 PolarHBondContact O-N 3.27Å; H77-Q80 PolarHBondContact O-N 2.99Å; H77-I81 WeakPolarHBondContact O-CG1 3.24Å; H77-I81 PolarHBondContact O-N 3.37Å |
| 78 | R | 98.6 | Very high | 98.2 | Very high | 159 Ų | 159 | 95.6 Ų | 95.6 | 60% | 0.6 | 49% | 0.487 | S | S | * | . | H | α-helix | trans | -58.1 | -50.8 | 174 | -175 | 176.5 | -175.6 | 123.9 | 13.5 | 111.5 | V74 T76 Q80 I81 D82 | V74-R78 VanDerWaalsContact O-CB 3.28Å; V74-R78 WeakPolarHBondContact O-CB 3.49Å; V74-R78 PolarHBondContact O-N 3.21Å; T76-R78 VanDerWaalsContact C-N 3.32Å; T76-R78 PolarHBondContact O-N 3.36Å; R78-Q80 VanDerWaalsContact C-N 3.27Å; R78-Q80 PolarHBondContact O-N 2.92Å; R78-I81 WeakPolarHBondContact O-CA 3.43Å; R78-I81 WeakPolarHBondContact O-CB 3.12Å; R78-I81 PolarHBondContact O-N 2.73Å; R78-D82 VanDerWaalsContact O-CG 3.25Å; R78-D82 PolarHBondContact O-N 3.42Å |
| 79 | K | 98.4 | Very high | 98.3 | Very high | 140 Ų | 140 | 96.5 Ų | 96.5 | 61% | 0.609 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -60.6 | -34.3 | 176.4 | -71 | 164.7 | -172.7 | 168.7 | 0 | 113.1 | D75 T76 Q83 | D75-K79 WeakPolarHBondContact O-CD 3.38Å; D75-K79 VanDerWaalsContact O-CG 3.28Å; D75-K79 WeakPolarHBondContact O-CG 3.45Å; D75-K79 PolarHBondContact O-N 3.08Å; D75-K79 VanDerWaalsContact O-N 3.14Å; T76-K79 PolarHBondContact O-N 3.33Å; K79-Q83 VanDerWaalsContact O-CB 3.23Å; K79-Q83 WeakPolarHBondContact O-CB 3.36Å; K79-Q83 PolarHBondContact O-N 2.86Å |
| 80 | Q | 98.5 | Very high | 98.3 | Very high | 99 Ų | 99 | 97.1 Ų | 97.1 | 46% | 0.463 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -69.1 | -32.4 | 173.7 | -71.2 | -179.8 | 24.8 | 0 | 0 | 112.9 | T76 H77 R78 K84 | T76-Q80 WeakPolarHBondContact O-CG 3.28Å; T76-Q80 PolarHBondContact O-N 2.89Å; H77-Q80 PolarHBondContact O-N 2.99Å; R78-Q80 VanDerWaalsContact C-N 3.27Å; R78-Q80 PolarHBondContact O-N 2.92Å; Q80-K84 WeakPolarHBondContact O-CB 3.43Å; Q80-K84 WeakPolarHBondContact O-CD 3.28Å; Q80-K84 VanDerWaalsContact O-CG 3.24Å; Q80-K84 WeakPolarHBondContact O-CG 3.38Å; Q80-K84 PolarHBondContact O-N 3.47Å; Q80-K84 VanDerWaalsContact O-N 3.1Å |
| 81 | I | 98.4 | Very high | 98.3 | Very high | 96 Ų | 96 | 97.5 Ų | 97.5 | 49% | 0.492 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -70.6 | -53.6 | 172.4 | -67 | 162.3 | 0 | 0 | 0 | 109.3 | H77 R78 Q83 K84 D85 | H77-I81 WeakPolarHBondContact O-CG1 3.24Å; H77-I81 PolarHBondContact O-N 3.37Å; R78-I81 WeakPolarHBondContact O-CA 3.43Å; R78-I81 WeakPolarHBondContact O-CB 3.12Å; R78-I81 PolarHBondContact O-N 2.73Å; I81-Q83 PolarHBondContact O-N 3.07Å; I81-Q83 VanDerWaalsContact O-N 3.17Å; I81-K84 PolarHBondContact O-N 3.19Å; I81-D85 WeakPolarHBondContact CG2-OD2 3.3Å; I81-D85 WeakPolarHBondContact O-CB 3.49Å; I81-D85 PolarHBondContact O-N 3.1Å |
| 82 | D | 98.4 | Very high | 98.4 | Very high | 88 Ų | 88 | 96.5 Ų | 96.5 | 47% | 0.471 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -53.6 | -39.9 | 178.7 | -60 | -35.9 | 0 | 0 | 0 | 111.6 | R78 G86 | R78-D82 VanDerWaalsContact O-CG 3.25Å; R78-D82 PolarHBondContact O-N 3.42Å; D82-G86 PolarHBondContact O-N 3.24Å |
| 83 | Q | 98.5 | Very high | 98.4 | Very high | 113 Ų | 113 | 93.9 Ų | 93.9 | 53% | 0.528 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -66.4 | -50.5 | 173.8 | 178 | 60.2 | 51.4 | 0 | 0 | 112.4 | K79 I81 D85 G86 D87 | K79-Q83 VanDerWaalsContact O-CB 3.23Å; K79-Q83 WeakPolarHBondContact O-CB 3.36Å; K79-Q83 PolarHBondContact O-N 2.86Å; I81-Q83 PolarHBondContact O-N 3.07Å; I81-Q83 VanDerWaalsContact O-N 3.17Å; Q83-D85 VanDerWaalsContact C-N 3.29Å; Q83-D85 PolarHBondContact O-N 3.24Å; Q83-G86 WeakPolarHBondContact O-CA 3.48Å; Q83-G86 PolarHBondContact O-N 3.49Å; Q83-G86 VanDerWaalsContact O-N 3.15Å; Q83-D87 VanDerWaalsContact NE2-CG 3.27Å; Q83-D87 PolarHBondContact NE2-OD1 3.04Å; Q83-D87 VanDerWaalsContact NE2-OD1 3.16Å; Q83-D87 PolarHBondContact NE2-OD2 3.05Å; Q83-D87 PolarHBondContact O-N 2.91Å |
| 84 | K | 98.3 | Very high | 98.4 | Very high | 124 Ų | 124 | 94.8 Ų | 94.8 | 54% | 0.539 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -63.5 | -34.2 | 179.9 | -78.4 | 172.4 | 178.9 | 173 | 0 | 112.5 | Q80 I81 D87 N88 | Q80-K84 WeakPolarHBondContact O-CB 3.43Å; Q80-K84 WeakPolarHBondContact O-CD 3.28Å; Q80-K84 VanDerWaalsContact O-CG 3.24Å; Q80-K84 WeakPolarHBondContact O-CG 3.38Å; Q80-K84 PolarHBondContact O-N 3.47Å; Q80-K84 VanDerWaalsContact O-N 3.1Å; I81-K84 PolarHBondContact O-N 3.19Å; K84-D87 PolarHBondContact O-N 2.69Å; K84-N88 VanDerWaalsContact O-CB 3.23Å; K84-N88 WeakPolarHBondContact O-CB 3.27Å; K84-N88 PolarHBondContact O-N 2.89Å; K84-N88 PolarHBondContact O-ND2 3.16Å; K84-N88 VanDerWaalsContact O-ND2 3.12Å |
| 85 | D | 98.4 | Very high | 98.4 | Very high | 91 Ų | 91 | 95.7 Ų | 95.7 | 49% | 0.487 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -69.6 | -35.9 | 175.6 | -69.8 | -16.9 | 0 | 0 | 0 | 111.2 | I81 Q83 S89 | I81-D85 WeakPolarHBondContact CG2-OD2 3.3Å; I81-D85 WeakPolarHBondContact O-CB 3.49Å; I81-D85 PolarHBondContact O-N 3.1Å; Q83-D85 VanDerWaalsContact C-N 3.29Å; Q83-D85 PolarHBondContact O-N 3.24Å; D85-S89 WeakPolarHBondContact O-CB 3.47Å; D85-S89 PolarHBondContact O-N 2.93Å |
| 86 | G | 98.6 | Very high | 98.5 | Very high | 31 Ų | 31 | 98.5 Ų | 98.5 | 32% | 0.32 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.2 | -48.5 | 168 | 0 | 0 | 0 | 0 | 0 | 113 | D82 Q83 N88 S89 I90 | D82-G86 PolarHBondContact O-N 3.24Å; Q83-G86 WeakPolarHBondContact O-CA 3.48Å; Q83-G86 PolarHBondContact O-N 3.49Å; Q83-G86 VanDerWaalsContact O-N 3.15Å; G86-N88 PolarHBondContact O-N 3.22Å; G86-S89 PolarHBondContact O-N 2.91Å; G86-I90 WeakPolarHBondContact O-CG1 3.32Å; G86-I90 PolarHBondContact O-N 3.46Å |
| 87 | D | 98.3 | Very high | 98.5 | Very high | 71 Ų | 71 | 98.1 Ų | 98.1 | 38% | 0.38 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -63.7 | -40.9 | 177.9 | -67.6 | -41.2 | 0 | 0 | 0 | 111.9 | Q83 K84 I90 L91 | Q83-D87 VanDerWaalsContact NE2-CG 3.27Å; Q83-D87 PolarHBondContact NE2-OD1 3.04Å; Q83-D87 VanDerWaalsContact NE2-OD1 3.16Å; Q83-D87 PolarHBondContact NE2-OD2 3.05Å; Q83-D87 PolarHBondContact O-N 2.91Å; K84-D87 PolarHBondContact O-N 2.69Å; D87-I90 PolarHBondContact O-N 2.9Å; D87-L91 WeakPolarHBondContact O-CG 3.49Å; D87-L91 PolarHBondContact O-N 3.44Å |
| 88 | N | 98.3 | Very high | 98.5 | Very high | 93 Ų | 93 | 101.2 Ų | 101.2 | 50% | 0.497 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -60.6 | -45 | 172.7 | -76.1 | -28.8 | 0 | 0 | 0 | 111.4 | K84 G86 I90 L91 D92 | K84-N88 VanDerWaalsContact O-CB 3.23Å; K84-N88 WeakPolarHBondContact O-CB 3.27Å; K84-N88 PolarHBondContact O-N 2.89Å; K84-N88 PolarHBondContact O-ND2 3.16Å; K84-N88 VanDerWaalsContact O-ND2 3.12Å; G86-N88 PolarHBondContact O-N 3.22Å; N88-I90 VanDerWaalsContact C-N 3.31Å; N88-I90 PolarHBondContact O-N 3.36Å; N88-L91 PolarHBondContact O-N 2.96Å; N88-L91 VanDerWaalsContact O-N 3.16Å; N88-D92 WeakPolarHBondContact O-CB 3.41Å; N88-D92 PolarHBondContact O-N 3.47Å |
| 89 | S | 98.6 | Very high | 98.5 | Very high | 84 Ų | 84 | 99.9 Ų | 99.9 | 59% | 0.587 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -62.8 | -37.3 | 176.9 | -176.6 | 0 | 0 | 0 | 0 | 112.3 | D85 G86 G93 | D85-S89 WeakPolarHBondContact O-CB 3.47Å; D85-S89 PolarHBondContact O-N 2.93Å; G86-S89 PolarHBondContact O-N 2.91Å; S89-G93 PolarHBondContact O-N 3.39Å |
| 90 | I | 98.5 | Very high | 98.5 | Very high | 92 Ų | 92 | 95.7 Ų | 95.7 | 47% | 0.472 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -68 | -37.4 | 174 | -68.7 | 164.8 | 0 | 0 | 0 | 111.4 | G86 D87 N88 K94 | G86-I90 WeakPolarHBondContact O-CG1 3.32Å; G86-I90 PolarHBondContact O-N 3.46Å; D87-I90 PolarHBondContact O-N 2.9Å; N88-I90 VanDerWaalsContact C-N 3.31Å; N88-I90 PolarHBondContact O-N 3.36Å; I90-K94 HydrophobicContact CG2-CD 4.24Å; I90-K94 WeakPolarHBondContact O-CD 3.42Å; I90-K94 VanDerWaalsContact O-CG 3.23Å; I90-K94 WeakPolarHBondContact O-CG 3.26Å; I90-K94 PolarHBondContact O-N 3.04Å; I90-K94 VanDerWaalsContact O-N 3.16Å |
| 91 | L | 98.4 | Very high | 98.5 | Very high | 104 Ų | 104 | 95.8 Ų | 95.8 | 55% | 0.545 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -69.3 | -41.8 | 175.4 | -73.3 | 170.1 | 0 | 0 | 0 | 112.1 | D87 N88 K94 L95 | D87-L91 WeakPolarHBondContact O-CG 3.49Å; D87-L91 PolarHBondContact O-N 3.44Å; N88-L91 PolarHBondContact O-N 2.96Å; N88-L91 VanDerWaalsContact O-N 3.16Å; L91-K94 WeakPolarHBondContact O-CB 3.4Å; L91-K94 PolarHBondContact O-N 2.92Å; L91-L95 WeakPolarHBondContact O-CB 3.48Å; L91-L95 PolarHBondContact O-N 2.89Å |
| 92 | D | 98.4 | Very high | 98.5 | Very high | 103 Ų | 103 | 96.4 Ų | 96.4 | 55% | 0.551 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -63.9 | -45.4 | 176.8 | -170.9 | 55.5 | 0 | 0 | 0 | 111.5 | N88 K94 L95 Q96 | N88-D92 WeakPolarHBondContact O-CB 3.41Å; N88-D92 PolarHBondContact O-N 3.47Å; D92-K94 VanDerWaalsContact C-N 3.29Å; D92-K94 PolarHBondContact O-N 3.36Å; D92-L95 WeakPolarHBondContact O-CB 3.47Å; D92-L95 PolarHBondContact O-N 3.38Å; D92-Q96 WeakPolarHBondContact O-CB 3.29Å; D92-Q96 PolarHBondContact O-N 3.44Å |
| 93 | G | 98.4 | Very high | 98.5 | Very high | 37 Ų | 37 | 98.5 Ų | 98.5 | 38% | 0.381 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.3 | -35.7 | 172.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | S89 A97 | S89-G93 PolarHBondContact O-N 3.39Å; G93-A97 WeakPolarHBondContact O-CB 3.48Å; G93-A97 PolarHBondContact O-N 3.25Å; G93-A97 VanDerWaalsContact O-N 3.08Å |
| 94 | K | 98.6 | Very high | 98.5 | Very high | 125 Ų | 125 | 99.1 Ų | 99.1 | 54% | 0.543 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -69.6 | -37.8 | 172.3 | -73.8 | 165.6 | -176.3 | 170.5 | 0 | 112.1 | I90 L91 D92 R98 | I90-K94 HydrophobicContact CG2-CD 4.24Å; I90-K94 WeakPolarHBondContact O-CD 3.42Å; I90-K94 VanDerWaalsContact O-CG 3.23Å; I90-K94 WeakPolarHBondContact O-CG 3.26Å; I90-K94 PolarHBondContact O-N 3.04Å; I90-K94 VanDerWaalsContact O-N 3.16Å; L91-K94 WeakPolarHBondContact O-CB 3.4Å; L91-K94 PolarHBondContact O-N 2.92Å; D92-K94 VanDerWaalsContact C-N 3.29Å; D92-K94 PolarHBondContact O-N 3.36Å; K94-R98 WeakPolarHBondContact O-CG 3.2Å; K94-R98 PolarHBondContact O-N 2.61Å |
| 95 | L | 98.4 | Very high | 98.5 | Very high | 113 Ų | 113 | 97 Ų | 97 | 59% | 0.592 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -66 | -49.6 | 177.3 | -178.4 | 62.3 | 0 | 0 | 0 | 110.6 | L91 D92 A97 R98 E99 | L91-L95 WeakPolarHBondContact O-CB 3.48Å; L91-L95 PolarHBondContact O-N 2.89Å; D92-L95 WeakPolarHBondContact O-CB 3.47Å; D92-L95 PolarHBondContact O-N 3.38Å; L95-A97 VanDerWaalsContact C-N 3.31Å; L95-A97 PolarHBondContact O-N 3.08Å; L95-R98 CarbonylContact O-C 3.59Å; L95-R98 WeakPolarHBondContact O-CA 3.37Å; L95-R98 WeakPolarHBondContact O-CB 3.39Å; L95-R98 PolarHBondContact O-N 3.34Å; L95-E99 PolarHBondContact O-N 3.31Å |
| 96 | Q | 98.6 | Very high | 98.5 | Very high | 132 Ų | 132 | 95.8 Ų | 95.8 | 62% | 0.617 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -59 | -40.4 | 175.3 | -172.5 | -177.9 | 67.6 | 0 | 0 | 111.9 | D92 R98 E99 A100 | D92-Q96 WeakPolarHBondContact O-CB 3.29Å; D92-Q96 PolarHBondContact O-N 3.44Å; Q96-R98 VanDerWaalsContact C-N 3.35Å; Q96-R98 PolarHBondContact O-N 2.97Å; Q96-E99 PolarHBondContact O-N 3.03Å; Q96-A100 WeakPolarHBondContact O-CB 3.39Å; Q96-A100 PolarHBondContact O-N 2.89Å |
| 97 | A | 98.6 | Very high | 98.5 | Very high | 53 Ų | 53 | 98.7 Ų | 98.7 | 44% | 0.438 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -64.8 | -36.3 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | G93 L95 L101 | G93-A97 WeakPolarHBondContact O-CB 3.48Å; G93-A97 PolarHBondContact O-N 3.25Å; G93-A97 VanDerWaalsContact O-N 3.08Å; L95-A97 VanDerWaalsContact C-N 3.31Å; L95-A97 PolarHBondContact O-N 3.08Å; A97-L101 WeakPolarHBondContact O-CG 3.42Å; A97-L101 PolarHBondContact O-N 3.46Å |
| 98 | R | 98.5 | Very high | 98.5 | Very high | 177 Ų | 177 | 101.5 Ų | 101.5 | 67% | 0.668 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -69.5 | -42.7 | 172.9 | -75 | -68.8 | -170.7 | 174.7 | 2.4 | 111.9 | K94 L95 Q96 A100 L101 I102 | K94-R98 WeakPolarHBondContact O-CG 3.2Å; K94-R98 PolarHBondContact O-N 2.61Å; L95-R98 CarbonylContact O-C 3.59Å; L95-R98 WeakPolarHBondContact O-CA 3.37Å; L95-R98 WeakPolarHBondContact O-CB 3.39Å; L95-R98 PolarHBondContact O-N 3.34Å; Q96-R98 VanDerWaalsContact C-N 3.35Å; Q96-R98 PolarHBondContact O-N 2.97Å; R98-A100 PolarHBondContact O-N 3.01Å; R98-L101 PolarHBondContact O-N 3.31Å; R98-L101 VanDerWaalsContact O-N 3.16Å; R98-I102 VanDerWaalsContact O-CG1 3.31Å; R98-I102 WeakPolarHBondContact O-CG1 3.42Å; R98-I102 PolarHBondContact O-N 2.89Å |
| 99 | E | 98.5 | Very high | 98.5 | Very high | 132 Ų | 132 | 103.7 Ų | 103.7 | 62% | 0.617 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -60.8 | -43.9 | 176.3 | -171.2 | -178.1 | -174.2 | 0 | 0 | 111.4 | L95 Q96 L101 I102 K103 | L95-E99 PolarHBondContact O-N 3.31Å; Q96-E99 PolarHBondContact O-N 3.03Å; E99-L101 VanDerWaalsContact C-N 3.27Å; E99-L101 PolarHBondContact O-N 3.01Å; E99-I102 PolarHBondContact O-N 3.37Å; E99-K103 WeakPolarHBondContact O-CB 3.36Å; E99-K103 PolarHBondContact O-N 3.05Å |
| 100 | A | 98.6 | Very high | 98.5 | Very high | 51 Ų | 51 | 105.6 Ų | 105.6 | 42% | 0.421 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -62.7 | -31.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | Q96 R98 K104 | Q96-A100 WeakPolarHBondContact O-CB 3.39Å; Q96-A100 PolarHBondContact O-N 2.89Å; R98-A100 PolarHBondContact O-N 3.01Å; A100-K104 WeakPolarHBondContact O-CG 3.48Å; A100-K104 PolarHBondContact O-N 3.19Å |
| 101 | L | 98.6 | Very high | 98.5 | Very high | 102 Ų | 102 | 108 Ų | 108 | 53% | 0.534 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -76.3 | -40.7 | 172.6 | -72.2 | 169.6 | 0 | 0 | 0 | 112.2 | A97 R98 E99 K103 K104 C105 | A97-L101 WeakPolarHBondContact O-CG 3.42Å; A97-L101 PolarHBondContact O-N 3.46Å; R98-L101 PolarHBondContact O-N 3.31Å; R98-L101 VanDerWaalsContact O-N 3.16Å; E99-L101 VanDerWaalsContact C-N 3.27Å; E99-L101 PolarHBondContact O-N 3.01Å; L101-K103 VanDerWaalsContact C-N 3.32Å; L101-K103 PolarHBondContact O-N 3.49Å; L101-K104 PolarHBondContact O-N 2.99Å; L101-C105 WeakPolarHBondContact O-CB 3.43Å; L101-C105 PolarHBondContact O-N 3.41Å |
| 102 | I | 98.5 | Very high | 98.5 | Very high | 108 Ų | 108 | 107 Ų | 107 | 55% | 0.554 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -59.5 | -46 | 174.4 | -70.8 | 163.4 | 0 | 0 | 0 | 109.7 | R98 E99 K104 C105 T106 | R98-I102 VanDerWaalsContact O-CG1 3.31Å; R98-I102 WeakPolarHBondContact O-CG1 3.42Å; R98-I102 PolarHBondContact O-N 2.89Å; E99-I102 PolarHBondContact O-N 3.37Å; I102-K104 PolarHBondContact O-N 2.88Å; I102-C105 CarbonylContact O-C 3.6Å; I102-C105 WeakPolarHBondContact O-CB 3.33Å; I102-C105 PolarHBondContact O-N 3.4Å; I102-T106 PolarHBondContact O-N 3.09Å; I102-T106 PolarHBondContact O-OG1 2.71Å |
| 103 | K | 98.6 | Very high | 98.5 | Very high | 133 Ų | 133 | 107 Ų | 107 | 58% | 0.578 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -58.7 | -47.4 | 177.9 | -175.9 | 171.7 | -179.7 | 174.7 | 0 | 112.5 | E99 L101 C105 T106 D107 | E99-K103 WeakPolarHBondContact O-CB 3.36Å; E99-K103 PolarHBondContact O-N 3.05Å; L101-K103 VanDerWaalsContact C-N 3.32Å; L101-K103 PolarHBondContact O-N 3.49Å; K103-C105 VanDerWaalsContact C-N 3.33Å; K103-C105 PolarHBondContact O-N 3.25Å; K103-T106 WeakPolarHBondContact CA-OG1 3.19Å; K103-T106 PolarHBondContact O-N 3.47Å; K103-T106 PolarHBondContact O-OG1 3.35Å; K103-D107 PolarHBondContact O-N 2.78Å |
| 104 | K | 98.5 | Very high | 98.5 | Very high | 126 Ų | 126 | 107.1 Ų | 107.1 | 55% | 0.548 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -58.8 | -45.1 | 174.9 | -72.4 | 173.1 | -179.4 | -177.6 | 0 | 111.8 | A100 L101 I102 T106 D107 E108 | A100-K104 WeakPolarHBondContact O-CG 3.48Å; A100-K104 PolarHBondContact O-N 3.19Å; L101-K104 PolarHBondContact O-N 2.99Å; I102-K104 PolarHBondContact O-N 2.88Å; K104-T106 VanDerWaalsContact C-N 3.34Å; K104-T106 PolarHBondContact O-N 2.88Å; K104-D107 PolarHBondContact O-N 3.43Å; K104-E108 WeakPolarHBondContact O-CB 3.41Å; K104-E108 VanDerWaalsContact O-CG 3.32Å; K104-E108 WeakPolarHBondContact O-CG 3.28Å; K104-E108 PolarHBondContact O-N 2.87Å |
| 105 | C | 98.4 | Very high | 98.5 | Very high | 79 Ų | 79 | 104.9 Ų | 104.9 | 53% | 0.534 | 54% | 0.536 | S | S | . | . | H | α-helix | trans | -61.6 | -38.4 | 176.4 | -175.6 | 0 | 0 | 0 | 0 | 112.3 | L101 I102 K103 K109 | L101-C105 WeakPolarHBondContact O-CB 3.43Å; L101-C105 PolarHBondContact O-N 3.41Å; I102-C105 CarbonylContact O-C 3.6Å; I102-C105 WeakPolarHBondContact O-CB 3.33Å; I102-C105 PolarHBondContact O-N 3.4Å; K103-C105 VanDerWaalsContact C-N 3.33Å; K103-C105 PolarHBondContact O-N 3.25Å; C105-K109 WeakPolarHBondContact O-CB 3.44Å; C105-K109 PolarHBondContact O-N 2.89Å |
| 106 | T | 98.5 | Very high | 98.6 | Very high | 65 Ų | 65 | 103.3 Ų | 103.3 | 40% | 0.399 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -69.9 | -39.8 | 174.2 | 50.6 | 0 | 0 | 0 | 0 | 112.7 | I102 K103 K104 K109 M110 | I102-T106 PolarHBondContact O-N 3.09Å; I102-T106 PolarHBondContact O-OG1 2.71Å; K103-T106 WeakPolarHBondContact CA-OG1 3.19Å; K103-T106 PolarHBondContact O-N 3.47Å; K103-T106 PolarHBondContact O-OG1 3.35Å; K104-T106 VanDerWaalsContact C-N 3.34Å; K104-T106 PolarHBondContact O-N 2.88Å; T106-K109 PolarHBondContact O-N 3.39Å; T106-M110 WeakPolarHBondContact O-CB 3.4Å; T106-M110 VanDerWaalsContact O-CG 3.27Å; T106-M110 WeakPolarHBondContact O-CG 3.48Å; T106-M110 PolarHBondContact O-N 2.91Å |
| 107 | D | 98.6 | Very high | 98.6 | Very high | 92 Ų | 92 | 101.2 Ų | 101.2 | 49% | 0.492 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -65.2 | -43.5 | 177.8 | -63.8 | -20.1 | 0 | 0 | 0 | 110.7 | K103 K104 M110 K111 | K103-D107 PolarHBondContact O-N 2.78Å; K104-D107 PolarHBondContact O-N 3.43Å; D107-M110 PolarHBondContact O-N 3.49Å; D107-K111 PolarHBondContact O-N 3.32Å |
| 108 | E | 98.5 | Very high | 98.6 | Very high | 130 Ų | 130 | 101.3 Ų | 101.3 | 61% | 0.607 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -63.9 | -43.8 | 173.9 | -73.4 | 170.1 | -166.7 | 0 | 0 | 112.2 | K104 M110 K111 V112 | K104-E108 WeakPolarHBondContact O-CB 3.41Å; K104-E108 VanDerWaalsContact O-CG 3.32Å; K104-E108 WeakPolarHBondContact O-CG 3.28Å; K104-E108 PolarHBondContact O-N 2.87Å; E108-M110 PolarHBondContact O-N 3.39Å; E108-K111 PolarHBondContact O-N 3.26Å; E108-V112 WeakPolarHBondContact O-CG2 3.37Å; E108-V112 PolarHBondContact O-N 3.37Å |
| 109 | K | 98.6 | Very high | 98.6 | Very high | 140 Ų | 140 | 99 Ų | 99 | 61% | 0.609 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -58.6 | -47.1 | 173.7 | 178.1 | -171.5 | 172.9 | -172.3 | 0 | 111.4 | C105 T106 K111 V112 Q113 | C105-K109 WeakPolarHBondContact O-CB 3.44Å; C105-K109 PolarHBondContact O-N 2.89Å; T106-K109 PolarHBondContact O-N 3.39Å; K109-K111 VanDerWaalsContact C-N 3.32Å; K109-K111 PolarHBondContact O-N 3.19Å; K109-V112 PolarHBondContact O-N 2.84Å; K109-Q113 VanDerWaalsContact O-CB 3.28Å; K109-Q113 WeakPolarHBondContact O-CB 3.41Å; K109-Q113 PolarHBondContact O-N 3.49Å |
| 110 | M | 98.7 | Very high | 98.6 | Very high | 123 Ų | 123 | 98.1 Ų | 98.1 | 61% | 0.606 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63.2 | -38.9 | 179.6 | -73.8 | -60 | -63.8 | 0 | 0 | 111.6 | T106 D107 E108 Q113 G114 | T106-M110 WeakPolarHBondContact O-CB 3.4Å; T106-M110 VanDerWaalsContact O-CG 3.27Å; T106-M110 WeakPolarHBondContact O-CG 3.48Å; T106-M110 PolarHBondContact O-N 2.91Å; D107-M110 PolarHBondContact O-N 3.49Å; E108-M110 PolarHBondContact O-N 3.39Å; M110-Q113 PolarHBondContact O-N 3Å; M110-G114 PolarHBondContact O-N 3.16Å |
| 111 | K | 98.7 | Very high | 98.6 | Very high | 142 Ų | 142 | 99.4 Ų | 99.4 | 62% | 0.617 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -60.5 | -54.3 | 172.6 | -176 | -171.7 | 170.6 | -171.9 | 0 | 111.7 | D107 E108 K109 Q113 G114 D115 | D107-K111 PolarHBondContact O-N 3.32Å; E108-K111 PolarHBondContact O-N 3.26Å; K109-K111 VanDerWaalsContact C-N 3.32Å; K109-K111 PolarHBondContact O-N 3.19Å; K111-Q113 VanDerWaalsContact C-N 3.26Å; K111-Q113 PolarHBondContact O-N 3.43Å; K111-G114 WeakPolarHBondContact O-CA 3.4Å; K111-G114 PolarHBondContact O-N 2.92Å; K111-D115 PolarHBondContact O-N 3.49Å |
| 112 | V | 98.6 | Very high | 98.6 | Very high | 85 Ų | 85 | 98.1 Ų | 98.1 | 52% | 0.515 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -61.6 | -35.8 | -179.4 | 173.9 | 0 | 0 | 0 | 0 | 111.4 | E108 K109 G114 D115 V116 | E108-V112 WeakPolarHBondContact O-CG2 3.37Å; E108-V112 PolarHBondContact O-N 3.37Å; K109-V112 PolarHBondContact O-N 2.84Å; V112-G114 VanDerWaalsContact C-N 3.34Å; V112-D115 PolarHBondContact O-N 2.86Å; V112-V116 HydrophobicContact CG1-CG2 4.36Å; V112-V116 WeakPolarHBondContact O-CB 3.37Å; V112-V116 VanDerWaalsContact O-CG2 3.28Å; V112-V116 WeakPolarHBondContact O-CG2 3.32Å; V112-V116 PolarHBondContact O-N 3.02Å |
| 113 | Q | 98.6 | Very high | 98.6 | Very high | 102 Ų | 102 | 96.6 Ų | 96.6 | 48% | 0.477 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.1 | -37.1 | 173.9 | -175.7 | 170.8 | -13.3 | 0 | 0 | 112.1 | K109 M110 K111 T117 | K109-Q113 VanDerWaalsContact O-CB 3.28Å; K109-Q113 WeakPolarHBondContact O-CB 3.41Å; K109-Q113 PolarHBondContact O-N 3.49Å; M110-Q113 PolarHBondContact O-N 3Å; K111-Q113 VanDerWaalsContact C-N 3.26Å; K111-Q113 PolarHBondContact O-N 3.43Å; Q113-T117 WeakPolarHBondContact O-CB 3.27Å; Q113-T117 PolarHBondContact O-N 3.28Å; Q113-T117 PolarHBondContact O-OG1 2.85Å |
| 114 | G | 98.6 | Very high | 98.6 | Very high | 39 Ų | 39 | 94.1 Ų | 94.1 | 40% | 0.402 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -63.5 | -49.8 | 170.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | M110 K111 V112 V116 T117 A118 | M110-G114 PolarHBondContact O-N 3.16Å; K111-G114 WeakPolarHBondContact O-CA 3.4Å; K111-G114 PolarHBondContact O-N 2.92Å; V112-G114 VanDerWaalsContact C-N 3.34Å; G114-V116 VanDerWaalsContact C-N 3.35Å; G114-V116 PolarHBondContact O-N 3.04Å; G114-T117 WeakPolarHBondContact O-CB 3.45Å; G114-T117 PolarHBondContact O-N 3.2Å; G114-T117 VanDerWaalsContact O-N 3.09Å; G114-A118 PolarHBondContact O-N 2.83Å |
| 115 | D | 98.6 | Very high | 98.6 | Very high | 79 Ų | 79 | 93.4 Ų | 93.4 | 42% | 0.422 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -58.7 | -43.6 | 178.3 | -66.7 | -30.1 | 0 | 0 | 0 | 111.6 | K111 V112 A118 Q119 | K111-D115 PolarHBondContact O-N 3.49Å; V112-D115 PolarHBondContact O-N 2.86Å; D115-A118 PolarHBondContact O-N 3.08Å; D115-Q119 WeakPolarHBondContact O-CG 3.36Å; D115-Q119 PolarHBondContact O-N 3.37Å |
| 116 | V | 98.6 | Very high | 98.6 | Very high | 80 Ų | 80 | 93.7 Ų | 93.7 | 49% | 0.485 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -64.4 | -38.3 | 174.6 | 167.9 | 0 | 0 | 0 | 0 | 111.9 | V112 G114 Q119 M120 | V112-V116 HydrophobicContact CG1-CG2 4.36Å; V112-V116 WeakPolarHBondContact O-CB 3.37Å; V112-V116 VanDerWaalsContact O-CG2 3.28Å; V112-V116 WeakPolarHBondContact O-CG2 3.32Å; V112-V116 PolarHBondContact O-N 3.02Å; G114-V116 VanDerWaalsContact C-N 3.35Å; G114-V116 PolarHBondContact O-N 3.04Å; V116-Q119 PolarHBondContact O-N 3.16Å; V116-M120 WeakPolarHBondContact O-CB 3.22Å; V116-M120 PolarHBondContact O-N 3.3Å |
| 117 | T | 98.6 | Very high | 98.6 | Very high | 87 Ų | 87 | 96.6 Ų | 96.6 | 53% | 0.534 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -67.4 | -40.2 | 177.6 | -57.1 | 0 | 0 | 0 | 0 | 111.3 | Q113 G114 M120 S121 | Q113-T117 WeakPolarHBondContact O-CB 3.27Å; Q113-T117 PolarHBondContact O-N 3.28Å; Q113-T117 PolarHBondContact O-OG1 2.85Å; G114-T117 WeakPolarHBondContact O-CB 3.45Å; G114-T117 PolarHBondContact O-N 3.2Å; G114-T117 VanDerWaalsContact O-N 3.09Å; T117-M120 PolarHBondContact O-N 3.42Å; T117-S121 PolarHBondContact O-N 3.49Å; T117-S121 VanDerWaalsContact O-N 3.08Å |
| 118 | A | 98.6 | Very high | 98.6 | Very high | 55 Ų | 55 | 96.2 Ų | 96.2 | 46% | 0.455 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.7 | -42.7 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | G114 D115 M120 S121 E122 | G114-A118 PolarHBondContact O-N 2.83Å; D115-A118 PolarHBondContact O-N 3.08Å; A118-M120 VanDerWaalsContact C-N 3.32Å; A118-M120 PolarHBondContact O-N 2.99Å; A118-S121 PolarHBondContact O-N 3.06Å; A118-S121 PolarHBondContact O-OG 2.81Å; A118-E122 WeakPolarHBondContact O-CB 3.41Å; A118-E122 PolarHBondContact O-N 2.91Å |
| 119 | Q | 98.5 | Very high | 98.6 | Very high | 130 Ų | 130 | 94.2 Ų | 94.2 | 61% | 0.607 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -63.2 | -37.7 | 173.6 | -73.5 | -179 | 7.1 | 0 | 0 | 112.1 | D115 V116 E122 I123 | D115-Q119 WeakPolarHBondContact O-CG 3.36Å; D115-Q119 PolarHBondContact O-N 3.37Å; V116-Q119 PolarHBondContact O-N 3.16Å; Q119-E122 PolarHBondContact O-N 3.16Å; Q119-I123 WeakPolarHBondContact O-CB 3.36Å; Q119-I123 WeakPolarHBondContact O-CD1 3.28Å; Q119-I123 WeakPolarHBondContact O-CG1 3.33Å; Q119-I123 PolarHBondContact O-N 2.83Å |
| 120 | M | 98.6 | Very high | 98.6 | Very high | 113 Ų | 113 | 93.3 Ų | 93.3 | 56% | 0.557 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -64 | -43.7 | 176.5 | -174.4 | 64.3 | 74 | 0 | 0 | 111.9 | V116 T117 A118 I123 V124 | V116-M120 WeakPolarHBondContact O-CB 3.22Å; V116-M120 PolarHBondContact O-N 3.3Å; T117-M120 PolarHBondContact O-N 3.42Å; A118-M120 VanDerWaalsContact C-N 3.32Å; A118-M120 PolarHBondContact O-N 2.99Å; M120-I123 PolarHBondContact O-N 2.85Å; M120-V124 WeakPolarHBondContact O-CG2 3.42Å; M120-V124 PolarHBondContact O-N 2.99Å |
| 121 | S | 98.3 | Very high | 98.6 | Very high | 77 Ų | 77 | 92.6 Ų | 92.6 | 54% | 0.538 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -66.7 | -38.6 | 177.5 | 65.7 | 0 | 0 | 0 | 0 | 112 | T117 A118 V124 R125 | T117-S121 PolarHBondContact O-N 3.49Å; T117-S121 VanDerWaalsContact O-N 3.08Å; A118-S121 PolarHBondContact O-N 3.06Å; A118-S121 PolarHBondContact O-OG 2.81Å; S121-V124 PolarHBondContact O-N 3.34Å; S121-R125 WeakPolarHBondContact O-CB 3.37Å; S121-R125 PolarHBondContact O-N 3.19Å |
| 122 | E | 98.7 | Very high | 98.6 | Very high | 76 Ų | 76 | 91.3 Ų | 91.3 | 36% | 0.355 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -64.4 | -40.8 | 173.7 | 178.9 | 59.6 | -170.5 | 0 | 0 | 112.2 | A118 Q119 V124 R125 L126 | A118-E122 WeakPolarHBondContact O-CB 3.41Å; A118-E122 PolarHBondContact O-N 2.91Å; Q119-E122 PolarHBondContact O-N 3.16Å; E122-V124 VanDerWaalsContact C-N 3.31Å; E122-V124 PolarHBondContact O-N 3.23Å; E122-R125 PolarHBondContact O-N 3.31Å; E122-R125 IonicContact OE1-CZ 3.41Å; E122-R125 IonicContact OE1-NE 2.73Å; E122-R125 IonicContact OE1-NH2 3.27Å; E122-R125 PolarHBondContact OE1-NH2 3.25Å; E122-R125 IonicContact OE2-CZ 3.97Å; E122-R125 IonicContact OE2-NE 2.7Å; E122-R125 PolarHBondContact OE2-NE 3.5Å; E122-R125 IonicContact OE2-NH2 3.62Å; E122-R125 PolarHBondContact OE2-NH2 3.15Å; E122-L126 HydrophobicContact CG-CD1 3.97Å; E122-L126 HydrophobicContact CG-CG 4.43Å; E122-L126 WeakPolarHBondContact O-CB 3.38Å; E122-L126 WeakPolarHBondContact O-CG 3.46Å; E122-L126 PolarHBondContact O-N 2.93Å |
| 123 | I | 98.6 | Very high | 98.6 | Very high | 76 Ų | 76 | 93.3 Ų | 93.3 | 39% | 0.39 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -61.7 | -38.3 | 173.7 | -74.1 | 164.2 | 0 | 0 | 0 | 111.4 | Q119 M120 K127 | Q119-I123 WeakPolarHBondContact O-CB 3.36Å; Q119-I123 WeakPolarHBondContact O-CD1 3.28Å; Q119-I123 WeakPolarHBondContact O-CG1 3.33Å; Q119-I123 PolarHBondContact O-N 2.83Å; M120-I123 PolarHBondContact O-N 2.85Å; I123-K127 HydrophobicContact CG2-CD 4.07Å; I123-K127 WeakPolarHBondContact O-CB 3.47Å; I123-K127 WeakPolarHBondContact O-CD 3.31Å; I123-K127 WeakPolarHBondContact O-CG 3.43Å; I123-K127 PolarHBondContact O-N 3.12Å |
| 124 | V | 98.6 | Very high | 98.5 | Very high | 81 Ų | 81 | 95.4 Ų | 95.4 | 49% | 0.491 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -66.8 | -45.8 | 174.2 | 171.5 | 0 | 0 | 0 | 0 | 110.8 | M120 S121 E122 L126 K127 E128 | M120-V124 WeakPolarHBondContact O-CG2 3.42Å; M120-V124 PolarHBondContact O-N 2.99Å; S121-V124 PolarHBondContact O-N 3.34Å; E122-V124 VanDerWaalsContact C-N 3.31Å; E122-V124 PolarHBondContact O-N 3.23Å; V124-L126 PolarHBondContact O-N 3.38Å; V124-K127 WeakPolarHBondContact O-CB 3.49Å; V124-K127 PolarHBondContact O-N 2.8Å; V124-E128 PolarHBondContact O-N 2.96Å |
| 125 | R | 98.7 | Very high | 98.5 | Very high | 110 Ų | 110 | 100.7 Ų | 100.7 | 42% | 0.415 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -58.7 | -47.7 | 178.1 | -164 | -168.9 | 67.4 | 66.5 | 9.7 | 112 | S121 E122 E128 Q129 | S121-R125 WeakPolarHBondContact O-CB 3.37Å; S121-R125 PolarHBondContact O-N 3.19Å; E122-R125 PolarHBondContact O-N 3.31Å; E122-R125 IonicContact OE1-CZ 3.41Å; E122-R125 IonicContact OE1-NE 2.73Å; E122-R125 IonicContact OE1-NH2 3.27Å; E122-R125 PolarHBondContact OE1-NH2 3.25Å; E122-R125 IonicContact OE2-CZ 3.97Å; E122-R125 IonicContact OE2-NE 2.7Å; E122-R125 PolarHBondContact OE2-NE 3.5Å; E122-R125 IonicContact OE2-NH2 3.62Å; E122-R125 PolarHBondContact OE2-NH2 3.15Å; R125-E128 PolarHBondContact O-N 2.9Å; R125-Q129 PolarHBondContact O-N 3.39Å; R125-Q129 VanDerWaalsContact O-N 3.1Å |
| 126 | L | 98.6 | Very high | 98.5 | Very high | 85 Ų | 85 | 100.4 Ų | 100.4 | 45% | 0.445 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -66 | -36 | 177.5 | -70.7 | 170.3 | 0 | 0 | 0 | 112.5 | E122 V124 E128 L130 | E122-L126 HydrophobicContact CG-CD1 3.97Å; E122-L126 HydrophobicContact CG-CG 4.43Å; E122-L126 WeakPolarHBondContact O-CB 3.38Å; E122-L126 WeakPolarHBondContact O-CG 3.46Å; E122-L126 PolarHBondContact O-N 2.93Å; V124-L126 PolarHBondContact O-N 3.38Å; L126-E128 VanDerWaalsContact C-N 3.31Å; L126-E128 PolarHBondContact O-N 3.16Å; L126-L130 WeakPolarHBondContact O-CB 3.42Å; L126-L130 PolarHBondContact O-N 2.83Å |
| 127 | K | 98.5 | Very high | 98.5 | Very high | 127 Ų | 127 | 102.5 Ų | 102.5 | 55% | 0.552 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -63.5 | -35.9 | 172.9 | -80.1 | 168.8 | -179.5 | 172.1 | 0 | 112.1 | I123 V124 K131 | I123-K127 HydrophobicContact CG2-CD 4.07Å; I123-K127 WeakPolarHBondContact O-CB 3.47Å; I123-K127 WeakPolarHBondContact O-CD 3.31Å; I123-K127 WeakPolarHBondContact O-CG 3.43Å; I123-K127 PolarHBondContact O-N 3.12Å; V124-K127 WeakPolarHBondContact O-CB 3.49Å; V124-K127 PolarHBondContact O-N 2.8Å; K127-K131 PolarHBondContact O-N 2.97Å |
| 128 | E | 98.6 | Very high | 98.5 | Very high | 83 Ų | 83 | 103 Ų | 103 | 39% | 0.388 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -70.8 | -47.5 | 177.1 | -148.3 | 61.2 | -129.9 | 0 | 0 | 111.5 | V124 R125 L126 L130 K131 E132 | V124-E128 PolarHBondContact O-N 2.96Å; R125-E128 PolarHBondContact O-N 2.9Å; L126-E128 VanDerWaalsContact C-N 3.31Å; L126-E128 PolarHBondContact O-N 3.16Å; E128-L130 PolarHBondContact O-N 3.02Å; E128-L130 VanDerWaalsContact O-N 3.16Å; E128-K131 WeakPolarHBondContact O-CA 3.45Å; E128-K131 WeakPolarHBondContact O-CB 3.35Å; E128-K131 PolarHBondContact O-N 3.33Å; E128-K131 WeakPolarHBondContact OE1-CD 3.41Å; E128-K131 VanDerWaalsContact OE1-CE 3.29Å; E128-K131 WeakPolarHBondContact OE1-CE 3.23Å; E128-K131 IonicContact OE1-NZ 2.61Å; E128-K131 PolarHBondContact OE1-NZ 3.17Å; E128-K131 WeakPolarHBondContact OE2-CE 3.36Å; E128-K131 IonicContact OE2-NZ 3.73Å; E128-K131 PolarHBondContact OE2-NZ 3.14Å; E128-E132 WeakPolarHBondContact O-CG 3.41Å; E128-E132 PolarHBondContact O-N 3.31Å |
| 129 | Q | 98.6 | Very high | 98.4 | Very high | 88 Ų | 88 | 107.2 Ų | 107.2 | 41% | 0.411 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -56.5 | -34.6 | 174.4 | -67.3 | -167.1 | -63.8 | 0 | 0 | 112.6 | R125 E132 L133 | R125-Q129 PolarHBondContact O-N 3.39Å; R125-Q129 VanDerWaalsContact O-N 3.1Å; Q129-E132 PolarHBondContact O-N 2.83Å; Q129-L133 VanDerWaalsContact O-CB 3.27Å; Q129-L133 WeakPolarHBondContact O-CB 3.45Å; Q129-L133 PolarHBondContact O-N 2.84Å |
| 130 | L | 98.5 | Very high | 98.4 | Very high | 121 Ų | 121 | 105.9 Ų | 105.9 | 63% | 0.634 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -70.8 | -30.4 | 175.1 | -172.8 | 145.8 | 0 | 0 | 0 | 112.8 | L126 E128 K134 | L126-L130 WeakPolarHBondContact O-CB 3.42Å; L126-L130 PolarHBondContact O-N 2.83Å; E128-L130 PolarHBondContact O-N 3.02Å; E128-L130 VanDerWaalsContact O-N 3.16Å; L130-K134 VanDerWaalsContact O-CB 3.26Å; L130-K134 WeakPolarHBondContact O-CB 3.34Å; L130-K134 PolarHBondContact O-N 3.1Å |
| 131 | K | 98.6 | Very high | 98.4 | Very high | 109 Ų | 109 | 104.4 Ų | 104.4 | 47% | 0.474 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -70.5 | -47.7 | 169.8 | -70.9 | -174.6 | -118.9 | 154.9 | 0 | 111.3 | K127 E128 K134 Q135 | K127-K131 PolarHBondContact O-N 2.97Å; E128-K131 WeakPolarHBondContact O-CA 3.45Å; E128-K131 WeakPolarHBondContact O-CB 3.35Å; E128-K131 PolarHBondContact O-N 3.33Å; E128-K131 WeakPolarHBondContact OE1-CD 3.41Å; E128-K131 VanDerWaalsContact OE1-CE 3.29Å; E128-K131 WeakPolarHBondContact OE1-CE 3.23Å; E128-K131 IonicContact OE1-NZ 2.61Å; E128-K131 PolarHBondContact OE1-NZ 3.17Å; E128-K131 WeakPolarHBondContact OE2-CE 3.36Å; E128-K131 IonicContact OE2-NZ 3.73Å; E128-K131 PolarHBondContact OE2-NZ 3.14Å; K131-K134 PolarHBondContact O-N 2.85Å; K131-Q135 WeakPolarHBondContact O-CB 3.49Å; K131-Q135 PolarHBondContact O-N 3.38Å |
| 132 | E | 98.3 | Very high | 98.4 | Very high | 114 Ų | 114 | 105.3 Ų | 105.3 | 53% | 0.533 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -56.3 | -51.7 | 178.4 | -68 | 173.9 | 157.6 | 0 | 0 | 111 | E128 Q129 K134 Q135 E136 | E128-E132 WeakPolarHBondContact O-CG 3.41Å; E128-E132 PolarHBondContact O-N 3.31Å; Q129-E132 PolarHBondContact O-N 2.83Å; E132-K134 VanDerWaalsContact C-N 3.31Å; E132-K134 PolarHBondContact O-N 3.48Å; E132-Q135 WeakPolarHBondContact O-CB 3.23Å; E132-Q135 PolarHBondContact O-N 3.19Å; E132-Q135 VanDerWaalsContact O-N 3.12Å; E132-E136 PolarHBondContact O-N 2.97Å |
| 133 | L | 98.5 | Very high | 98.4 | Very high | 128 Ų | 128 | 106 Ų | 106 | 67% | 0.67 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -61.9 | -37.1 | 178.3 | -176.4 | 62.1 | 0 | 0 | 0 | 112.4 | Q129 F137 | Q129-L133 VanDerWaalsContact O-CB 3.27Å; Q129-L133 WeakPolarHBondContact O-CB 3.45Å; Q129-L133 PolarHBondContact O-N 2.84Å; L133-F137 WeakPolarHBondContact O-CB 3.49Å; L133-F137 PolarHBondContact O-N 3.01Å |
| 134 | K | 98 | Very high | 98.4 | Very high | 146 Ų | 146 | 108.1 Ų | 108.1 | 64% | 0.635 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -67.8 | -38.6 | 174.4 | -177.8 | 178.8 | 178.6 | -178.8 | 0 | 112.1 | L130 K131 E132 M138 | L130-K134 VanDerWaalsContact O-CB 3.26Å; L130-K134 WeakPolarHBondContact O-CB 3.34Å; L130-K134 PolarHBondContact O-N 3.1Å; K131-K134 PolarHBondContact O-N 2.85Å; E132-K134 VanDerWaalsContact C-N 3.31Å; E132-K134 PolarHBondContact O-N 3.48Å; K134-M138 VanDerWaalsContact O-CG 3.28Å; K134-M138 WeakPolarHBondContact O-CG 3.43Å; K134-M138 PolarHBondContact O-N 2.83Å; K134-M138 VanDerWaalsContact O-N 3.08Å |
| 135 | Q | 98.5 | Very high | 98.3 | Very high | 149 Ų | 149 | 110.1 Ų | 110.1 | 70% | 0.696 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -66.9 | -42 | 176.3 | 178.7 | 172.9 | -19.5 | 0 | 0 | 111.2 | K131 E132 M138 R139 | K131-Q135 WeakPolarHBondContact O-CB 3.49Å; K131-Q135 PolarHBondContact O-N 3.38Å; E132-Q135 WeakPolarHBondContact O-CB 3.23Å; E132-Q135 PolarHBondContact O-N 3.19Å; E132-Q135 VanDerWaalsContact O-N 3.12Å; Q135-M138 PolarHBondContact O-N 2.69Å; Q135-R139 PolarHBondContact O-N 3.04Å |
| 136 | E | 98.3 | Very high | 98.3 | Very high | 73 Ų | 73 | 110.1 Ų | 110.1 | 34% | 0.341 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -68 | -39.9 | 176.6 | -175.9 | 53 | -148.4 | 0 | 0 | 111.8 | E132 M138 R139 Q140 | E132-E136 PolarHBondContact O-N 2.97Å; E136-M138 VanDerWaalsContact C-N 3.34Å; E136-M138 PolarHBondContact O-N 2.94Å; E136-R139 WeakPolarHBondContact O-CB 3.42Å; E136-R139 PolarHBondContact O-N 3.38Å; E136-R139 VanDerWaalsContact O-N 3.15Å; E136-R139 WeakPolarHBondContact OE2-CD 3.28Å; E136-R139 IonicContact OE2-NE 2.69Å; E136-Q140 WeakPolarHBondContact O-CG 3.48Å; E136-Q140 PolarHBondContact O-N 3.38Å; E136-Q140 WeakPolarHBondContact OE1-CG 3.5Å; E136-Q140 PolarHBondContact OE1-NE2 3.47Å |
| 137 | F | 98.1 | Very high | 98.2 | Very high | 125 Ų | 125 | 110.6 Ų | 110.6 | 55% | 0.548 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -57.4 | -45.5 | 171 | -177.9 | -88.1 | 0 | 0 | 0 | 112 | L133 R139 Q140 E141 | L133-F137 WeakPolarHBondContact O-CB 3.49Å; L133-F137 PolarHBondContact O-N 3.01Å; F137-R139 VanDerWaalsContact C-N 3.32Å; F137-R139 PolarHBondContact O-N 3.22Å; F137-Q140 PolarHBondContact O-N 3.27Å; F137-E141 PolarHBondContact O-N 3.03Å |
| 138 | M | 98.1 | Very high | 98.2 | Very high | 97 Ų | 97 | 111.7 Ų | 111.7 | 48% | 0.478 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.7 | -36.7 | 176.4 | -71.9 | -66 | -59.4 | 0 | 0 | 112.5 | K134 Q135 E136 I142 | K134-M138 VanDerWaalsContact O-CG 3.28Å; K134-M138 WeakPolarHBondContact O-CG 3.43Å; K134-M138 PolarHBondContact O-N 2.83Å; K134-M138 VanDerWaalsContact O-N 3.08Å; Q135-M138 PolarHBondContact O-N 2.69Å; E136-M138 VanDerWaalsContact C-N 3.34Å; E136-M138 PolarHBondContact O-N 2.94Å; M138-I142 WeakPolarHBondContact O-CD1 3.28Å; M138-I142 VanDerWaalsContact O-CG1 3.3Å; M138-I142 WeakPolarHBondContact O-CG1 3.23Å; M138-I142 PolarHBondContact O-N 3.14Å; M138-I142 VanDerWaalsContact O-N 3.14Å |
| 139 | R | 98.4 | Very high | 98.2 | Very high | 143 Ų | 143 | 114.6 Ų | 114.6 | 54% | 0.54 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -64.2 | -47.5 | 173.3 | 179.8 | -163.9 | 172.1 | 92.3 | -4.1 | 111 | Q135 E136 F137 E141 I142 Q143 | Q135-R139 PolarHBondContact O-N 3.04Å; E136-R139 WeakPolarHBondContact O-CB 3.42Å; E136-R139 PolarHBondContact O-N 3.38Å; E136-R139 VanDerWaalsContact O-N 3.15Å; E136-R139 WeakPolarHBondContact OE2-CD 3.28Å; E136-R139 IonicContact OE2-NE 2.69Å; F137-R139 VanDerWaalsContact C-N 3.32Å; F137-R139 PolarHBondContact O-N 3.22Å; R139-E141 PolarHBondContact O-N 3.39Å; R139-I142 WeakPolarHBondContact O-CB 3.42Å; R139-I142 PolarHBondContact O-N 2.98Å; R139-I142 VanDerWaalsContact O-N 3.15Å; R139-Q143 PolarHBondContact O-N 2.84Å |
| 140 | Q | 98.1 | Very high | 98.2 | Very high | 103 Ų | 103 | 115.1 Ų | 115.1 | 48% | 0.481 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -64.1 | -38 | 179.3 | -70 | 175.4 | 12.4 | 0 | 0 | 112 | E136 F137 I142 Q143 L144 | E136-Q140 WeakPolarHBondContact O-CG 3.48Å; E136-Q140 PolarHBondContact O-N 3.38Å; E136-Q140 WeakPolarHBondContact OE1-CG 3.5Å; E136-Q140 PolarHBondContact OE1-NE2 3.47Å; F137-Q140 PolarHBondContact O-N 3.27Å; Q140-I142 VanDerWaalsContact C-N 3.34Å; Q140-I142 PolarHBondContact O-N 3.25Å; Q140-Q143 PolarHBondContact O-N 3.46Å; Q140-L144 WeakPolarHBondContact O-CB 3.36Å; Q140-L144 PolarHBondContact O-N 3.17Å |
| 141 | E | 98.2 | Very high | 98.1 | Very high | 82 Ų | 82 | 112.6 Ų | 112.6 | 38% | 0.383 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -70.6 | -27.1 | 174.3 | -173.5 | 171.8 | 173.2 | 0 | 0 | 113 | F137 R139 R145 | F137-E141 PolarHBondContact O-N 3.03Å; R139-E141 PolarHBondContact O-N 3.39Å; E141-R145 WeakPolarHBondContact O-CB 3.24Å; E141-R145 VanDerWaalsContact O-CG 3.28Å; E141-R145 WeakPolarHBondContact O-CG 3.35Å; E141-R145 PolarHBondContact O-N 2.89Å; E141-R145 PolarHBondContact O-NE 2.89Å |
| 142 | I | 98.3 | Very high | 98.1 | Very high | 95 Ų | 95 | 109.9 Ų | 109.9 | 49% | 0.487 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -66 | -50.4 | 167.7 | -69 | 163.1 | 0 | 0 | 0 | 109.9 | M138 R139 Q140 L144 R145 E146 | M138-I142 WeakPolarHBondContact O-CD1 3.28Å; M138-I142 VanDerWaalsContact O-CG1 3.3Å; M138-I142 WeakPolarHBondContact O-CG1 3.23Å; M138-I142 PolarHBondContact O-N 3.14Å; M138-I142 VanDerWaalsContact O-N 3.14Å; R139-I142 WeakPolarHBondContact O-CB 3.42Å; R139-I142 PolarHBondContact O-N 2.98Å; R139-I142 VanDerWaalsContact O-N 3.15Å; Q140-I142 VanDerWaalsContact C-N 3.34Å; Q140-I142 PolarHBondContact O-N 3.25Å; I142-L144 PolarHBondContact O-N 3.1Å; I142-R145 PolarHBondContact O-N 3.49Å; I142-E146 PolarHBondContact O-N 3.17Å |
| 143 | Q | 98.1 | Very high | 98.1 | Very high | 90 Ų | 90 | 107.6 Ų | 107.6 | 42% | 0.421 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -60.6 | -43.3 | 179.4 | -69.5 | -179.4 | -50.4 | 0 | 0 | 112.5 | R139 Q140 R145 E146 V147 | R139-Q143 PolarHBondContact O-N 2.84Å; Q140-Q143 PolarHBondContact O-N 3.46Å; Q143-R145 VanDerWaalsContact C-N 3.34Å; Q143-R145 PolarHBondContact O-N 3.11Å; Q143-E146 WeakPolarHBondContact O-CB 3.43Å; Q143-E146 PolarHBondContact O-N 2.92Å; Q143-E146 VanDerWaalsContact O-N 3.14Å; Q143-V147 WeakPolarHBondContact O-CG2 3.3Å; Q143-V147 PolarHBondContact O-N 3.34Å |
| 144 | L | 98 | Very high | 98 | Very high | 122 Ų | 122 | 107 Ų | 107 | 64% | 0.639 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -62.2 | -40.2 | 177.5 | -177.3 | 63.3 | 0 | 0 | 0 | 112 | Q140 I142 E146 K148 | Q140-L144 WeakPolarHBondContact O-CB 3.36Å; Q140-L144 PolarHBondContact O-N 3.17Å; I142-L144 PolarHBondContact O-N 3.1Å; L144-E146 VanDerWaalsContact C-N 3.33Å; L144-K148 WeakPolarHBondContact O-CB 3.39Å; L144-K148 PolarHBondContact O-N 2.89Å |
| 145 | R | 97.8 | Very high | 98 | Very high | 122 Ų | 122 | 105.1 Ų | 105.1 | 46% | 0.46 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -69 | -31 | 174.9 | -73.7 | 179.3 | -64.8 | 168.2 | -3.7 | 112.4 | E141 I142 Q143 K149 | E141-R145 WeakPolarHBondContact O-CB 3.24Å; E141-R145 VanDerWaalsContact O-CG 3.28Å; E141-R145 WeakPolarHBondContact O-CG 3.35Å; E141-R145 PolarHBondContact O-N 2.89Å; E141-R145 PolarHBondContact O-NE 2.89Å; I142-R145 PolarHBondContact O-N 3.49Å; Q143-R145 VanDerWaalsContact C-N 3.34Å; Q143-R145 PolarHBondContact O-N 3.11Å; R145-K149 WeakPolarHBondContact O-CD 3.38Å; R145-K149 VanDerWaalsContact O-CG 3.24Å; R145-K149 WeakPolarHBondContact O-CG 3.46Å; R145-K149 PolarHBondContact O-N 2.69Å; R145-K149 VanDerWaalsContact O-N 3.14Å |
| 146 | E | 98 | Very high | 97.9 | Very high | 111 Ų | 111 | 104.7 Ų | 104.7 | 52% | 0.519 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -71.6 | -49 | 173.5 | -177.7 | 162.3 | -139.3 | 0 | 0 | 112 | I142 Q143 L144 K148 K149 N150 | I142-E146 PolarHBondContact O-N 3.17Å; Q143-E146 WeakPolarHBondContact O-CB 3.43Å; Q143-E146 PolarHBondContact O-N 2.92Å; Q143-E146 VanDerWaalsContact O-N 3.14Å; L144-E146 VanDerWaalsContact C-N 3.33Å; E146-K148 VanDerWaalsContact C-N 3.27Å; E146-K148 PolarHBondContact O-N 3.43Å; E146-K149 WeakPolarHBondContact O-CB 3.39Å; E146-K149 PolarHBondContact O-N 3.22Å; E146-N150 VanDerWaalsContact O-CG 3.31Å; E146-N150 PolarHBondContact O-N 3.29Å |
| 147 | V | 97.9 | Very high | 97.9 | Very high | 95 Ų | 95 | 107.2 Ų | 107.2 | 58% | 0.576 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -56.3 | -42 | 173.9 | 171.7 | 0 | 0 | 0 | 0 | 111.1 | Q143 K149 N150 S151 | Q143-V147 WeakPolarHBondContact O-CG2 3.3Å; Q143-V147 PolarHBondContact O-N 3.34Å; V147-K149 PolarHBondContact O-N 2.95Å; V147-N150 PolarHBondContact O-N 2.95Å; V147-S151 VanDerWaalsContact O-CB 3.31Å; V147-S151 WeakPolarHBondContact O-CB 3.41Å; V147-S151 PolarHBondContact O-N 3.28Å |
| 148 | K | 98 | Very high | 97.9 | Very high | 150 Ų | 150 | 107.1 Ų | 107.1 | 65% | 0.652 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -64.2 | -38.4 | 175.7 | -172.4 | 170 | -177.7 | 172.2 | 0 | 113.1 | L144 E146 T152 | L144-K148 WeakPolarHBondContact O-CB 3.39Å; L144-K148 PolarHBondContact O-N 2.89Å; E146-K148 VanDerWaalsContact C-N 3.27Å; E146-K148 PolarHBondContact O-N 3.43Å; K148-T152 WeakPolarHBondContact O-CB 3.37Å; K148-T152 WeakPolarHBondContact O-CG2 3.29Å; K148-T152 PolarHBondContact O-N 3.04Å; K148-T152 VanDerWaalsContact O-N 3.08Å; K148-T152 PolarHBondContact O-OG1 3.33Å |
| 149 | K | 97.9 | Very high | 97.8 | Very high | 144 Ų | 144 | 107.3 Ų | 107.3 | 63% | 0.626 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -66.2 | -41 | 173.4 | -74.2 | 166.5 | -177.5 | 178.5 | 0 | 111.9 | R145 E146 V147 T152 N153 | R145-K149 WeakPolarHBondContact O-CD 3.38Å; R145-K149 VanDerWaalsContact O-CG 3.24Å; R145-K149 WeakPolarHBondContact O-CG 3.46Å; R145-K149 PolarHBondContact O-N 2.69Å; R145-K149 VanDerWaalsContact O-N 3.14Å; E146-K149 WeakPolarHBondContact O-CB 3.39Å; E146-K149 PolarHBondContact O-N 3.22Å; V147-K149 PolarHBondContact O-N 2.95Å; K149-T152 PolarHBondContact O-OG1 3.48Å; K149-N153 VanDerWaalsContact O-CB 3.27Å; K149-N153 WeakPolarHBondContact O-CB 3.35Å; K149-N153 PolarHBondContact O-N 2.84Å |
| 150 | N | 97.9 | Very high | 97.8 | Very high | 98 Ų | 98 | 107.4 Ų | 107.4 | 52% | 0.524 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -70.5 | -43.2 | -178.9 | -67.4 | -15.1 | 0 | 0 | 0 | 111.3 | E146 V147 N153 L154 | E146-N150 VanDerWaalsContact O-CG 3.31Å; E146-N150 PolarHBondContact O-N 3.29Å; V147-N150 PolarHBondContact O-N 2.95Å; N150-N153 WeakPolarHBondContact O-CB 3.5Å; N150-N153 PolarHBondContact O-N 3.38Å; N150-L154 WeakPolarHBondContact O-CB 3.28Å; N150-L154 PolarHBondContact O-N 2.78Å |
| 151 | S | 97.8 | Very high | 97.7 | Very high | 68 Ų | 68 | 107.4 Ų | 107.4 | 48% | 0.476 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -57.6 | -55.4 | 172.7 | 179.1 | 0 | 0 | 0 | 0 | 111.5 | V147 N153 L154 E155 | V147-S151 VanDerWaalsContact O-CB 3.31Å; V147-S151 WeakPolarHBondContact O-CB 3.41Å; V147-S151 PolarHBondContact O-N 3.28Å; S151-N153 PolarHBondContact O-N 2.82Å; S151-N153 VanDerWaalsContact O-N 3.09Å; S151-L154 PolarHBondContact O-N 2.82Å; S151-E155 WeakPolarHBondContact O-CB 3.36Å; S151-E155 PolarHBondContact O-N 2.79Å |
| 152 | T | 97.6 | Very high | 97.6 | Very high | 53 Ų | 53 | 106.6 Ų | 106.6 | 33% | 0.325 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -68.6 | -8.2 | 177.5 | 56.8 | 0 | 0 | 0 | 0 | 114.3 | K148 K149 R156 | K148-T152 WeakPolarHBondContact O-CB 3.37Å; K148-T152 WeakPolarHBondContact O-CG2 3.29Å; K148-T152 PolarHBondContact O-N 3.04Å; K148-T152 VanDerWaalsContact O-N 3.08Å; K148-T152 PolarHBondContact O-OG1 3.33Å; K149-T152 PolarHBondContact O-OG1 3.48Å; T152-R156 VanDerWaalsContact O-CZ 3.24Å; T152-R156 PolarHBondContact O-NE 2.61Å; T152-R156 PolarHBondContact O-NH2 3.29Å |
| 153 | N | 98 | Very high | 97.6 | Very high | 65 Ų | 65 | 107.3 Ų | 107.3 | 35% | 0.348 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -86.9 | -41.8 | 168.6 | -173.2 | -86.9 | 0 | 0 | 0 | 111.4 | K149 N150 S151 K157 | K149-N153 VanDerWaalsContact O-CB 3.27Å; K149-N153 WeakPolarHBondContact O-CB 3.35Å; K149-N153 PolarHBondContact O-N 2.84Å; N150-N153 WeakPolarHBondContact O-CB 3.5Å; N150-N153 PolarHBondContact O-N 3.38Å; S151-N153 PolarHBondContact O-N 2.82Å; S151-N153 VanDerWaalsContact O-N 3.09Å; N153-K157 WeakPolarHBondContact O-CG 3.34Å; N153-K157 PolarHBondContact O-N 3.07Å; N153-K157 WeakPolarHBondContact OD1-CE 3.29Å; N153-K157 PolarHBondContact OD1-NZ 3.04Å |
| 154 | L | 97.6 | Very high | 97.5 | Very high | 115 Ų | 115 | 106.2 Ų | 106.2 | 60% | 0.602 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -66.7 | -42.3 | 175.8 | -177.8 | 62.6 | 0 | 0 | 0 | 111.5 | N150 S151 K157 L158 | N150-L154 WeakPolarHBondContact O-CB 3.28Å; N150-L154 PolarHBondContact O-N 2.78Å; S151-L154 PolarHBondContact O-N 2.82Å; L154-K157 WeakPolarHBondContact O-CB 3.43Å; L154-K157 PolarHBondContact O-N 3.33Å; L154-L158 WeakPolarHBondContact O-CB 3.48Å; L154-L158 PolarHBondContact O-N 3.3Å |
| 155 | E | 97.3 | Very high | 97.4 | Very high | 107 Ų | 107 | 103.3 Ų | 103.3 | 50% | 0.5 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -53.5 | -56.6 | 174.6 | -174.5 | 171.5 | -137.9 | 0 | 0 | 111.1 | S151 K157 L158 E159 | S151-E155 WeakPolarHBondContact O-CB 3.36Å; S151-E155 PolarHBondContact O-N 2.79Å; E155-K157 VanDerWaalsContact C-N 3.27Å; E155-K157 PolarHBondContact O-N 3.34Å; E155-L158 CarbonylContact O-C 3.59Å; E155-L158 PolarHBondContact O-N 3.35Å; E155-E159 WeakPolarHBondContact O-CG 3.35Å; E155-E159 PolarHBondContact O-N 3.31Å |
| 156 | R | 97.6 | Very high | 97.4 | Very high | 140 Ų | 140 | 99 Ų | 99 | 53% | 0.528 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.2 | -26.4 | 177.1 | -76.7 | 177.3 | -67 | 125.7 | 0.1 | 114.9 | T152 E159 Y160 | T152-R156 VanDerWaalsContact O-CZ 3.24Å; T152-R156 PolarHBondContact O-NE 2.61Å; T152-R156 PolarHBondContact O-NH2 3.29Å; R156-E159 WeakPolarHBondContact CA-OE2 3.5Å; R156-E159 WeakPolarHBondContact CG-OE2 3.43Å; R156-Y160 WeakPolarHBondContact O-CB 3.46Å; R156-Y160 PolarHBondContact O-N 3.09Å; R156-Y160 VanDerWaalsContact O-N 3.07Å |
| 157 | K | 97.7 | Very high | 97.3 | Very high | 126 Ų | 126 | 102 Ų | 102 | 55% | 0.548 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -71.5 | -43.5 | 171.3 | -78 | 166 | 170.8 | 163.1 | 0 | 111 | N153 L154 E155 Y160 E161 | N153-K157 WeakPolarHBondContact O-CG 3.34Å; N153-K157 PolarHBondContact O-N 3.07Å; N153-K157 WeakPolarHBondContact OD1-CE 3.29Å; N153-K157 PolarHBondContact OD1-NZ 3.04Å; L154-K157 WeakPolarHBondContact O-CB 3.43Å; L154-K157 PolarHBondContact O-N 3.33Å; E155-K157 VanDerWaalsContact C-N 3.27Å; E155-K157 PolarHBondContact O-N 3.34Å; K157-Y160 PolarHBondContact O-N 3.07Å; K157-E161 WeakPolarHBondContact O-CG 3.33Å; K157-E161 PolarHBondContact O-N 3.14Å |
| 158 | L | 97.2 | Very high | 97.2 | Very high | 123 Ų | 123 | 102.8 Ų | 102.8 | 64% | 0.644 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -68.1 | -37.9 | 177.9 | -171.4 | 144.7 | 0 | 0 | 0 | 111.5 | L154 E155 S162 | L154-L158 WeakPolarHBondContact O-CB 3.48Å; L154-L158 PolarHBondContact O-N 3.3Å; E155-L158 CarbonylContact O-C 3.59Å; E155-L158 PolarHBondContact O-N 3.35Å; L158-S162 VanDerWaalsContact O-CB 3.25Å; L158-S162 WeakPolarHBondContact O-CB 3.43Å; L158-S162 PolarHBondContact O-N 3.43Å; L158-S162 PolarHBondContact O-OG 2.82Å |
| 159 | E | 96.8 | Very high | 97.2 | Very high | 102 Ų | 102 | 100.4 Ų | 100.4 | 48% | 0.477 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -55.9 | -52.3 | 166.7 | -70.8 | 178.4 | 147.6 | 0 | 0 | 111.1 | E155 R156 E161 S162 L163 | E155-E159 WeakPolarHBondContact O-CG 3.35Å; E155-E159 PolarHBondContact O-N 3.31Å; R156-E159 WeakPolarHBondContact CA-OE2 3.5Å; R156-E159 WeakPolarHBondContact CG-OE2 3.43Å; E159-E161 PolarHBondContact O-N 3.22Å; E159-S162 PolarHBondContact O-N 2.89Å; E159-S162 PolarHBondContact O-OG 3.26Å; E159-L163 WeakPolarHBondContact O-CB 3.36Å; E159-L163 VanDerWaalsContact O-CG 3.31Å; E159-L163 WeakPolarHBondContact O-CG 3.42Å; E159-L163 PolarHBondContact O-N 3.5Å |
| 160 | Y | 98.1 | Very high | 97.1 | Very high | 145 Ų | 145 | 97.4 Ų | 97.4 | 57% | 0.569 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -58.5 | -49.4 | 179.3 | -177.5 | -93.3 | 0 | 0 | 0 | 112.6 | R156 K157 S162 L163 Q164 | R156-Y160 WeakPolarHBondContact O-CB 3.46Å; R156-Y160 PolarHBondContact O-N 3.09Å; R156-Y160 VanDerWaalsContact O-N 3.07Å; K157-Y160 PolarHBondContact O-N 3.07Å; Y160-S162 PolarHBondContact O-N 3.14Å; Y160-L163 PolarHBondContact O-N 3.18Å; Y160-Q164 WeakPolarHBondContact O-CB 3.31Å; Y160-Q164 PolarHBondContact O-N 3.08Å |
| 161 | E | 96.9 | Very high | 97 | Very high | 102 Ų | 102 | 98.2 Ų | 98.2 | 48% | 0.477 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -65.2 | -36.9 | 177.8 | -69.2 | -59.6 | 153 | 0 | 0 | 112.1 | K157 E159 Q164 C165 | K157-E161 WeakPolarHBondContact O-CG 3.33Å; K157-E161 PolarHBondContact O-N 3.14Å; E159-E161 PolarHBondContact O-N 3.22Å; E161-Q164 PolarHBondContact O-N 3.05Å; E161-Q164 PolarHBondContact OE2-NE2 3.49Å; E161-C165 VanDerWaalsContact O-CB 3.25Å; E161-C165 WeakPolarHBondContact O-CB 3.41Å; E161-C165 PolarHBondContact O-N 3.41Å |
| 162 | S | 95.8 | Very high | 96.9 | Very high | 66 Ų | 66 | 99.3 Ų | 99.3 | 46% | 0.462 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -66.2 | -37.3 | 174.5 | 72.7 | 0 | 0 | 0 | 0 | 112.5 | L158 E159 Y160 G166 | L158-S162 VanDerWaalsContact O-CB 3.25Å; L158-S162 WeakPolarHBondContact O-CB 3.43Å; L158-S162 PolarHBondContact O-N 3.43Å; L158-S162 PolarHBondContact O-OG 2.82Å; E159-S162 PolarHBondContact O-N 2.89Å; E159-S162 PolarHBondContact O-OG 3.26Å; Y160-S162 PolarHBondContact O-N 3.14Å; S162-G166 PolarHBondContact O-N 3.26Å |
| 163 | L | 97.1 | Very high | 96.8 | Very high | 109 Ų | 109 | 102.2 Ų | 102.2 | 57% | 0.571 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -71.3 | -33 | 174.4 | -70.9 | 169.2 | 0 | 0 | 0 | 111.9 | E159 Y160 R167 | E159-L163 WeakPolarHBondContact O-CB 3.36Å; E159-L163 VanDerWaalsContact O-CG 3.31Å; E159-L163 WeakPolarHBondContact O-CG 3.42Å; E159-L163 PolarHBondContact O-N 3.5Å; Y160-L163 PolarHBondContact O-N 3.18Å; L163-R167 WeakPolarHBondContact O-CD 3.26Å; L163-R167 WeakPolarHBondContact O-CG 3.43Å; L163-R167 PolarHBondContact O-N 3.18Å; L163-R167 VanDerWaalsContact O-N 3.08Å |
| 164 | Q | 96.6 | Very high | 96.7 | Very high | 68 Ų | 68 | 103.6 Ų | 103.6 | 32% | 0.318 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -68.2 | -50.1 | 173.5 | -178.8 | 169.8 | -92.8 | 0 | 0 | 111.1 | Y160 E161 G166 R167 Q168 | Y160-Q164 WeakPolarHBondContact O-CB 3.31Å; Y160-Q164 PolarHBondContact O-N 3.08Å; E161-Q164 PolarHBondContact O-N 3.05Å; E161-Q164 PolarHBondContact OE2-NE2 3.49Å; Q164-G166 PolarHBondContact O-N 2.92Å; Q164-R167 PolarHBondContact O-N 3.08Å; Q164-Q168 WeakPolarHBondContact O-CG 3.32Å; Q164-Q168 PolarHBondContact O-N 3.23Å |
| 165 | C | 96.4 | Very high | 96.6 | Very high | 61 Ų | 61 | 103.9 Ų | 103.9 | 41% | 0.412 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -60.1 | -44.2 | 174.9 | -177.2 | 0 | 0 | 0 | 0 | 111.6 | E161 R167 Q168 I169 | E161-C165 VanDerWaalsContact O-CB 3.25Å; E161-C165 WeakPolarHBondContact O-CB 3.41Å; E161-C165 PolarHBondContact O-N 3.41Å; C165-R167 PolarHBondContact O-N 2.86Å; C165-Q168 PolarHBondContact O-N 3.28Å; C165-I169 WeakPolarHBondContact O-CG1 3.24Å; C165-I169 PolarHBondContact O-N 2.88Å |
| 166 | G | 96.8 | Very high | 96.4 | Very high | 31 Ų | 31 | 106.2 Ų | 106.2 | 32% | 0.32 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -58.5 | -43.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | S162 Q164 I169 T170 | S162-G166 PolarHBondContact O-N 3.26Å; Q164-G166 PolarHBondContact O-N 2.92Å; G166-I169 PolarHBondContact O-N 3.48Å; G166-T170 PolarHBondContact O-N 2.9Å; G166-T170 PolarHBondContact O-OG1 2.93Å |
| 167 | R | 96.4 | Very high | 96.3 | Very high | 175 Ų | 175 | 103.1 Ų | 103.1 | 66% | 0.66 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -62.9 | -44.2 | 173.8 | -72.4 | 162.9 | -171.8 | -109.3 | 2.5 | 112.1 | L163 Q164 C165 I169 T170 Q171 | L163-R167 WeakPolarHBondContact O-CD 3.26Å; L163-R167 WeakPolarHBondContact O-CG 3.43Å; L163-R167 PolarHBondContact O-N 3.18Å; L163-R167 VanDerWaalsContact O-N 3.08Å; Q164-R167 PolarHBondContact O-N 3.08Å; C165-R167 PolarHBondContact O-N 2.86Å; R167-I169 VanDerWaalsContact C-N 3.34Å; R167-I169 PolarHBondContact O-N 3.27Å; R167-T170 PolarHBondContact O-N 2.92Å; R167-Q171 WeakPolarHBondContact O-CB 3.26Å; R167-Q171 VanDerWaalsContact O-CG 3.29Å; R167-Q171 WeakPolarHBondContact O-CG 3.44Å; R167-Q171 PolarHBondContact O-N 2.9Å |
| 168 | Q | 96.6 | Very high | 96.1 | Very high | 110 Ų | 110 | 103.3 Ų | 103.3 | 51% | 0.514 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -61.3 | -42.4 | 177.3 | -73.5 | 171.7 | -18.4 | 0 | 0 | 111.4 | Q164 C165 Q171 L172 | Q164-Q168 WeakPolarHBondContact O-CG 3.32Å; Q164-Q168 PolarHBondContact O-N 3.23Å; C165-Q168 PolarHBondContact O-N 3.28Å; Q168-Q171 PolarHBondContact O-N 3.01Å; Q168-L172 WeakPolarHBondContact O-CB 3.5Å; Q168-L172 PolarHBondContact O-N 3.4Å |
| 169 | I | 97 | Very high | 95.9 | Very high | 100 Ų | 100 | 100 Ų | 100 | 51% | 0.513 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -62.5 | -46 | 175.4 | -68.9 | 165.1 | 0 | 0 | 0 | 110.7 | C165 G166 R167 L172 M173 | C165-I169 WeakPolarHBondContact O-CG1 3.24Å; C165-I169 PolarHBondContact O-N 2.88Å; G166-I169 PolarHBondContact O-N 3.48Å; R167-I169 VanDerWaalsContact C-N 3.34Å; R167-I169 PolarHBondContact O-N 3.27Å; I169-L172 PolarHBondContact O-N 3.27Å; I169-M173 HydrophobicContact CG2-CG 4.36Å; I169-M173 WeakPolarHBondContact O-CB 3.3Å; I169-M173 VanDerWaalsContact O-CG 3.23Å; I169-M173 WeakPolarHBondContact O-CG 3.32Å; I169-M173 PolarHBondContact O-N 3.41Å |
| 170 | T | 96.2 | Very high | 95.7 | Very high | 81 Ų | 81 | 99.9 Ų | 99.9 | 50% | 0.497 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -61.1 | -46.4 | 176.4 | -57.3 | 0 | 0 | 0 | 0 | 111.7 | G166 R167 L172 M173 D174 | G166-T170 PolarHBondContact O-N 2.9Å; G166-T170 PolarHBondContact O-OG1 2.93Å; R167-T170 PolarHBondContact O-N 2.92Å; T170-L172 PolarHBondContact O-N 2.85Å; T170-M173 WeakPolarHBondContact O-CB 3.28Å; T170-M173 PolarHBondContact O-N 2.75Å; T170-D174 PolarHBondContact O-N 2.69Å |
| 171 | Q | 95.8 | Very high | 95.5 | Very high | 116 Ų | 116 | 98 Ų | 98 | 54% | 0.542 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -58.5 | -46.3 | 177.4 | -73.6 | 172.3 | -43.3 | 0 | 0 | 111.8 | R167 Q168 M173 D174 E175 | R167-Q171 WeakPolarHBondContact O-CB 3.26Å; R167-Q171 VanDerWaalsContact O-CG 3.29Å; R167-Q171 WeakPolarHBondContact O-CG 3.44Å; R167-Q171 PolarHBondContact O-N 2.9Å; Q168-Q171 PolarHBondContact O-N 3.01Å; Q171-M173 VanDerWaalsContact C-N 3.33Å; Q171-M173 PolarHBondContact O-N 2.83Å; Q171-D174 PolarHBondContact O-N 2.67Å; Q171-E175 WeakPolarHBondContact O-CG 3.49Å; Q171-E175 PolarHBondContact O-N 2.76Å |
| 172 | L | 96.5 | Very high | 95.2 | Very high | 90 Ų | 90 | 97 Ų | 97 | 47% | 0.471 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -65.5 | -36.5 | 178.1 | -143.6 | 75.1 | 0 | 0 | 0 | 111.8 | Q168 I169 T170 Y176 | Q168-L172 WeakPolarHBondContact O-CB 3.5Å; Q168-L172 PolarHBondContact O-N 3.4Å; I169-L172 PolarHBondContact O-N 3.27Å; T170-L172 PolarHBondContact O-N 2.85Å; L172-Y176 HydrophobicContact CD2-CE2 3.97Å; L172-Y176 HydrophobicContact CG-CD2 4.26Å; L172-Y176 HydrophobicContact CG-CE2 3.92Å; L172-Y176 WeakPolarHBondContact O-CB 3.34Å; L172-Y176 WeakPolarHBondContact O-CD2 3.44Å; L172-Y176 PolarHBondContact O-N 3.15Å |
| 173 | M | 95.4 | Very high | 94.9 | Very high | 114 Ų | 114 | 98.9 Ų | 98.9 | 56% | 0.562 | 50% | 0.495 | S | S | * | . | H | α-helix | trans | -66.1 | -42 | 174.6 | -76.2 | -67.8 | -59.2 | 0 | 0 | 112.4 | I169 T170 Q171 Y176 E177 | I169-M173 HydrophobicContact CG2-CG 4.36Å; I169-M173 WeakPolarHBondContact O-CB 3.3Å; I169-M173 VanDerWaalsContact O-CG 3.23Å; I169-M173 WeakPolarHBondContact O-CG 3.32Å; I169-M173 PolarHBondContact O-N 3.41Å; T170-M173 WeakPolarHBondContact O-CB 3.28Å; T170-M173 PolarHBondContact O-N 2.75Å; Q171-M173 VanDerWaalsContact C-N 3.33Å; Q171-M173 PolarHBondContact O-N 2.83Å; M173-Y176 PolarHBondContact O-N 2.99Å; M173-E177 WeakPolarHBondContact O-CB 3.47Å; M173-E177 PolarHBondContact O-N 3.46Å |
| 174 | D | 95.6 | Very high | 94.5 | Very high | 94 Ų | 94 | 98.7 Ų | 98.7 | 50% | 0.503 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.2 | -46 | 175 | -69.6 | -33.1 | 0 | 0 | 0 | 110.4 | T170 Q171 Y176 E177 E178 | T170-D174 PolarHBondContact O-N 2.69Å; Q171-D174 PolarHBondContact O-N 2.67Å; D174-Y176 PolarHBondContact O-N 2.87Å; D174-E177 PolarHBondContact O-N 2.99Å; D174-E178 WeakPolarHBondContact O-CG 3.25Å; D174-E178 PolarHBondContact O-N 3.47Å |
| 175 | E | 94.8 | Very high | 94.1 | Very high | 121 Ų | 121 | 102 Ų | 102 | 57% | 0.565 | 51% | 0.507 | S | S | * | . | H | α-helix | trans | -57.9 | -43.7 | 173.6 | -74 | 174 | -169.7 | 0 | 0 | 112.2 | Q171 E178 A179 | Q171-E175 WeakPolarHBondContact O-CG 3.49Å; Q171-E175 PolarHBondContact O-N 2.76Å; E175-E178 PolarHBondContact O-N 3.45Å; E175-A179 VanDerWaalsContact O-CB 3.29Å; E175-A179 WeakPolarHBondContact O-CB 3.36Å; E175-A179 PolarHBondContact O-N 3.4Å |
| 176 | Y | 94.1 | Very high | 93.6 | Very high | 157 Ų | 157 | 104.5 Ų | 104.5 | 62% | 0.616 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -66.6 | -38.2 | 175.5 | -84.1 | -58.7 | 0 | 0 | 0 | 112.8 | L172 M173 D174 K180 | L172-Y176 HydrophobicContact CD2-CE2 3.97Å; L172-Y176 HydrophobicContact CG-CD2 4.26Å; L172-Y176 HydrophobicContact CG-CE2 3.92Å; L172-Y176 WeakPolarHBondContact O-CB 3.34Å; L172-Y176 WeakPolarHBondContact O-CD2 3.44Å; L172-Y176 PolarHBondContact O-N 3.15Å; M173-Y176 PolarHBondContact O-N 2.99Å; D174-Y176 PolarHBondContact O-N 2.87Å; Y176-K180 WeakPolarHBondContact O-CB 3.48Å; Y176-K180 PolarHBondContact O-N 3.47Å |
| 177 | E | 94.6 | Very high | 93 | Very high | 75 Ų | 75 | 106 Ų | 106 | 35% | 0.35 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -70.5 | -34.3 | 177.7 | -167.1 | 85.2 | -104.1 | 0 | 0 | 111.2 | M173 D174 K180 K181 | M173-E177 WeakPolarHBondContact O-CB 3.47Å; M173-E177 PolarHBondContact O-N 3.46Å; D174-E177 PolarHBondContact O-N 2.99Å; E177-K180 IonicContact OE1-NZ 2.68Å; E177-K180 PolarHBondContact OE1-NZ 3.41Å; E177-K181 HydrophobicContact CG-CD 4.5Å; E177-K181 VanDerWaalsContact CG-NZ 3.28Å; E177-K181 WeakPolarHBondContact O-CB 3.37Å; E177-K181 WeakPolarHBondContact O-CD 3.33Å; E177-K181 WeakPolarHBondContact O-CG 3.48Å; E177-K181 PolarHBondContact O-N 2.84Å |
| 178 | E | 93.3 | Very high | 92.5 | Very high | 130 Ų | 130 | 102.2 Ų | 102.2 | 61% | 0.607 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -70.4 | -43.8 | 171.2 | -72 | -169.8 | 172.7 | 0 | 0 | 112.6 | D174 E175 K180 K181 T182 | D174-E178 WeakPolarHBondContact O-CG 3.25Å; D174-E178 PolarHBondContact O-N 3.47Å; E175-E178 PolarHBondContact O-N 3.45Å; E178-K180 VanDerWaalsContact C-N 3.27Å; E178-K180 PolarHBondContact O-N 3.43Å; E178-K181 PolarHBondContact O-N 3.17Å; E178-T182 WeakPolarHBondContact O-CG2 3.5Å; E178-T182 PolarHBondContact O-N 3.42Å; E178-T182 PolarHBondContact O-OG1 2.82Å |
| 179 | A | 92.4 | Very high | 91.9 | Very high | 54 Ų | 54 | 103.6 Ų | 103.6 | 45% | 0.446 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -61.1 | -36.9 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | E175 T182 L183 | E175-A179 VanDerWaalsContact O-CB 3.29Å; E175-A179 WeakPolarHBondContact O-CB 3.36Å; E175-A179 PolarHBondContact O-N 3.4Å; A179-T182 WeakPolarHBondContact CA-OG1 3.43Å; A179-T182 PolarHBondContact O-OG1 3.31Å; A179-T182 VanDerWaalsContact O-OG1 3.07Å; A179-L183 VanDerWaalsContact O-CB 3.28Å; A179-L183 WeakPolarHBondContact O-CB 3.46Å; A179-L183 PolarHBondContact O-N 2.91Å |
| 180 | K | 93.4 | Very high | 91 | Very high | 99 Ų | 99 | 104.4 Ų | 104.4 | 43% | 0.43 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -67.6 | -48.8 | 173.4 | 174.1 | -174.4 | 152.6 | -148.5 | 0 | 112.1 | Y176 E177 E178 T182 L183 E184 | Y176-K180 WeakPolarHBondContact O-CB 3.48Å; Y176-K180 PolarHBondContact O-N 3.47Å; E177-K180 IonicContact OE1-NZ 2.68Å; E177-K180 PolarHBondContact OE1-NZ 3.41Å; E178-K180 VanDerWaalsContact C-N 3.27Å; E178-K180 PolarHBondContact O-N 3.43Å; K180-T182 PolarHBondContact O-N 3.48Å; K180-L183 PolarHBondContact O-N 3.16Å; K180-E184 WeakPolarHBondContact CE-OE1 3.28Å; K180-E184 WeakPolarHBondContact CG-OE1 3.29Å; K180-E184 WeakPolarHBondContact O-CB 3.26Å; K180-E184 WeakPolarHBondContact O-CG 3.3Å; K180-E184 PolarHBondContact O-N 3.33Å |
| 181 | K | 93.1 | Very high | 90.1 | Very high | 106 Ų | 106 | 108.8 Ų | 108.8 | 46% | 0.461 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -59.5 | -45.2 | 177.7 | -73.8 | 159.5 | -172 | 148.5 | 0 | 111.8 | E177 E178 E184 E185 | E177-K181 HydrophobicContact CG-CD 4.5Å; E177-K181 VanDerWaalsContact CG-NZ 3.28Å; E177-K181 WeakPolarHBondContact O-CB 3.37Å; E177-K181 WeakPolarHBondContact O-CD 3.33Å; E177-K181 WeakPolarHBondContact O-CG 3.48Å; E177-K181 PolarHBondContact O-N 2.84Å; E178-K181 PolarHBondContact O-N 3.17Å; K181-E184 PolarHBondContact O-N 2.76Å; K181-E185 WeakPolarHBondContact O-CG 3.4Å; K181-E185 PolarHBondContact O-N 2.92Å |
| 182 | T | 90.5 | Very high | 89.2 | Confident | 79 Ų | 79 | 109.8 Ų | 109.8 | 49% | 0.485 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -64.6 | -40.2 | 177.6 | 48.3 | 0 | 0 | 0 | 0 | 111.7 | E178 A179 K180 E185 E186 | E178-T182 WeakPolarHBondContact O-CG2 3.5Å; E178-T182 PolarHBondContact O-N 3.42Å; E178-T182 PolarHBondContact O-OG1 2.82Å; A179-T182 WeakPolarHBondContact CA-OG1 3.43Å; A179-T182 PolarHBondContact O-OG1 3.31Å; A179-T182 VanDerWaalsContact O-OG1 3.07Å; K180-T182 PolarHBondContact O-N 3.48Å; T182-E185 PolarHBondContact O-N 3.27Å; T182-E186 WeakPolarHBondContact O-CG 3.49Å; T182-E186 PolarHBondContact O-N 3.03Å |
| 183 | L | 89.5 | Confident | 88 | Confident | 107 Ų | 107 | 108.3 Ų | 108.3 | 56% | 0.56 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -64.4 | -39.4 | 171.9 | -176.4 | 63.8 | 0 | 0 | 0 | 112.7 | A179 K180 E186 V187 | A179-L183 VanDerWaalsContact O-CB 3.28Å; A179-L183 WeakPolarHBondContact O-CB 3.46Å; A179-L183 PolarHBondContact O-N 2.91Å; K180-L183 PolarHBondContact O-N 3.16Å; L183-E186 PolarHBondContact O-N 2.83Å; L183-V187 WeakPolarHBondContact O-CB 3.32Å; L183-V187 VanDerWaalsContact O-CG2 3.27Å; L183-V187 WeakPolarHBondContact O-CG2 3.4Å; L183-V187 PolarHBondContact O-N 2.91Å |
| 184 | E | 89.6 | Confident | 86.8 | Confident | 104 Ų | 104 | 106.9 Ų | 106.9 | 49% | 0.486 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -64.2 | -41.7 | 174.2 | -75.7 | 175.6 | -168 | 0 | 0 | 111.5 | K180 K181 V187 V188 | K180-E184 WeakPolarHBondContact CE-OE1 3.28Å; K180-E184 WeakPolarHBondContact CG-OE1 3.29Å; K180-E184 WeakPolarHBondContact O-CB 3.26Å; K180-E184 WeakPolarHBondContact O-CG 3.3Å; K180-E184 PolarHBondContact O-N 3.33Å; K181-E184 PolarHBondContact O-N 2.76Å; E184-V187 PolarHBondContact O-N 3.47Å; E184-V188 WeakPolarHBondContact O-CB 3.1Å; E184-V188 WeakPolarHBondContact O-CG2 3.19Å; E184-V188 PolarHBondContact O-N 3.27Å |
| 185 | E | 88 | Confident | 85.2 | Confident | 139 Ų | 139 | 108 Ų | 108 | 65% | 0.65 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -62.6 | -43.6 | 172.5 | -75.5 | -176.8 | -168.4 | 0 | 0 | 112.1 | K181 T182 V188 K189 | K181-E185 WeakPolarHBondContact O-CG 3.4Å; K181-E185 PolarHBondContact O-N 2.92Å; T182-E185 PolarHBondContact O-N 3.27Å; E185-V188 PolarHBondContact O-N 3.5Å; E185-K189 WeakPolarHBondContact O-CB 3.49Å; E185-K189 PolarHBondContact O-N 3.32Å |
| 186 | E | 86.1 | Confident | 83.4 | Confident | 113 Ų | 113 | 107.4 Ų | 107.4 | 53% | 0.528 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -64.3 | -40 | 174.6 | -71 | -142.9 | 128.8 | 0 | 0 | 112.1 | T182 L183 K189 L190 | T182-E186 WeakPolarHBondContact O-CG 3.49Å; T182-E186 PolarHBondContact O-N 3.03Å; L183-E186 PolarHBondContact O-N 2.83Å; E186-K189 WeakPolarHBondContact O-CB 3.21Å; E186-K189 PolarHBondContact O-N 3.1Å; E186-L190 WeakPolarHBondContact O-CB 3.46Å; E186-L190 PolarHBondContact O-N 3.38Å |
| 187 | V | 84.9 | Confident | 81.4 | Confident | 62 Ų | 62 | 104 Ų | 104 | 38% | 0.376 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -65.6 | -38.4 | 174.2 | 167 | 0 | 0 | 0 | 0 | 111.4 | L183 E184 R191 | L183-V187 WeakPolarHBondContact O-CB 3.32Å; L183-V187 VanDerWaalsContact O-CG2 3.27Å; L183-V187 WeakPolarHBondContact O-CG2 3.4Å; L183-V187 PolarHBondContact O-N 2.91Å; E184-V187 PolarHBondContact O-N 3.47Å; V187-R191 HydrophobicContact CG1-CG 4.46Å; V187-R191 VanDerWaalsContact O-CB 3.28Å; V187-R191 WeakPolarHBondContact O-CB 3.4Å; V187-R191 WeakPolarHBondContact O-CG 3.43Å; V187-R191 PolarHBondContact O-N 2.86Å |
| 188 | V | 85 | Confident | 79.2 | Confident | 95 Ų | 95 | 109.7 Ų | 109.7 | 58% | 0.576 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -66.8 | -40.2 | 173.2 | 167.9 | 0 | 0 | 0 | 0 | 111.1 | E184 E185 R191 K192 | E184-V188 WeakPolarHBondContact O-CB 3.1Å; E184-V188 WeakPolarHBondContact O-CG2 3.19Å; E184-V188 PolarHBondContact O-N 3.27Å; E185-V188 PolarHBondContact O-N 3.5Å; V188-R191 PolarHBondContact O-N 2.81Å; V188-K192 WeakPolarHBondContact O-CB 3.34Å; V188-K192 PolarHBondContact O-N 3.43Å |
| 189 | K | 83.4 | Confident | 76.5 | Confident | 140 Ų | 140 | 112.9 Ų | 112.9 | 61% | 0.609 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -65 | -41.8 | 176 | -175.7 | -178.5 | 176.8 | -171.1 | 0 | 111.9 | E185 E186 K192 S193 | E185-K189 WeakPolarHBondContact O-CB 3.49Å; E185-K189 PolarHBondContact O-N 3.32Å; E186-K189 WeakPolarHBondContact O-CB 3.21Å; E186-K189 PolarHBondContact O-N 3.1Å; K189-K192 PolarHBondContact O-N 2.95Å; K189-S193 PolarHBondContact O-N 2.83Å; K189-S193 PolarHBondContact O-OG 2.78Å |
| 190 | L | 78.7 | Confident | 73.8 | Confident | 117 Ų | 117 | 114.2 Ų | 114.2 | 61% | 0.613 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -66.9 | -42.9 | 171.7 | -114.8 | 72.4 | 0 | 0 | 0 | 112 | E186 K192 S193 V194 | E186-L190 WeakPolarHBondContact O-CB 3.46Å; E186-L190 PolarHBondContact O-N 3.38Å; L190-K192 VanDerWaalsContact C-N 3.26Å; L190-K192 PolarHBondContact O-N 3.4Å; L190-S193 PolarHBondContact O-N 3.41Å; L190-S193 PolarHBondContact O-OG 2.81Å; L190-S193 VanDerWaalsContact O-OG 3.05Å; L190-V194 VanDerWaalsContact O-CB 3.29Å; L190-V194 WeakPolarHBondContact O-CB 3.37Å; L190-V194 VanDerWaalsContact O-CG2 3.24Å; L190-V194 WeakPolarHBondContact O-CG2 3.39Å; L190-V194 PolarHBondContact O-N 2.91Å |
| 191 | R | 77.9 | Confident | 70.7 | Confident | 172 Ų | 172 | 113 Ų | 113 | 65% | 0.649 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -62.1 | -36.3 | 174.8 | -77.8 | 173.3 | 178.4 | -157.8 | 1.2 | 111.5 | V187 V188 L195 | V187-R191 HydrophobicContact CG1-CG 4.46Å; V187-R191 VanDerWaalsContact O-CB 3.28Å; V187-R191 WeakPolarHBondContact O-CB 3.4Å; V187-R191 WeakPolarHBondContact O-CG 3.43Å; V187-R191 PolarHBondContact O-N 2.86Å; V188-R191 PolarHBondContact O-N 2.81Å; R191-L195 WeakPolarHBondContact O-CB 3.43Å; R191-L195 VanDerWaalsContact O-CG 3.26Å; R191-L195 WeakPolarHBondContact O-CG 3.31Å; R191-L195 PolarHBondContact O-N 2.96Å |
| 192 | K | 75.8 | Confident | 67.6 | Low | 137 Ų | 137 | 112.6 Ų | 112.6 | 60% | 0.596 | 60% | 0.603 | S | S | * | * | H | α-helix | trans | -68.1 | -49.3 | 175.3 | -171.6 | 173.3 | -179.8 | 179.3 | 0 | 111.6 | V188 K189 L190 V194 L195 D196 | V188-K192 WeakPolarHBondContact O-CB 3.34Å; V188-K192 PolarHBondContact O-N 3.43Å; K189-K192 PolarHBondContact O-N 2.95Å; L190-K192 VanDerWaalsContact C-N 3.26Å; L190-K192 PolarHBondContact O-N 3.4Å; K192-V194 VanDerWaalsContact C-N 3.3Å; K192-V194 PolarHBondContact O-N 2.92Å; K192-L195 PolarHBondContact O-N 2.85Å; K192-L195 VanDerWaalsContact O-N 3.1Å; K192-D196 PolarHBondContact O-N 3.37Å |
| 193 | S | 71.8 | Confident | 64.8 | Low | 59 Ų | 59 | 113.3 Ų | 113.3 | 41% | 0.413 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -62.9 | -36.1 | 175.8 | 62.9 | 0 | 0 | 0 | 0 | 112.4 | K189 L190 D196 S197 | K189-S193 PolarHBondContact O-N 2.83Å; K189-S193 PolarHBondContact O-OG 2.78Å; L190-S193 PolarHBondContact O-N 3.41Å; L190-S193 PolarHBondContact O-OG 2.81Å; L190-S193 VanDerWaalsContact O-OG 3.05Å; S193-D196 PolarHBondContact O-N 3.41Å; S193-S197 WeakPolarHBondContact O-CB 3.44Å; S193-S197 PolarHBondContact O-N 2.9Å; S193-S197 PolarHBondContact O-OG 3.26Å |
| 194 | V | 71.1 | Confident | 61.9 | Low | 84 Ų | 84 | 117.3 Ų | 117.3 | 51% | 0.509 | 63% | 0.633 | S | S | . | * | H | α-helix | trans | -65.4 | -38.9 | 171.6 | 167.3 | 0 | 0 | 0 | 0 | 112 | L190 K192 S197 R198 | L190-V194 VanDerWaalsContact O-CB 3.29Å; L190-V194 WeakPolarHBondContact O-CB 3.37Å; L190-V194 VanDerWaalsContact O-CG2 3.24Å; L190-V194 WeakPolarHBondContact O-CG2 3.39Å; L190-V194 PolarHBondContact O-N 2.91Å; K192-V194 VanDerWaalsContact C-N 3.3Å; K192-V194 PolarHBondContact O-N 2.92Å; V194-S197 PolarHBondContact O-N 3.43Å; V194-R198 VanDerWaalsContact O-CB 3.23Å; V194-R198 WeakPolarHBondContact O-CB 3.31Å; V194-R198 PolarHBondContact O-N 2.85Å |
| 195 | L | 60.4 | Low | 59 | Low | 118 Ų | 118 | 116.1 Ų | 116.1 | 62% | 0.618 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -68.2 | -39.7 | 174.8 | -79.9 | 165.4 | 0 | 0 | 0 | 112.2 | R191 K192 S197 R198 K199 | R191-L195 WeakPolarHBondContact O-CB 3.43Å; R191-L195 VanDerWaalsContact O-CG 3.26Å; R191-L195 WeakPolarHBondContact O-CG 3.31Å; R191-L195 PolarHBondContact O-N 2.96Å; K192-L195 PolarHBondContact O-N 2.85Å; K192-L195 VanDerWaalsContact O-N 3.1Å; L195-S197 VanDerWaalsContact C-N 3.35Å; L195-R198 PolarHBondContact O-N 2.94Å; L195-K199 PolarHBondContact O-N 3.3Å |
| 196 | D | 57.4 | Low | 56.1 | Low | 108 Ų | 108 | 113 Ų | 113 | 58% | 0.578 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -65.1 | -38.3 | 173.3 | -69.5 | -38 | 0 | 0 | 0 | 110.9 | K192 S193 | K192-D196 PolarHBondContact O-N 3.37Å; S193-D196 PolarHBondContact O-N 3.41Å |
| 197 | S | 51.9 | Low | 53.5 | Low | 86 Ų | 86 | 113.4 Ų | 113.4 | 60% | 0.601 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -64.9 | -40.8 | 169.5 | -62.2 | 0 | 0 | 0 | 0 | 112.9 | S193 V194 L195 K199 A200 | S193-S197 WeakPolarHBondContact O-CB 3.44Å; S193-S197 PolarHBondContact O-N 2.9Å; S193-S197 PolarHBondContact O-OG 3.26Å; V194-S197 PolarHBondContact O-N 3.43Å; L195-S197 VanDerWaalsContact C-N 3.35Å; S197-K199 PolarHBondContact O-N 2.98Å; S197-K199 VanDerWaalsContact O-N 3.11Å; S197-A200 PolarHBondContact O-N 2.94Å |
| 198 | R | 48.6 | Very low | 50.9 | Low | 195 Ų | 195 | 119 Ų | 119 | 74% | 0.736 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -73.5 | 1.2 | -177.6 | -153.6 | 174.5 | -164.1 | 177.8 | 5.8 | 113.6 | V194 L195 A200 | V194-R198 VanDerWaalsContact O-CB 3.23Å; V194-R198 WeakPolarHBondContact O-CB 3.31Å; V194-R198 PolarHBondContact O-N 2.85Å; L195-R198 PolarHBondContact O-N 2.94Å; R198-A200 PolarHBondContact O-N 3.44Å |
| 199 | K | 37.3 | Very low | 48.4 | Very low | 196 Ų | 196 | 120.5 Ų | 120.5 | 85% | 0.852 | 70% | 0.695 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.9 | 0.7 | 164.5 | -143.4 | 172.2 | -174.7 | 175.8 | 0 | 113.1 | L195 S197 | L195-K199 PolarHBondContact O-N 3.3Å; S197-K199 PolarHBondContact O-N 2.98Å; S197-K199 VanDerWaalsContact O-N 3.11Å |
| 200 | A | 34.7 | Very low | 46.2 | Very low | 83 Ų | 83 | 122 Ų | 122 | 69% | 0.686 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -129.9 | 121.1 | 163.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | S197 R198 | S197-A200 PolarHBondContact O-N 2.94Å; R198-A200 PolarHBondContact O-N 3.44Å |
| 201 | G | 29.6 | Very low | 44 | Very low | 72 Ų | 72 | 121.9 Ų | 121.9 | 74% | 0.742 | 71% | 0.709 | S | S | * | * | trans | 105.4 | 136.6 | 173.5 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 202 | A | 27.8 | Very low | 42.1 | Very low | 98 Ų | 98 | 118.8 Ų | 118.8 | 81% | 0.81 | 72% | 0.72 | S | S | * | * | trans | -149.5 | 162.6 | 179.1 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 203 | A | 31.8 | Very low | 40.1 | Very low | 94 Ų | 94 | 115.6 Ų | 115.6 | 78% | 0.777 | 73% | 0.726 | S | S | * | * | trans | 68.1 | 155.2 | 174.1 | 0 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 204 | E | 28.4 | Very low | 38.2 | Very low | 192 Ų | 192 | 122.2 Ų | 122.2 | 90% | 0.897 | 75% | 0.75 | S | S | * | * | cis | -163 | 171.8 | -22.4 | -116.2 | -173.3 | 172.2 | 0 | 0 | 110.8 | ||||
| 205 | G | 27.6 | Very low | 36.3 | Very low | 79 Ų | 79 | 127 Ų | 127 | 81% | 0.814 | 77% | 0.767 | S | S | * | * | trans | 83.7 | 152.2 | 170.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 206 | G | 27.6 | Very low | 35.6 | Very low | 73 Ų | 73 | 126.6 Ų | 126.6 | 75% | 0.753 | 77% | 0.771 | S | S | * | * | cis | 108.1 | 134.9 | 2.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 207 | T | 31.3 | Very low | 34.3 | Very low | 121 Ų | 121 | 127 Ų | 127 | 74% | 0.742 | 78% | 0.778 | S | S | * | * | cis | -166.1 | 150.3 | 0.8 | -52.9 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 208 | E | 30.3 | Very low | 33.4 | Very low | 181 Ų | 181 | 129.4 Ų | 129.4 | 85% | 0.846 | 79% | 0.788 | S | S | * | * | trans | 57.9 | 155.4 | 164.5 | -74.9 | 160.5 | 142.3 | 0 | 0 | 118.5 | ||||
| 209 | V | 33.8 | Very low | 32.4 | Very low | 126 Ų | 126 | 124.5 Ų | 124.5 | 76% | 0.764 | 79% | 0.79 | S | S | * | * | cis | -147.7 | 168.2 | 36.1 | 169.1 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 210 | E | 36.4 | Very low | 32.1 | Very low | 172 Ų | 172 | 120.6 Ų | 120.6 | 80% | 0.804 | 78% | 0.783 | S | S | * | * | trans | -38.5 | 178.4 | 171.6 | -46.9 | 172.3 | 110 | 0 | 0 | 119.4 | ||||
| 211 | T | 32.4 | Very low | 32.1 | Very low | 114 Ų | 114 | 124 Ų | 124 | 70% | 0.699 | 78% | 0.784 | S | S | * | * | cis | -150.4 | 151.9 | 20 | 52.4 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 212 | A | 37.8 | Very low | 32.1 | Very low | 106 Ų | 106 | 130 Ų | 130 | 88% | 0.876 | 78% | 0.784 | S | S | * | * | trans | 41.6 | 148.4 | 144.5 | 0 | 0 | 0 | 0 | 0 | 122.6 | ||||
| 213 | G | 33.2 | Very low | 32.4 | Very low | 71 Ų | 71 | 131.8 Ų | 131.8 | 73% | 0.732 | 78% | 0.78 | S | S | * | * | cis | -176.4 | 179.3 | 1.3 | 0 | 0 | 0 | 0 | 0 | 109.3 | ||||
| 214 | E | 31.8 | Very low | 32.6 | Very low | 197 Ų | 197 | 134.3 Ų | 134.3 | 92% | 0.921 | 79% | 0.786 | S | S | * | * | cis | -146 | 176 | 5.8 | -63.8 | -172.5 | 110.1 | 0 | 0 | 111.8 | ||||
| 215 | H | 33.1 | Very low | 33 | Very low | 186 Ų | 186 | 132.1 Ų | 132.1 | 86% | 0.861 | 78% | 0.78 | S | S | * | * | trans | -99.4 | -171.6 | -178.9 | -89.1 | -73.4 | 0 | 0 | 0 | 112.2 | ||||
| 216 | P | 45.5 | Very low | 33.7 | Very low | 109 Ų | 109 | 135.4 Ų | 135.4 | 71% | 0.708 | 78% | 0.778 | S | S | * | * | cis | -122.7 | -152 | 0.2 | 44.7 | -27.5 | 0 | 0 | 0 | 111.9 | ||||
| 217 | T | 29.6 | Very low | 34.1 | Very low | 116 Ų | 116 | 139.3 Ų | 139.3 | 71% | 0.712 | 78% | 0.775 | S | S | * | * | cis | -147.7 | 141.6 | -0 | 12.7 | 0 | 0 | 0 | 0 | 106.3 | ||||
| 218 | V | 32.6 | Very low | 34.4 | Very low | 136 Ų | 136 | 140.6 Ų | 140.6 | 82% | 0.824 | 77% | 0.772 | S | S | * | * | 65.2 | 123.4 | 68.2 | 179.4 | 0 | 0 | 0 | 0 | 113.9 | |||||
| 219 | A | 28 | Very low | 34.7 | Very low | 92 Ų | 92 | 139.1 Ų | 139.1 | 76% | 0.76 | 77% | 0.77 | S | S | * | * | cis | -163.1 | 162.2 | -14.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 220 | T | 30.5 | Very low | 35 | Very low | 115 Ų | 115 | 140 Ų | 140 | 71% | 0.706 | 77% | 0.77 | S | S | * | * | trans | -95.1 | 139.7 | 169.5 | -42.7 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 221 | H | 35.3 | Very low | 35.2 | Very low | 153 Ų | 153 | 135 Ų | 135 | 71% | 0.708 | 76% | 0.764 | S | S | * | * | 162.2 | 138.8 | 120.2 | -90.5 | -62.6 | 0 | 0 | 0 | 117.3 | |||||
| 222 | R | 29.7 | Very low | 36.1 | Very low | 198 Ų | 198 | 139 Ų | 139 | 75% | 0.747 | 77% | 0.772 | S | S | * | * | trans | 72.9 | 95.1 | 139.6 | -76.7 | 176.9 | 168.3 | 134.4 | -0.5 | 121.5 | ||||
| 223 | D | 32.8 | Very low | 36.6 | Very low | 137 Ų | 137 | 139.8 Ų | 139.8 | 73% | 0.733 | 77% | 0.768 | S | S | * | * | 45 | 111.7 | 99.8 | -41.9 | -35.8 | 0 | 0 | 0 | 119.5 | |||||
| 224 | T | 36.6 | Very low | 36.9 | Very low | 147 Ų | 147 | 140.2 Ų | 140.2 | 90% | 0.902 | 77% | 0.772 | S | S | * | * | trans | -143.4 | 85.4 | 131.7 | 41.2 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 225 | D | 37.7 | Very low | 37.2 | Very low | 145 Ų | 145 | 136.6 Ų | 136.6 | 78% | 0.775 | 77% | 0.769 | S | S | * | * | trans | 33.7 | 149.7 | 140.3 | -110.6 | -44.1 | 0 | 0 | 0 | 125.2 | ||||
| 226 | L | 41 | Very low | 37.7 | Very low | 148 Ų | 148 | 134.9 Ų | 134.9 | 78% | 0.775 | 77% | 0.766 | S | S | * | * | trans | 64.9 | 96.9 | 155.8 | -62.6 | 170.7 | 0 | 0 | 0 | 120.7 | ||||
| 227 | K | 36.7 | Very low | 37.9 | Very low | 156 Ų | 156 | 134.7 Ų | 134.7 | 68% | 0.678 | 77% | 0.773 | S | S | * | * | -170.7 | 149.9 | 91.5 | -105 | -176.9 | 172.3 | -75.8 | 0 | 114.5 | |||||
| 228 | E | 36.8 | Very low | 38.3 | Very low | 147 Ų | 147 | 132.4 Ų | 132.4 | 69% | 0.687 | 77% | 0.773 | S | S | * | * | trans | 10.7 | 133.7 | 146.4 | -63.8 | 132.7 | -141.7 | 0 | 0 | 118.4 | ||||
| 229 | D | 37.6 | Very low | 38.6 | Very low | 150 Ų | 150 | 134.1 Ų | 134.1 | 80% | 0.802 | 77% | 0.774 | S | S | * | * | cis | -154.9 | 169.1 | 18.1 | -165.2 | 10.8 | 0 | 0 | 0 | 112.6 | ||||
| 230 | L | 39.7 | Very low | 39.5 | Very low | 146 Ų | 146 | 135.8 Ų | 135.8 | 76% | 0.764 | 78% | 0.777 | S | S | * | * | trans | -74.8 | 145.5 | 172.4 | -88 | 60 | 0 | 0 | 0 | 111 | ||||
| 231 | G | 41 | Very low | 40 | Very low | 65 Ų | 65 | 133.2 Ų | 133.2 | 67% | 0.67 | 77% | 0.774 | S | S | * | * | cis | 95.8 | 77.9 | 5.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 232 | K | 51.7 | Low | 40.1 | Very low | 200 Ų | 200 | 133.3 Ų | 133.3 | 87% | 0.87 | 78% | 0.778 | S | S | * | * | trans | -143.8 | 155.4 | 161.7 | -85.7 | -152.1 | 174 | -176.5 | 0 | 113 | ||||
| 233 | P | 48.7 | Very low | 40.7 | Very low | 121 Ų | 121 | 132.9 Ų | 132.9 | 79% | 0.786 | 78% | 0.784 | S | S | * | * | trans | -131.6 | 160.7 | -144.2 | 40.1 | -24 | 0 | 0 | 0 | 116.7 | ||||
| 234 | G | 38.7 | Very low | 40.8 | Very low | 80 Ų | 80 | 134 Ų | 134 | 83% | 0.825 | 79% | 0.791 | S | S | * | * | trans | 78 | 129.8 | 145.1 | 0 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 235 | S | 37 | Very low | 41.1 | Very low | 122 Ų | 122 | 132.7 Ų | 132.7 | 85% | 0.853 | 79% | 0.787 | S | S | * | * | -168.3 | 168.6 | 106.2 | -157.9 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 236 | D | 45.1 | Very low | 41.5 | Very low | 149 Ų | 149 | 134.9 Ų | 134.9 | 80% | 0.797 | 79% | 0.793 | S | S | * | * | trans | 76.1 | 134.3 | 153.5 | -146.4 | -1.3 | 0 | 0 | 0 | 120.2 | ||||
| 237 | A | 48.4 | Very low | 41.4 | Very low | 105 Ų | 105 | 134.8 Ų | 134.8 | 87% | 0.868 | 80% | 0.798 | S | S | * | * | trans | -159.1 | 89.5 | 176.1 | 0 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 238 | G | 38.4 | Very low | 41.5 | Very low | 68 Ų | 68 | 130.8 Ų | 130.8 | 70% | 0.701 | 80% | 0.801 | S | S | * | * | trans | -156.1 | 54.5 | -170.1 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 239 | M | 39.3 | Very low | 41.6 | Very low | 172 Ų | 172 | 133.7 Ų | 133.7 | 85% | 0.847 | 81% | 0.811 | S | S | * | * | trans | -125.1 | 115.2 | -175.8 | -172.4 | -171.9 | 78 | 0 | 0 | 113 | ||||
| 240 | P | 47.1 | Very low | 41.8 | Very low | 127 Ų | 127 | 133.8 Ų | 133.8 | 83% | 0.825 | 81% | 0.81 | S | S | * | * | trans | -92.6 | 128.9 | 155.2 | 33.1 | -25.4 | 0 | 0 | 0 | 109.8 | ||||
| 241 | G | 40.6 | Very low | 41.8 | Very low | 62 Ų | 62 | 134.5 Ų | 134.5 | 64% | 0.639 | 82% | 0.815 | S | S | * | * | trans | -103.9 | 172.5 | -174.5 | 0 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 242 | I | 37.1 | Very low | 41.6 | Very low | 154 Ų | 154 | 137.9 Ų | 137.9 | 79% | 0.79 | 82% | 0.818 | S | S | * | * | trans | -144.8 | 102.6 | 159.9 | 34.7 | 172.9 | 0 | 0 | 0 | 105.1 | ||||
| 243 | E | 43.3 | Very low | 40.8 | Very low | 190 Ų | 190 | 134.4 Ų | 134.4 | 89% | 0.888 | 81% | 0.813 | S | S | * | * | 66 | 87.6 | 103.3 | -70.9 | -164.4 | 141.5 | 0 | 0 | 113.3 | |||||
| 244 | D | 35.4 | Very low | 40.3 | Very low | 161 Ų | 161 | 137.2 Ų | 137.2 | 86% | 0.861 | 82% | 0.816 | S | S | * | * | trans | -72.3 | 143.9 | 168.6 | -73.3 | -64.5 | 0 | 0 | 0 | 112.1 | ||||
| 245 | S | 42.5 | Very low | 40 | Very low | 119 Ų | 119 | 142.8 Ų | 142.8 | 83% | 0.832 | 82% | 0.817 | S | S | * | * | trans | -150.9 | 77.7 | 162.3 | -77.7 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 246 | E | 45.8 | Very low | 39.8 | Very low | 191 Ų | 191 | 141.7 Ų | 141.7 | 89% | 0.893 | 82% | 0.816 | S | S | * | * | trans | 48.4 | 91.3 | 136.6 | -166.1 | 175.5 | -137.9 | 0 | 0 | 119 | ||||
| 247 | V | 38 | Very low | 39.6 | Very low | 146 Ų | 146 | 142.3 Ų | 142.3 | 89% | 0.885 | 82% | 0.818 | S | S | * | * | trans | -143.3 | 133.3 | 150.9 | -177.5 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 248 | G | 38.5 | Very low | 39 | Very low | 72 Ų | 72 | 147.4 Ų | 147.4 | 74% | 0.742 | 82% | 0.821 | S | S | * | * | trans | 84 | 89.1 | 147 | 0 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 249 | K | 38.7 | Very low | 39.1 | Very low | 207 Ų | 207 | 153.2 Ų | 153.2 | 90% | 0.9 | 83% | 0.827 | S | S | * | * | trans | -61.1 | 147 | 174.5 | -61.8 | 175.2 | -179.2 | 178.6 | 0 | 113.6 | ||||
| 250 | I | 41.9 | Very low | 39 | Very low | 153 Ų | 153 | 151.6 Ų | 151.6 | 79% | 0.785 | 83% | 0.829 | S | S | * | * | trans | -80.8 | 152.3 | 161.4 | 46.9 | 169.1 | 0 | 0 | 0 | 111.9 | ||||
| 251 | D | 40.9 | Very low | 38.2 | Very low | 160 Ų | 160 | 149.7 Ų | 149.7 | 86% | 0.856 | 82% | 0.824 | S | S | * | * | trans | -174.3 | 84.9 | 154.4 | -85.8 | -38.3 | 0 | 0 | 0 | 104.2 | ||||
| 252 | D | 37.3 | Very low | 38.2 | Very low | 137 Ų | 137 | 155 Ų | 155 | 73% | 0.733 | 84% | 0.836 | S | S | * | * | 50.7 | 111.8 | 79.9 | -165.1 | 25.2 | 0 | 0 | 0 | 114.1 | |||||
| 253 | V | 34.6 | Very low | 37.9 | Very low | 126 Ų | 126 | 153.1 Ų | 153.1 | 76% | 0.764 | 83% | 0.832 | S | S | * | * | -164.5 | 150.4 | 110.2 | -149.7 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 254 | Q | 37.8 | Very low | 37.4 | Very low | 181 Ų | 181 | 152.4 Ų | 152.4 | 85% | 0.846 | 83% | 0.828 | S | S | * | * | trans | 95.4 | 107.6 | 154.7 | -58.2 | -165.4 | 17.7 | 0 | 0 | 120.5 | ||||
| 255 | F | 32.4 | Very low | 37.3 | Very low | 197 Ų | 197 | 152.1 Ų | 152.1 | 86% | 0.864 | 83% | 0.827 | S | S | * | * | trans | -74 | 147.1 | 164.6 | -76.4 | -120 | 0 | 0 | 0 | 112.7 | ||||
| 256 | A | 33.6 | Very low | 36.6 | Very low | 99 Ų | 99 | 154.9 Ų | 154.9 | 82% | 0.818 | 83% | 0.826 | S | S | * | * | trans | -161.4 | 124.3 | 131.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 257 | L | 40 | Very low | 36 | Very low | 162 Ų | 162 | 152.5 Ų | 152.5 | 85% | 0.848 | 82% | 0.818 | S | S | * | * | trans | -77.2 | 134.6 | 166.5 | -70.5 | 88.2 | 0 | 0 | 0 | 109.9 | ||||
| 258 | K | 34.8 | Very low | 35.6 | Very low | 211 Ų | 211 | 154 Ų | 154 | 92% | 0.917 | 82% | 0.816 | S | S | * | * | trans | -141.3 | 126.7 | 158.5 | -113.6 | 174 | -178.8 | 177.3 | 0 | 111.3 | ||||
| 259 | K | 41.1 | Very low | 35.2 | Very low | 191 Ų | 191 | 157.5 Ų | 157.5 | 83% | 0.83 | 82% | 0.816 | S | S | * | * | trans | -79.3 | 147.7 | 172.5 | -60.8 | 174.8 | -178.9 | 177.5 | 0 | 109 | A261 | K259-A261 PolarHBondContact O-N 3.2Š| ||
| 260 | P | 36.6 | Very low | 35 | Very low | 137 Ų | 137 | 153.8 Ų | 153.8 | 89% | 0.89 | 81% | 0.813 | S | S | * | * | trans | -68.9 | 124.6 | 168.8 | 29.4 | -32.6 | 0 | 0 | 0 | 109.4 | ||||
| 261 | A | 32 | Very low | 34.4 | Very low | 88 Ų | 88 | 153.1 Ų | 153.1 | 73% | 0.727 | 81% | 0.811 | S | S | * | * | trans | -123.8 | 126.3 | 169.7 | 0 | 0 | 0 | 0 | 0 | 108.4 | K259 T263 | K259-A261 PolarHBondContact O-N 3.2Å; A261-T263 PolarHBondContact O-N 2.83Å | ||
| 262 | I | 39 | Very low | 33.9 | Very low | 173 Ų | 173 | 151.7 Ų | 151.7 | 89% | 0.887 | 81% | 0.808 | S | S | * | * | trans | -75.4 | 119.3 | 174.3 | -66.9 | 161.4 | 0 | 0 | 0 | 108.1 | ||||
| 263 | T | 32.6 | Very low | 33.4 | Very low | 114 Ų | 114 | 148.8 Ų | 148.8 | 70% | 0.699 | 81% | 0.81 | S | S | * | * | trans | -154.6 | 121.3 | 152.5 | 12.6 | 0 | 0 | 0 | 0 | 111.7 | A261 | A261-T263 PolarHBondContact O-N 2.83Š| ||
| 264 | Q | 32.8 | Very low | 33.3 | Very low | 175 Ų | 175 | 151.1 Ų | 151.1 | 82% | 0.818 | 82% | 0.818 | S | S | * | * | 58.2 | 113.8 | 123.9 | -156.7 | 162 | 13.3 | 0 | 0 | 119 | |||||
| 265 | N | 31.8 | Very low | 32.8 | Very low | 156 Ų | 156 | 153.8 Ų | 153.8 | 83% | 0.834 | 82% | 0.82 | S | S | * | * | trans | -56.9 | 143.8 | 170 | -47 | -54.6 | 0 | 0 | 0 | 111.5 | ||||
| 266 | H | 28.9 | Very low | 32.6 | Very low | 177 Ų | 177 | 152.8 Ų | 152.8 | 82% | 0.819 | 82% | 0.818 | S | S | * | * | trans | -125.4 | 133.2 | 153.4 | -147.5 | -63.5 | 0 | 0 | 0 | 108.7 | ||||
| 267 | I | 32.4 | Very low | 32.4 | Very low | 141 Ų | 141 | 154.9 Ų | 154.9 | 72% | 0.723 | 82% | 0.82 | S | S | * | * | trans | -105.6 | 146.2 | 173.7 | -68.4 | 169.6 | 0 | 0 | 0 | 107.1 | ||||
| 268 | E | 29.8 | Very low | 31.9 | Very low | 177 Ų | 177 | 150.3 Ų | 150.3 | 83% | 0.827 | 81% | 0.813 | S | S | * | * | trans | -119.4 | 162.2 | 163.5 | -72.9 | -166 | 152.3 | 0 | 0 | 110.3 | ||||
| 269 | I | 31.3 | Very low | 31.6 | Very low | 146 Ų | 146 | 145.7 Ų | 145.7 | 75% | 0.749 | 81% | 0.814 | S | S | * | * | trans | -107.6 | 143.4 | -151.3 | -63.2 | 160.4 | 0 | 0 | 0 | 111.5 | ||||
| 270 | P | 34.3 | Very low | 31 | Very low | 128 Ų | 128 | 140.3 Ų | 140.3 | 83% | 0.831 | 81% | 0.812 | S | S | * | * | trans | -113.9 | 153.5 | 137.3 | 35.3 | -30.8 | 0 | 0 | 0 | 111.4 | ||||
| 271 | D | 28.1 | Very low | 30.5 | Very low | 139 Ų | 139 | 143.4 Ų | 143.4 | 74% | 0.743 | 82% | 0.817 | S | S | * | * | trans | -109.3 | 170.2 | -150.2 | -156.9 | -5.7 | 0 | 0 | 0 | 114.7 | ||||
| 272 | T | 30.5 | Very low | 30.3 | Very low | 130 Ų | 130 | 143 Ų | 143 | 80% | 0.798 | 82% | 0.822 | S | S | * | * | trans | 73.7 | 111.7 | 166.8 | 65.6 | 0 | 0 | 0 | 0 | 119.2 | ||||
| 273 | G | 28 | Very low | 29.8 | Very low | 76 Ų | 76 | 140 Ų | 140 | 78% | 0.784 | 82% | 0.823 | S | S | * | * | trans | 172.3 | 94.4 | 167.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 274 | L | 31.3 | Very low | 29.6 | Very low | 176 Ų | 176 | 138.2 Ų | 138.2 | 92% | 0.921 | 83% | 0.828 | S | S | * | * | trans | -73.5 | 135.4 | -177.1 | -83.1 | 70.5 | 0 | 0 | 0 | 112.8 | ||||
| 275 | R | 27.7 | Very low | 29.3 | Very low | 236 Ų | 236 | 139.9 Ų | 139.9 | 89% | 0.891 | 84% | 0.835 | S | S | * | * | 161.3 | 129.1 | 102.8 | -174.5 | 169.8 | -178.3 | -177 | 0.2 | 112.6 | |||||
| 276 | E | 28.1 | Very low | 29 | Very low | 176 Ų | 176 | 136.4 Ų | 136.4 | 82% | 0.822 | 84% | 0.836 | S | S | * | * | trans | -80.1 | 156.5 | 172 | -58 | 169.8 | 95.1 | 0 | 0 | 113 | ||||
| 277 | V | 30 | Very low | 29.1 | Very low | 143 Ų | 143 | 133.3 Ų | 133.3 | 87% | 0.867 | 84% | 0.841 | S | S | * | * | -145.3 | 140.2 | 115.1 | -179.9 | 0 | 0 | 0 | 0 | 108.2 | |||||
| 278 | G | 29.9 | Very low | 29 | Very low | 67 Ų | 67 | 130 Ų | 130 | 69% | 0.691 | 84% | 0.841 | S | S | * | * | trans | -84.2 | -176.7 | -176.8 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 279 | A | 28.6 | Very low | 29 | Very low | 114 Ų | 114 | 132.3 Ų | 132.3 | 94% | 0.942 | 84% | 0.843 | S | S | * | * | trans | -80.7 | 159.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 280 | G | 27.4 | Very low | 28.7 | Very low | 77 Ų | 77 | 131.5 Ų | 131.5 | 79% | 0.794 | 84% | 0.84 | S | S | * | * | trans | -138.8 | 121.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 281 | M | 27.2 | Very low | 28.7 | Very low | 202 Ų | 202 | 133.2 Ų | 133.2 | 100% | 0.995 | 84% | 0.841 | S | S | * | * | trans | -71.5 | 147.4 | 172.6 | -117.6 | 81.1 | 157.6 | 0 | 0 | 111.1 | ||||
| 282 | G | 26.7 | Very low | 28.6 | Very low | 80 Ų | 80 | 132 Ų | 132 | 83% | 0.825 | 84% | 0.843 | S | S | * | * | trans | -135.1 | 120.7 | 160.1 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 283 | A | 28.4 | Very low | 28.6 | Very low | 109 Ų | 109 | 133.8 Ų | 133.8 | 90% | 0.901 | 85% | 0.847 | S | S | * | * | trans | -103.1 | 148.8 | 180 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 284 | G | 28.7 | Very low | 28.6 | Very low | 78 Ų | 78 | 136.8 Ų | 136.8 | 80% | 0.804 | 85% | 0.845 | S | S | * | * | trans | -140.4 | 135.4 | 170.7 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 285 | E | 25.3 | Very low | 28.5 | Very low | 210 Ų | 210 | 138.9 Ų | 138.9 | 98% | 0.981 | 84% | 0.841 | S | S | * | * | trans | -82.4 | 146.8 | -176 | -67.5 | 170.1 | 80.9 | 0 | 0 | 112.5 | ||||
| 286 | G | 27.4 | Very low | 28.8 | Very low | 82 Ų | 82 | 133.3 Ų | 133.3 | 85% | 0.845 | 84% | 0.835 | S | S | * | * | trans | -164.6 | 131.8 | 170.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 287 | A | 30.2 | Very low | 28.9 | Very low | 113 Ų | 113 | 130.5 Ų | 130.5 | 93% | 0.934 | 83% | 0.83 | S | S | * | * | trans | -116.5 | 149.1 | -165.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 288 | G | 29.4 | Very low | 28.9 | Very low | 70 Ų | 70 | 132 Ų | 132 | 72% | 0.722 | 83% | 0.832 | S | S | * | * | trans | 145.4 | 96.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 289 | R | 29.8 | Very low | 28.9 | Very low | 227 Ų | 227 | 137.2 Ų | 137.2 | 86% | 0.857 | 84% | 0.839 | S | S | * | * | 64 | 126.6 | 77.1 | -85.3 | -165.6 | 173.8 | 175.3 | -1.3 | 115.3 | |||||
| 290 | D | 25.5 | Very low | 29.2 | Very low | 129 Ų | 129 | 140.1 Ų | 140.1 | 69% | 0.69 | 84% | 0.837 | S | S | * | * | trans | 50.3 | 114.2 | 148.3 | -43.1 | -34.5 | 0 | 0 | 0 | 116.8 | ||||
| 291 | L | 34.6 | Very low | 29.4 | Very low | 163 Ų | 163 | 144.7 Ų | 144.7 | 85% | 0.853 | 84% | 0.837 | S | S | * | * | -164.1 | 151.8 | 73.3 | -88.6 | 163.6 | 0 | 0 | 0 | 112.9 | |||||
| 292 | S | 25.8 | Very low | 29.5 | Very low | 113 Ų | 113 | 141.2 Ų | 141.2 | 79% | 0.79 | 82% | 0.822 | S | S | * | * | trans | -110.7 | 124.2 | 175.3 | -55.1 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 293 | L | 30.5 | Very low | 29.9 | Very low | 168 Ų | 168 | 147.3 Ų | 147.3 | 88% | 0.88 | 83% | 0.826 | S | S | * | * | trans | -170.1 | 150.3 | 161.7 | -89.6 | 126.6 | 0 | 0 | 0 | 108.1 | ||||
| 294 | D | 28.3 | Very low | 30 | Very low | 140 Ų | 140 | 148 Ų | 148 | 75% | 0.749 | 82% | 0.819 | S | S | * | * | cis | -153.7 | 158.8 | -37.7 | -177.3 | 24.5 | 0 | 0 | 0 | 107 | ||||
| 295 | R | 28.2 | Very low | 30.3 | Very low | 220 Ų | 220 | 152 Ų | 152 | 83% | 0.83 | 82% | 0.82 | S | S | * | * | trans | -137.3 | 110.3 | 172.7 | -177.4 | 176.2 | 178.8 | 163.5 | 2 | 109.9 | V297 | R295-V297 PolarHBondContact O-N 3.45Š| ||
| 296 | P | 34.9 | Very low | 30.5 | Very low | 119 Ų | 119 | 145.1 Ų | 145.1 | 77% | 0.773 | 81% | 0.806 | S | S | * | * | trans | -66 | 128.9 | -172.7 | 25.5 | -34.2 | 0 | 0 | 0 | 112.2 | ||||
| 297 | V | 29.4 | Very low | 30.9 | Very low | 117 Ų | 117 | 149.9 Ų | 149.9 | 71% | 0.709 | 81% | 0.811 | S | S | * | * | trans | -123.5 | 120.2 | 164.7 | 174.3 | 0 | 0 | 0 | 0 | 107.6 | R295 | R295-V297 PolarHBondContact O-N 3.45Š| ||
| 298 | L | 29.8 | Very low | 30.8 | Very low | 174 Ų | 174 | 147.9 Ų | 147.9 | 91% | 0.911 | 80% | 0.801 | S | S | * | * | trans | -135 | 106.5 | 157.7 | -82.3 | 179.6 | 0 | 0 | 0 | 109.6 | ||||
| 299 | Q | 31.6 | Very low | 31.2 | Very low | 177 Ų | 177 | 153.1 Ų | 153.1 | 83% | 0.827 | 81% | 0.812 | S | S | * | * | trans | -86.1 | 161.3 | 149.8 | -70.1 | -171.6 | 3.1 | 0 | 0 | 108.9 | ||||
| 300 | I | 34.4 | Very low | 31.3 | Very low | 175 Ų | 175 | 151.6 Ų | 151.6 | 90% | 0.897 | 82% | 0.815 | S | S | * | * | trans | -81 | 162.3 | -173.1 | -67 | 171.4 | 0 | 0 | 0 | 111.1 | ||||
| 301 | Q | 31.1 | Very low | 31.4 | Very low | 172 Ų | 172 | 149 Ų | 149 | 80% | 0.804 | 82% | 0.819 | S | S | * | * | trans | -85 | -176.3 | -158 | -157 | 158.3 | 82.6 | 0 | 0 | 114.9 | ||||
| 302 | D | 28.6 | Very low | 31.2 | Very low | 129 Ų | 129 | 152.5 Ų | 152.5 | 69% | 0.69 | 82% | 0.82 | S | S | * | * | trans | 76.6 | 96.3 | 164.1 | -64.5 | -29.9 | 0 | 0 | 0 | 120.7 | ||||
| 303 | K | 35.8 | Very low | 31.4 | Very low | 209 Ų | 209 | 154 Ų | 154 | 91% | 0.909 | 82% | 0.824 | S | S | * | * | -160.7 | 169.6 | 89.5 | -112.7 | 171.1 | -177.6 | 170.3 | 0 | 114.9 | |||||
| 304 | V | 31.4 | Very low | 31.3 | Very low | 124 Ų | 124 | 149.6 Ų | 149.6 | 75% | 0.752 | 82% | 0.82 | S | S | * | * | trans | -106.1 | 169.4 | -163.3 | -178.7 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 305 | I | 34.6 | Very low | 31.6 | Very low | 160 Ų | 160 | 147.6 Ų | 147.6 | 82% | 0.821 | 82% | 0.822 | S | S | * | * | trans | 82.7 | 116.5 | 177.9 | -46.6 | 169.3 | 0 | 0 | 0 | 112.6 | ||||
| 306 | G | 28.9 | Very low | 31.6 | Very low | 67 Ų | 67 | 145 Ų | 145 | 69% | 0.691 | 82% | 0.824 | S | S | * | * | cis | 107.7 | 86.2 | -6.4 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 307 | L | 35.2 | Very low | 31.4 | Very low | 182 Ų | 182 | 146.6 Ų | 146.6 | 95% | 0.953 | 82% | 0.821 | S | S | * | * | trans | -168.9 | 140.2 | 153 | -103.7 | 167.1 | 0 | 0 | 0 | 107.3 | ||||
| 308 | G | 29.5 | Very low | 31.4 | Very low | 70 Ų | 70 | 148.9 Ų | 148.9 | 72% | 0.722 | 82% | 0.824 | S | S | * | * | trans | -118.1 | 176.3 | -173.5 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 309 | L | 36.4 | Very low | 31.4 | Very low | 181 Ų | 181 | 149.9 Ų | 149.9 | 95% | 0.948 | 82% | 0.824 | S | S | * | * | trans | -155.6 | 135.2 | 168.9 | -108.9 | 162.5 | 0 | 0 | 0 | 110.5 | ||||
| 310 | E | 32.4 | Very low | 32.7 | Very low | 195 Ų | 195 | 146.4 Ų | 146.4 | 91% | 0.911 | 82% | 0.817 | S | S | * | * | trans | -85.8 | 159 | 175.3 | -59.3 | 168.2 | 87.4 | 0 | 0 | 111.3 | ||||
| 311 | G | 28.8 | Very low | 33.3 | Very low | 75 Ų | 75 | 143.5 Ų | 143.5 | 77% | 0.773 | 81% | 0.81 | S | S | * | * | trans | -178.9 | 37 | -178.3 | 0 | 0 | 0 | 0 | 0 | 124.1 | ||||
| 312 | R | 30.3 | Very low | 33.4 | Very low | 236 Ų | 236 | 144.4 Ų | 144.4 | 89% | 0.891 | 81% | 0.814 | S | S | * | * | trans | 49.8 | 106.9 | 142 | -165.3 | -178.1 | -165.1 | 177.9 | 5 | 122.3 | ||||
| 313 | V | 29.8 | Very low | 33.5 | Very low | 144 Ų | 144 | 142.2 Ų | 142.2 | 87% | 0.873 | 81% | 0.813 | S | S | * | * | 32.8 | 128.8 | 129.5 | -170.1 | 0 | 0 | 0 | 0 | 121.6 | |||||
| 314 | G | 26.9 | Very low | 33.2 | Very low | 76 Ų | 76 | 139.5 Ų | 139.5 | 78% | 0.784 | 81% | 0.814 | S | S | * | * | trans | -163.4 | 148.3 | 155.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||||
| 315 | A | 36 | Very low | 33.3 | Very low | 97 Ų | 97 | 137.9 Ų | 137.9 | 80% | 0.802 | 81% | 0.813 | S | S | * | * | trans | -154 | 150.4 | -173 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 316 | L | 27.3 | Very low | 32.9 | Very low | 165 Ų | 165 | 137.9 Ų | 137.9 | 86% | 0.864 | 82% | 0.815 | S | S | * | * | trans | -173 | 164.4 | 170.7 | -107.4 | 132.3 | 0 | 0 | 0 | 111.2 | ||||
| 317 | Q | 31.8 | Very low | 32.9 | Very low | 154 Ų | 154 | 145.6 Ų | 145.6 | 72% | 0.72 | 82% | 0.823 | S | S | * | * | -162 | 168.8 | -65.4 | -147.7 | -163.7 | -1.1 | 0 | 0 | 112 | |||||
| 318 | Q | 29.5 | Very low | 33.5 | Very low | 164 Ų | 164 | 142.3 Ų | 142.3 | 77% | 0.766 | 81% | 0.813 | S | S | * | * | trans | 91.7 | 167.5 | 154.6 | -70.3 | 172.8 | 51.8 | 0 | 0 | 121.6 | ||||
| 319 | Q | 28.7 | Very low | 33.6 | Very low | 195 Ų | 195 | 146.9 Ų | 146.9 | 91% | 0.911 | 82% | 0.819 | S | S | * | * | trans | -150.4 | 179.1 | -144 | -107.1 | -162.2 | -48.9 | 0 | 0 | 115.2 | ||||
| 320 | P | 59.3 | Low | 33.1 | Very low | 105 Ų | 105 | 144.5 Ų | 144.5 | 68% | 0.682 | 81% | 0.807 | S | S | * | * | trans | -117.6 | -175.2 | -166.4 | 45.2 | -37.5 | 0 | 0 | 0 | 117 | ||||
| 321 | P | 46.3 | Very low | 32.8 | Very low | 114 Ų | 114 | 143.5 Ų | 143.5 | 74% | 0.74 | 80% | 0.8 | S | S | * | * | trans | -121.2 | 150.1 | 151.9 | 31.2 | -15.1 | 0 | 0 | 0 | 112.9 | ||||
| 322 | Q | 32.9 | Very low | 32.8 | Very low | 191 Ų | 191 | 146.3 Ų | 146.3 | 89% | 0.893 | 80% | 0.797 | S | S | * | * | 70.9 | 146.7 | 56.9 | -75.2 | -157.5 | -7 | 0 | 0 | 116 | |||||
| 323 | A | 31.4 | Very low | 32.8 | Very low | 82 Ų | 82 | 143.5 Ų | 143.5 | 68% | 0.678 | 79% | 0.794 | S | S | * | * | cis | -176.1 | -165.4 | -17 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 324 | V | 29.6 | Very low | 32.8 | Very low | 153 Ų | 153 | 143 Ų | 143 | 93% | 0.927 | 79% | 0.787 | S | S | * | * | trans | 116.2 | 148.7 | 163.3 | -179.4 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 325 | A | 33.3 | Very low | 32.9 | Very low | 89 Ų | 89 | 147.5 Ų | 147.5 | 74% | 0.736 | 79% | 0.792 | S | S | * | * | trans | -153.6 | 172.3 | -169.7 | 0 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 326 | D | 26.8 | Very low | 32.7 | Very low | 161 Ų | 161 | 151.9 Ų | 151.9 | 86% | 0.861 | 79% | 0.793 | S | S | * | * | trans | -162 | -179.7 | 150.2 | -127.2 | -37.2 | 0 | 0 | 0 | 115.4 | ||||
| 327 | R | 27.7 | Very low | 32.9 | Very low | 228 Ų | 228 | 148.6 Ų | 148.6 | 86% | 0.86 | 79% | 0.79 | S | S | * | * | trans | -108.3 | -147.6 | -160.4 | -59.2 | 178.1 | 166 | -161.7 | -0.8 | 117.6 | ||||
| 328 | P | 49.8 | Very low | 32.6 | Very low | 113 Ų | 113 | 145.6 Ų | 145.6 | 73% | 0.734 | 79% | 0.792 | S | S | * | * | -131.6 | 170.9 | -105.3 | 42.6 | -24.2 | 0 | 0 | 0 | 117.5 | |||||
| 329 | I | 30.5 | Very low | 32.8 | Very low | 166 Ų | 166 | 146.1 Ų | 146.1 | 85% | 0.851 | 80% | 0.798 | S | S | * | * | trans | -171.9 | 161.6 | 160.5 | -109.7 | 150.1 | 0 | 0 | 0 | 111.7 | ||||
| 330 | L | 26.4 | Very low | 33 | Very low | 131 Ų | 131 | 145.8 Ų | 145.8 | 69% | 0.686 | 80% | 0.797 | S | S | * | * | cis | -173.6 | 144.1 | -44.6 | -166.5 | 65.1 | 0 | 0 | 0 | 112.1 | ||||
| 331 | F | 25.4 | Very low | 31.6 | Very low | 174 Ų | 174 | 144.3 Ų | 144.3 | 76% | 0.763 | 79% | 0.793 | S | S | * | * | trans | 69 | 158.5 | 156.6 | -88.2 | -45.3 | 0 | 0 | 0 | 124.8 | ||||
| 332 | D | 30 | Very low | 31 | Very low | 134 Ų | 134 | 145.9 Ų | 145.9 | 72% | 0.717 | 80% | 0.796 | S | S | * | * | trans | 64.5 | 152.1 | 159.1 | -55.4 | -14.2 | 0 | 0 | 0 | 122.3 | ||||
| 333 | E | 30.1 | Very low | 31.1 | Very low | 178 Ų | 178 | 143.9 Ų | 143.9 | 83% | 0.832 | 79% | 0.786 | S | S | * | * | cis | -159.7 | 176 | -43.5 | -138.9 | -178.4 | -175 | 0 | 0 | 109.7 | ||||
| 334 | D | 29.6 | Very low | 31.1 | Very low | 134 Ų | 134 | 148.5 Ų | 148.5 | 72% | 0.717 | 79% | 0.791 | S | S | * | * | trans | -47.9 | 149.4 | -169.8 | -85.9 | -28.5 | 0 | 0 | 0 | 118.9 | ||||
| 335 | N | 28 | Very low | 31.3 | Very low | 169 Ų | 169 | 144.2 Ų | 144.2 | 90% | 0.904 | 78% | 0.778 | S | S | * | * | -157.6 | 155.1 | 127.5 | -118 | -69.6 | 0 | 0 | 0 | 115.6 | |||||
| 336 | K | 32.9 | Very low | 31.5 | Very low | 189 Ų | 189 | 149.6 Ų | 149.6 | 82% | 0.822 | 79% | 0.787 | S | S | * | * | trans | -118.6 | 131.4 | -174 | -67.1 | 177.3 | 179.8 | 174 | 0 | 113.7 | ||||
| 337 | A | 30.2 | Very low | 31.7 | Very low | 96 Ų | 96 | 150.6 Ų | 150.6 | 79% | 0.793 | 79% | 0.787 | S | S | * | * | trans | -165.8 | 118.2 | 142.9 | 0 | 0 | 0 | 0 | 0 | 107.3 | ||||
| 338 | A | 27.1 | Very low | 31.9 | Very low | 92 Ų | 92 | 147.7 Ų | 147.7 | 76% | 0.76 | 78% | 0.783 | S | S | * | * | 71.3 | 105 | 54.8 | 0 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 339 | I | 32.1 | Very low | 31.1 | Very low | 175 Ų | 175 | 153.2 Ų | 153.2 | 90% | 0.897 | 79% | 0.789 | S | S | * | * | trans | -173.7 | 142.3 | 133.7 | -95.2 | 154.3 | 0 | 0 | 0 | 110.1 | ||||
| 340 | Q | 34.2 | Very low | 31.9 | Very low | 188 Ų | 188 | 150.2 Ų | 150.2 | 88% | 0.879 | 78% | 0.78 | S | S | * | * | trans | -105.2 | 172.7 | 178.8 | -82.4 | 172.7 | -44.4 | 0 | 0 | 109.7 | ||||
| 341 | A | 30.3 | Very low | 32 | Very low | 74 Ų | 74 | 151.1 Ų | 151.1 | 61% | 0.612 | 79% | 0.785 | S | S | * | * | cis | -172 | -146.2 | -23.3 | 0 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 342 | D | 31.8 | Very low | 32 | Very low | 147 Ų | 147 | 153.8 Ų | 153.8 | 79% | 0.786 | 79% | 0.79 | S | S | * | * | trans | 75.9 | 157.6 | 158.8 | -55 | 0.4 | 0 | 0 | 0 | 120.3 | ||||
| 343 | E | 35.8 | Very low | 31.9 | Very low | 148 Ų | 148 | 151.8 Ų | 151.8 | 69% | 0.692 | 79% | 0.792 | S | S | * | * | -168.3 | 159.3 | -51.3 | -136.6 | -175.4 | 178.9 | 0 | 0 | 110.3 | |||||
| 344 | F | 31.9 | Very low | 32.4 | Very low | 180 Ų | 180 | 149.4 Ų | 149.4 | 79% | 0.789 | 79% | 0.792 | S | S | * | * | trans | 55.5 | 155.3 | 168.9 | -71.5 | -76.1 | 0 | 0 | 0 | 119.3 | ||||
| 345 | G | 32.5 | Very low | 32.3 | Very low | 62 Ų | 62 | 147 Ų | 147 | 64% | 0.639 | 79% | 0.791 | S | S | * | * | cis | 119.4 | 104.5 | -11.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 346 | E | 38.4 | Very low | 32.4 | Very low | 202 Ų | 202 | 146.3 Ų | 146.3 | 94% | 0.944 | 79% | 0.787 | S | S | * | * | trans | -135.2 | 150.3 | 170.7 | -73.8 | -164.6 | 132.6 | 0 | 0 | 112 | ||||
| 347 | Q | 31.2 | Very low | 32.4 | Very low | 182 Ų | 182 | 144.3 Ų | 144.3 | 85% | 0.85 | 79% | 0.791 | S | S | * | * | trans | -119 | 128.9 | -179.8 | -71.8 | -172 | -2.4 | 0 | 0 | 113.7 | ||||
| 348 | H | 31.3 | Very low | 32.6 | Very low | 167 Ų | 167 | 147.5 Ų | 147.5 | 77% | 0.773 | 79% | 0.791 | S | S | * | * | trans | 31.9 | 131.2 | 138.3 | -69.1 | -82.2 | 0 | 0 | 0 | 123.7 | ||||
| 349 | R | 32.7 | Very low | 32.8 | Very low | 230 Ų | 230 | 152.4 Ų | 152.4 | 87% | 0.868 | 80% | 0.795 | S | S | * | * | trans | 71.6 | 173.7 | 136.1 | -79.3 | -176.2 | 163.8 | -176 | -2 | 117.5 | ||||
| 350 | P | 47.8 | Very low | 32.8 | Very low | 102 Ų | 102 | 150 Ų | 150 | 66% | 0.662 | 79% | 0.788 | S | S | * | * | -134.1 | -172.2 | -52.8 | 39.3 | -23.6 | 0 | 0 | 0 | 111.4 | |||||
| 351 | L | 28.4 | Very low | 32.6 | Very low | 150 Ų | 150 | 148.5 Ų | 148.5 | 79% | 0.785 | 79% | 0.787 | S | S | * | * | 172.5 | 125.8 | 124.9 | -93.5 | 163.3 | 0 | 0 | 0 | 115.2 | |||||
| 352 | R | 26.1 | Very low | 32.7 | Very low | 230 Ų | 230 | 148.3 Ų | 148.3 | 87% | 0.868 | 79% | 0.791 | S | S | * | * | 35.8 | 117.6 | 128.4 | -159.9 | 176.2 | -144.1 | 157.8 | 6.2 | 120.4 | |||||
| 353 | A | 27.1 | Very low | 32.7 | Very low | 93 Ų | 93 | 147.6 Ų | 147.6 | 77% | 0.769 | 79% | 0.792 | S | S | * | * | trans | -88.3 | 152.8 | 163.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 354 | P | 40.3 | Very low | 32.5 | Very low | 128 Ų | 128 | 147.4 Ų | 147.4 | 83% | 0.831 | 79% | 0.791 | S | S | * | * | trans | -96.7 | 169.9 | 155.7 | 37.6 | -31 | 0 | 0 | 0 | 111.7 | ||||
| 355 | A | 28.7 | Very low | 32.4 | Very low | 83 Ų | 83 | 148.7 Ų | 148.7 | 69% | 0.686 | 79% | 0.791 | S | S | * | * | trans | -105.7 | -178.5 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114 | ||||
| 356 | N | 29.9 | Very low | 32.4 | Very low | 154 Ų | 154 | 155.6 Ų | 155.6 | 82% | 0.824 | 80% | 0.803 | S | S | * | * | trans | 81.5 | 99.2 | 162.4 | -52.1 | -20.7 | 0 | 0 | 0 | 118.9 | ||||
| 357 | V | 33.5 | Very low | 32 | Very low | 148 Ų | 148 | 149.8 Ų | 149.8 | 90% | 0.897 | 80% | 0.798 | S | S | * | * | trans | -136.1 | 148.9 | 142 | -178.7 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 358 | M | 34.1 | Very low | 32.1 | Very low | 162 Ų | 162 | 145.6 Ų | 145.6 | 80% | 0.798 | 79% | 0.794 | S | S | * | * | trans | -68.8 | 151 | -171.2 | -58.7 | 117.5 | 71 | 0 | 0 | 114.5 | ||||
| 359 | K | 30.8 | Very low | 32 | Very low | 195 Ų | 195 | 147 Ų | 147 | 85% | 0.848 | 80% | 0.801 | S | S | * | * | trans | -73.6 | 137.3 | 157.3 | -64.7 | -177.4 | 179 | -177.6 | 0 | 109.8 | ||||
| 360 | V | 31.9 | Very low | 32.1 | Very low | 124 Ų | 124 | 143.8 Ų | 143.8 | 75% | 0.752 | 80% | 0.8 | S | S | * | * | trans | -138.9 | 102.7 | 166.5 | 179.1 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 361 | D | 30.7 | Very low | 32 | Very low | 158 Ų | 158 | 143.8 Ų | 143.8 | 85% | 0.845 | 80% | 0.8 | S | S | * | * | trans | -85 | 130.4 | 166.6 | -71.1 | -65.9 | 0 | 0 | 0 | 109.2 | ||||
| 362 | G | 31.3 | Very low | 32.2 | Very low | 69 Ų | 69 | 144.3 Ų | 144.3 | 71% | 0.711 | 80% | 0.803 | S | S | * | * | trans | -162.4 | 21 | -164 | 0 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 363 | V | 31.8 | Very low | 33.3 | Very low | 132 Ų | 132 | 138.6 Ų | 138.6 | 80% | 0.8 | 80% | 0.796 | S | S | * | * | trans | 8.3 | 116.6 | 160.9 | -173.2 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 364 | Q | 31.6 | Very low | 34.4 | Very low | 145 Ų | 145 | 139.6 Ų | 139.6 | 68% | 0.678 | 79% | 0.794 | S | S | * | * | -171.2 | 132.7 | 121 | -105.9 | 178.7 | 109.1 | 0 | 0 | 115.9 | |||||
| 365 | R | 30.7 | Very low | 34.1 | Very low | 206 Ų | 206 | 140.5 Ų | 140.5 | 78% | 0.777 | 79% | 0.792 | S | S | * | * | trans | 32.9 | 134.3 | 132.5 | -59.8 | 170 | 179.1 | 153.7 | -9.4 | 117.4 | ||||
| 366 | K | 31.8 | Very low | 35.1 | Very low | 208 Ų | 208 | 141.4 Ų | 141.4 | 90% | 0.904 | 79% | 0.791 | S | S | * | * | -178.6 | 162.9 | 52.1 | -147 | 174.8 | -173.9 | -176.9 | 0 | 110.7 | |||||
| 367 | G | 29.8 | Very low | 35.1 | Very low | 80 Ų | 80 | 138.5 Ų | 138.5 | 83% | 0.825 | 79% | 0.788 | S | S | * | * | trans | 103.2 | 124.7 | 158.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 368 | A | 33.6 | Very low | 35.2 | Very low | 94 Ų | 94 | 140.3 Ų | 140.3 | 78% | 0.777 | 79% | 0.787 | S | S | * | * | trans | -118.6 | 149.7 | 168 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 369 | E | 28.8 | Very low | 35.4 | Very low | 197 Ų | 197 | 139.4 Ų | 139.4 | 92% | 0.921 | 79% | 0.79 | S | S | * | * | 179.2 | 155.5 | 125.4 | -99.3 | -179.8 | 139.1 | 0 | 0 | 112.4 | |||||
| 370 | L | 34.6 | Very low | 36.3 | Very low | 162 Ų | 162 | 135 Ų | 135 | 85% | 0.848 | 78% | 0.781 | S | S | * | * | trans | -153.1 | 157.2 | 176.3 | -85.5 | 167.9 | 0 | 0 | 0 | 105.8 | ||||
| 371 | P | 46.5 | Very low | 36.3 | Very low | 102 Ų | 102 | 136.4 Ų | 136.4 | 66% | 0.662 | 79% | 0.785 | S | S | * | * | cis | -140.1 | -163.1 | -13.1 | 28.7 | -3.1 | 0 | 0 | 0 | 113.5 | ||||
| 372 | L | 33.2 | Very low | 36.8 | Very low | 161 Ų | 161 | 133.9 Ų | 133.9 | 84% | 0.843 | 78% | 0.777 | S | S | * | * | trans | 96.3 | 153.5 | 151.5 | -63.3 | 171.1 | 0 | 0 | 0 | 121.9 | ||||
| 373 | P | 49 | Very low | 37 | Very low | 110 Ų | 110 | 139 Ų | 139 | 71% | 0.714 | 79% | 0.787 | S | S | * | * | trans | -114.4 | -148.8 | -175 | 47.3 | -33.8 | 0 | 0 | 0 | 110.7 | ||||
| 374 | P | 49.8 | Very low | 37.1 | Very low | 113 Ų | 113 | 141 Ų | 141 | 73% | 0.734 | 79% | 0.787 | S | S | * | * | cis | -137.7 | -156.4 | -10.6 | 38.4 | -16 | 0 | 0 | 0 | 115 | ||||
| 375 | N | 34.1 | Very low | 37.8 | Very low | 148 Ų | 148 | 139 Ų | 139 | 79% | 0.791 | 79% | 0.786 | S | S | * | * | trans | 98.1 | 167.8 | 148 | -124.3 | 22.1 | 0 | 0 | 0 | 118 | ||||
| 376 | P | 49.1 | Very low | 37.9 | Very low | 102 Ų | 102 | 139.8 Ų | 139.8 | 66% | 0.662 | 79% | 0.789 | S | S | * | * | -136.9 | -172.5 | -92.2 | 44.4 | -28.2 | 0 | 0 | 0 | 117.3 | |||||
| 377 | A | 31.2 | Very low | 38.1 | Very low | 93 Ų | 93 | 137.9 Ų | 137.9 | 77% | 0.769 | 78% | 0.783 | S | S | * | * | trans | 76.6 | 157.8 | 166.7 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 378 | Q | 34.2 | Very low | 38.1 | Very low | 185 Ų | 185 | 138.9 Ų | 138.9 | 86% | 0.864 | 78% | 0.784 | S | S | * | * | cis | -137.6 | 163.1 | 15.9 | -61.6 | 170.4 | 12.2 | 0 | 0 | 113.5 | ||||
| 379 | V | 39.6 | Very low | 38.3 | Very low | 143 Ų | 143 | 146.1 Ų | 146.1 | 87% | 0.867 | 79% | 0.791 | S | S | * | * | trans | -150.3 | 170.1 | 167.3 | -102.6 | 0 | 0 | 0 | 0 | 106.9 | ||||
| 380 | P | 49.1 | Very low | 38.5 | Very low | 102 Ų | 102 | 144.3 Ų | 144.3 | 66% | 0.662 | 79% | 0.788 | S | S | * | * | cis | -132.2 | -170.7 | 4.4 | 36.8 | -16.5 | 0 | 0 | 0 | 113.9 | ||||
| 381 | N | 32.1 | Very low | 39.1 | Very low | 154 Ų | 154 | 141.9 Ų | 141.9 | 82% | 0.824 | 78% | 0.782 | S | S | * | * | -171.5 | 159.3 | 113.7 | -95.4 | -25.3 | 0 | 0 | 0 | 113.5 | |||||
| 382 | P | 41.3 | Very low | 38.6 | Very low | 106 Ų | 106 | 146.9 Ų | 146.9 | 69% | 0.688 | 79% | 0.793 | S | S | * | * | trans | -123.4 | 170 | -153.3 | 42.4 | -30.4 | 0 | 0 | 0 | 116 | ||||
| 383 | I | 35.2 | Very low | 39 | Very low | 177 Ų | 177 | 145.1 Ų | 145.1 | 91% | 0.908 | 79% | 0.791 | S | S | * | * | trans | -137.1 | 134 | 154.9 | -58.9 | -177.8 | 0 | 0 | 0 | 108.3 | ||||
| 384 | E | 34.6 | Very low | 38.3 | Very low | 172 Ų | 172 | 144.8 Ų | 144.8 | 80% | 0.804 | 80% | 0.798 | S | S | * | * | trans | -148.6 | -179.9 | -176.7 | -145.5 | -161 | -129.7 | 0 | 0 | 109.6 | ||||
| 385 | P | 46.2 | Very low | 37.5 | Very low | 103 Ų | 103 | 148.3 Ų | 148.3 | 67% | 0.669 | 81% | 0.805 | S | S | * | * | -104.8 | 179.5 | -85 | 32.8 | -21.1 | 0 | 0 | 0 | 113.6 | |||||
| 386 | R | 32.8 | Very low | 37.6 | Very low | 223 Ų | 223 | 147.2 Ų | 147.2 | 84% | 0.842 | 81% | 0.806 | S | S | * | * | trans | -137.9 | 115.8 | 161.4 | -83.6 | -161.7 | 174.3 | -160.7 | -2.7 | 114.9 | ||||
| 387 | H | 34.9 | Very low | 36.9 | Very low | 168 Ų | 168 | 150.7 Ų | 150.7 | 78% | 0.778 | 82% | 0.818 | S | S | * | * | trans | 61 | 115.3 | 153 | -54.6 | -59 | 0 | 0 | 0 | 120.2 | ||||
| 388 | A | 31.3 | Very low | 37 | Very low | 101 Ų | 101 | 157.9 Ų | 157.9 | 84% | 0.835 | 83% | 0.825 | S | S | * | * | trans | -90 | 157.7 | 159.2 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 389 | R | 36 | Very low | 37.1 | Very low | 246 Ų | 246 | 157.8 Ų | 157.8 | 93% | 0.928 | 82% | 0.824 | S | S | * | * | trans | -156.9 | 146.6 | 154.4 | -122.8 | -179.7 | -174.6 | 179.3 | 2.2 | 110.6 | ||||
| 390 | D | 34.1 | Very low | 36.9 | Very low | 159 Ų | 159 | 162.2 Ų | 162.2 | 85% | 0.85 | 83% | 0.826 | S | S | * | * | trans | -80.8 | 159.9 | -164.3 | -70.9 | -70.8 | 0 | 0 | 0 | 116.5 | ||||
| 391 | P | 47.2 | Very low | 36.3 | Very low | 112 Ų | 112 | 165.9 Ų | 165.9 | 73% | 0.727 | 83% | 0.834 | S | S | * | * | trans | -97.4 | 169.5 | -173.2 | 39.2 | -37.6 | 0 | 0 | 0 | 114.6 | ||||
| 392 | K | 35.1 | Very low | 36.7 | Very low | 206 Ų | 206 | 162.3 Ų | 162.3 | 90% | 0.896 | 82% | 0.821 | S | S | * | * | trans | -167.3 | 169.4 | 155.1 | -107.4 | 160.2 | -175 | 175.3 | 0 | 111.1 | ||||
| 393 | P | 41.8 | Very low | 37.1 | Very low | 124 Ų | 124 | 168.1 Ų | 168.1 | 81% | 0.805 | 83% | 0.829 | S | S | * | * | -125.9 | -178.3 | -124.3 | 43 | -28.2 | 0 | 0 | 0 | 115.8 | |||||
| 394 | A | 34.1 | Very low | 37.4 | Very low | 104 Ų | 104 | 168.6 Ų | 168.6 | 86% | 0.86 | 83% | 0.825 | S | S | * | * | trans | -145.2 | 158.9 | 166.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 395 | E | 32.9 | Very low | 37.6 | Very low | 186 Ų | 186 | 168.5 Ų | 168.5 | 87% | 0.869 | 82% | 0.822 | S | S | * | * | P | Polyproline II helix | trans | -89.3 | 159.4 | -167.6 | -73.4 | 177.7 | 103.7 | 0 | 0 | 115.7 | ||
| 396 | P | 36.6 | Very low | 37.4 | Very low | 126 Ų | 126 | 170.1 Ų | 170.1 | 82% | 0.818 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -82.3 | 118.4 | -179.5 | 32.1 | -34.4 | 0 | 0 | 0 | 113.5 | R398 | P396-R398 PolarHBondContact O-N 3.47Š|
| 397 | L | 34.6 | Very low | 38.2 | Very low | 175 Ų | 175 | 168.1 Ų | 168.1 | 92% | 0.916 | 83% | 0.825 | S | S | * | * | P | Polyproline II helix | trans | -77.6 | 121.4 | 172.4 | -78.7 | 169.8 | 0 | 0 | 0 | 112.1 | ||
| 398 | R | 34.4 | Very low | 38.7 | Very low | 243 Ų | 243 | 166.8 Ų | 166.8 | 92% | 0.917 | 82% | 0.824 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 133.8 | 166.5 | -65.7 | -76.2 | -168.1 | 166.7 | 2.6 | 109.8 | P396 | P396-R398 PolarHBondContact O-N 3.47Š|
| 399 | H | 35.7 | Very low | 39.4 | Very low | 184 Ų | 184 | 171.2 Ų | 171.2 | 85% | 0.852 | 83% | 0.827 | S | S | * | * | trans | -113.8 | 137 | 165.6 | -141.4 | 67.3 | 0 | 0 | 0 | 110.7 | ||||
| 400 | R | 35.2 | Very low | 40 | Very low | 236 Ų | 236 | 164.3 Ų | 164.3 | 89% | 0.891 | 82% | 0.817 | S | S | * | * | trans | -141.8 | 80.1 | -166 | -178.2 | -156 | 172.6 | -176.5 | -1.5 | 111 | ||||
| 401 | Q | 36.7 | Very low | 40.9 | Very low | 179 Ų | 179 | 162.7 Ų | 162.7 | 84% | 0.836 | 82% | 0.815 | S | S | * | * | trans | -167.5 | 155.9 | 163.8 | -108.6 | 163.1 | 5.3 | 0 | 0 | 107.8 | ||||
| 402 | S | 41.1 | Very low | 40.8 | Very low | 78 Ų | 78 | 164 Ų | 164 | 55% | 0.545 | 82% | 0.82 | S | S | . | * | cis | -142.7 | 152.8 | 4.5 | 47.2 | 0 | 0 | 0 | 0 | 110.4 | F404 | S402-F404 VanDerWaalsContact OG-CE2 3.26Å; S402-F404 WeakPolarHBondContact OG-CE2 3.29Å | ||
| 403 | R | 48.1 | Very low | 41.1 | Very low | 228 Ų | 228 | 160 Ų | 160 | 86% | 0.86 | 81% | 0.809 | S | S | * | * | trans | -84.6 | 113.7 | 161 | -70.8 | -175.5 | 179.7 | -170.9 | -0.8 | 107.2 | ||||
| 404 | F | 42.1 | Very low | 41.6 | Very low | 188 Ų | 188 | 160 Ų | 160 | 83% | 0.825 | 81% | 0.809 | S | S | * | * | trans | -89.8 | 128.1 | 155.2 | -79.2 | -86.1 | 0 | 0 | 0 | 107.4 | S402 | S402-F404 VanDerWaalsContact OG-CE2 3.26Å; S402-F404 WeakPolarHBondContact OG-CE2 3.29Å | ||
| 405 | F | 39.5 | Very low | 42.4 | Very low | 169 Ų | 169 | 162.2 Ų | 162.2 | 74% | 0.741 | 80% | 0.802 | S | S | * | * | trans | -78.8 | 140.3 | 165.3 | -76.6 | -103.5 | 0 | 0 | 0 | 107.8 | E407 | F405-E407 HydrophobicContact CB-CG 4.48Š| ||
| 406 | D | 40.4 | Very low | 42.7 | Very low | 137 Ų | 137 | 163 Ų | 163 | 73% | 0.733 | 81% | 0.805 | S | S | * | * | trans | -104.8 | 106.6 | 166.8 | -161 | -19.4 | 0 | 0 | 0 | 107.4 | N408 | D406-N408 PolarHBondContact O-N 3.31Å; D406-N408 VanDerWaalsContact O-N 3.1Å; D406-N408 PolarHBondContact OD1-ND2 2.92Å; D406-N408 VanDerWaalsContact OD1-ND2 3.15Å | ||
| 407 | E | 50.7 | Low | 42.8 | Very low | 181 Ų | 181 | 160.5 Ų | 160.5 | 85% | 0.846 | 80% | 0.802 | S | S | * | * | trans | -86.6 | 47.9 | -173.5 | -64.4 | -173 | 120.4 | 0 | 0 | 111.7 | F405 | F405-E407 HydrophobicContact CB-CG 4.48Š| ||
| 408 | N | 46.1 | Very low | 43.5 | Very low | 140 Ų | 140 | 157.5 Ų | 157.5 | 75% | 0.749 | 80% | 0.796 | S | S | * | * | trans | -135.9 | 40.8 | -175.6 | -70.4 | -74.4 | 0 | 0 | 0 | 114.7 | D406 | D406-N408 PolarHBondContact O-N 3.31Å; D406-N408 VanDerWaalsContact O-N 3.1Å; D406-N408 PolarHBondContact OD1-ND2 2.92Å; D406-N408 VanDerWaalsContact OD1-ND2 3.15Å | ||
| 409 | E | 45.6 | Very low | 44.2 | Very low | 194 Ų | 194 | 156 Ų | 156 | 91% | 0.907 | 80% | 0.796 | S | S | * | * | trans | -134.2 | 130.2 | 164.6 | -112.7 | 167.9 | -151.4 | 0 | 0 | 111.5 | ||||
| 410 | S | 48.3 | Very low | 44.8 | Very low | 102 Ų | 102 | 154.8 Ų | 154.8 | 71% | 0.713 | 80% | 0.795 | S | S | * | * | P | Polyproline II helix | trans | -82.4 | 142.8 | 179.4 | -178 | 0 | 0 | 0 | 0 | 110.3 | V412 | S410-V412 PolarHBondContact O-N 3.45Š|
| 411 | P | 51.7 | Low | 45.4 | Very low | 125 Ų | 125 | 147.9 Ų | 147.9 | 81% | 0.812 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -59.8 | 133 | 173.8 | -20.8 | 32.3 | 0 | 0 | 0 | 111.4 | ||
| 412 | V | 45.9 | Very low | 46.1 | Very low | 138 Ų | 138 | 146.2 Ų | 146.2 | 84% | 0.836 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -100.8 | 138.5 | 168.2 | 179.2 | 0 | 0 | 0 | 0 | 108.3 | S410 | S410-V412 PolarHBondContact O-N 3.45Š|
| 413 | D | 42.1 | Very low | 46.5 | Very low | 122 Ų | 122 | 152.2 Ų | 152.2 | 65% | 0.652 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -69 | 121.9 | -170.1 | -167.5 | -6.5 | 0 | 0 | 0 | 112.4 | Q415 | D413-Q415 PolarHBondContact O-N 2.99Š|
| 414 | P | 52.9 | Low | 46.8 | Very low | 126 Ų | 126 | 147.4 Ų | 147.4 | 82% | 0.818 | 79% | 0.789 | S | S | * | * | trans | -79.3 | 53.5 | -179.7 | 34.6 | -37.6 | 0 | 0 | 0 | 112.8 | ||||
| 415 | Q | 49.2 | Very low | 47.2 | Very low | 150 Ų | 150 | 142.1 Ų | 142.1 | 70% | 0.701 | 79% | 0.787 | S | S | * | * | trans | -130.8 | 85.2 | 175 | -67.6 | -160.9 | 23.1 | 0 | 0 | 113.4 | D413 | D413-Q415 PolarHBondContact O-N 2.99Š| ||
| 416 | H | 39.9 | Very low | 47.4 | Very low | 202 Ų | 202 | 140.6 Ų | 140.6 | 94% | 0.935 | 79% | 0.787 | S | S | * | * | trans | -152.1 | 113.3 | 131.9 | -99.8 | -61.6 | 0 | 0 | 0 | 109.6 | ||||
| 417 | G | 38.6 | Very low | 48 | Very low | 74 Ų | 74 | 142.4 Ų | 142.4 | 76% | 0.763 | 80% | 0.797 | S | S | * | * | trans | -75.2 | 159.4 | -172.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 418 | S | 48.3 | Very low | 48.2 | Very low | 111 Ų | 111 | 136.5 Ų | 136.5 | 78% | 0.776 | 78% | 0.784 | S | S | * | * | trans | -51.9 | 132.1 | 175.3 | 49.9 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 419 | K | 49.2 | Very low | 48 | Very low | 211 Ų | 211 | 136.7 Ų | 136.7 | 92% | 0.917 | 79% | 0.785 | S | S | * | * | trans | -124.8 | 61.8 | 151.9 | -75.8 | -168.1 | 175.1 | -174.9 | 0 | 110 | ||||
| 420 | L | 49.9 | Very low | 48.4 | Very low | 159 Ų | 159 | 133.5 Ų | 133.5 | 83% | 0.832 | 78% | 0.779 | S | S | * | * | trans | -68.7 | 127.6 | 147.9 | -75.2 | 162.2 | 0 | 0 | 0 | 105.8 | ||||
| 421 | A | 48 | Very low | 48.8 | Very low | 91 Ų | 91 | 131 Ų | 131 | 75% | 0.752 | 77% | 0.769 | S | S | * | * | trans | -93.5 | 117.9 | 171.3 | 0 | 0 | 0 | 0 | 0 | 107.4 | Y423 | A421-Y423 PolarHBondContact O-N 3.5Å; A421-Y423 VanDerWaalsContact O-N 3.09Å | ||
| 422 | D | 50.2 | Low | 49 | Very low | 144 Ų | 144 | 134.1 Ų | 134.1 | 77% | 0.77 | 77% | 0.773 | S | S | * | * | trans | -64.1 | 110.1 | 170.9 | -61.7 | -54.6 | 0 | 0 | 0 | 108.4 | ||||
| 423 | Y | 49.5 | Very low | 49.2 | Very low | 204 Ų | 204 | 138 Ų | 138 | 80% | 0.8 | 77% | 0.774 | S | S | * | * | trans | -101.4 | 68.5 | 170.7 | -151.7 | -89.9 | 0 | 0 | 0 | 108.9 | A421 G425 | A421-Y423 PolarHBondContact O-N 3.5Å; A421-Y423 VanDerWaalsContact O-N 3.09Å; Y423-G425 PolarHBondContact O-N 2.88Å | ||
| 424 | N | 53.8 | Low | 49.8 | Very low | 128 Ų | 128 | 141.2 Ų | 141.2 | 68% | 0.684 | 79% | 0.785 | S | S | * | * | trans | -56.9 | 118.8 | 169.5 | 36.4 | -94.7 | 0 | 0 | 0 | 109.5 | D426 | N424-D426 PolarHBondContact O-N 3.05Å; N424-D426 VanDerWaalsContact O-N 3.07Å | ||
| 425 | G | 52.3 | Low | 49.8 | Very low | 77 Ų | 77 | 138.4 Ų | 138.4 | 79% | 0.794 | 77% | 0.772 | S | S | * | * | trans | -60.3 | 109 | -171.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y423 | Y423-G425 PolarHBondContact O-N 2.88Š| ||
| 426 | D | 41.9 | Very low | 50 | Low | 137 Ų | 137 | 138 Ų | 138 | 73% | 0.733 | 78% | 0.775 | S | S | * | * | trans | -103.7 | 140.2 | 168.4 | -170.8 | 13.5 | 0 | 0 | 0 | 108.2 | N424 G428 | N424-D426 PolarHBondContact O-N 3.05Å; N424-D426 VanDerWaalsContact O-N 3.07Å; D426-G428 PolarHBondContact O-N 2.8Å | ||
| 427 | D | 53.3 | Low | 50.5 | Low | 175 Ų | 175 | 136.6 Ų | 136.6 | 94% | 0.936 | 77% | 0.766 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.9 | 42.5 | -168.7 | -76 | -48.4 | 0 | 0 | 0 | 112.8 | ||
| 428 | G | 55 | Low | 51.1 | Low | 57 Ų | 57 | 141.1 Ų | 141.1 | 59% | 0.588 | 77% | 0.767 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.3 | -13 | -172.4 | 0 | 0 | 0 | 0 | 0 | 116.4 | D426 V430 | D426-G428 PolarHBondContact O-N 2.8Å; G428-V430 PolarHBondContact O-N 3.33Å |
| 429 | N | 43.5 | Very low | 51.2 | Low | 143 Ų | 143 | 139.1 Ų | 139.1 | 77% | 0.765 | 76% | 0.757 | S | S | * | * | trans | -85.8 | 78.9 | -172.2 | -166.1 | 97.2 | 0 | 0 | 0 | 112.9 | G431 | N429-G431 PolarHBondContact O-N 3.44Š| ||
| 430 | V | 53.9 | Low | 51.3 | Low | 128 Ų | 128 | 136 Ų | 136 | 78% | 0.776 | 75% | 0.746 | S | S | * | * | trans | -61.3 | 125.9 | 166.6 | -176.3 | 0 | 0 | 0 | 0 | 109.2 | G428 E432 | G428-V430 PolarHBondContact O-N 3.33Å; V430-E432 PolarHBondContact O-N 3.09Å | ||
| 431 | G | 55.3 | Low | 51.2 | Low | 49 Ų | 49 | 135.9 Ų | 135.9 | 51% | 0.505 | 75% | 0.746 | S | S | . | * | trans | -72.2 | 113.4 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | N429 | N429-G431 PolarHBondContact O-N 3.44Š| ||
| 432 | E | 55.8 | Low | 51.3 | Low | 191 Ų | 191 | 135.8 Ų | 135.8 | 89% | 0.893 | 75% | 0.745 | S | S | * | * | trans | -66.1 | 134.2 | 166.5 | -65.2 | -177.8 | -169.4 | 0 | 0 | 109.4 | V430 | V430-E432 PolarHBondContact O-N 3.09Š| ||
| 433 | Y | 51.3 | Low | 51.2 | Low | 218 Ų | 218 | 138.2 Ų | 138.2 | 86% | 0.855 | 74% | 0.744 | S | S | * | * | trans | -79.4 | 127 | -170.2 | -78.4 | -105.7 | 0 | 0 | 0 | 111.6 | A435 | Y433-A435 PolarHBondContact O-N 2.95Š| ||
| 434 | E | 55 | Low | 51.2 | Low | 191 Ų | 191 | 135.3 Ų | 135.3 | 89% | 0.893 | 74% | 0.743 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.4 | 31 | 175.1 | -60.3 | -171.2 | 118.3 | 0 | 0 | 114.1 | ||
| 435 | A | 51.7 | Low | 51.1 | Low | 66 Ų | 66 | 138.6 Ų | 138.6 | 55% | 0.545 | 75% | 0.754 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -74.7 | -42.3 | -174.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | Y433 K437 | Y433-A435 PolarHBondContact O-N 2.95Å; A435-K437 PolarHBondContact O-N 3.5Å; A435-K437 VanDerWaalsContact O-N 3.11Å |
| 436 | D | 52.7 | Low | 50.9 | Low | 143 Ų | 143 | 143.2 Ų | 143.2 | 77% | 0.765 | 76% | 0.755 | S | S | * | * | G | 310 helix | trans | -76.2 | -4.5 | -164.8 | -67.8 | -9.5 | 0 | 0 | 0 | 114.4 | Q438 | D436-Q438 PolarHBondContact O-N 3.21Š|
| 437 | K | 51.6 | Low | 51.3 | Low | 171 Ų | 171 | 145.8 Ų | 145.8 | 74% | 0.743 | 76% | 0.762 | S | S | * | * | G | 310 helix | trans | -88.6 | 7.5 | -177.8 | -148.5 | 173 | -176.3 | 171.4 | 0 | 115.4 | A435 | A435-K437 PolarHBondContact O-N 3.5Å; A435-K437 VanDerWaalsContact O-N 3.11Å |
| 438 | Q | 51.9 | Low | 51 | Low | 169 Ų | 169 | 145.9 Ų | 145.9 | 79% | 0.79 | 76% | 0.763 | S | S | * | * | G | 310 helix | trans | -103.4 | -10.2 | 169.7 | -64.2 | -171.2 | 9 | 0 | 0 | 113.3 | D436 | D436-Q438 PolarHBondContact O-N 3.21Š|
| 439 | A | 50.1 | Low | 50.3 | Low | 69 Ų | 69 | 147.1 Ų | 147.1 | 57% | 0.57 | 78% | 0.776 | S | S | * | * | G | 310 helix | trans | -75.6 | -35.1 | -180 | 0 | 0 | 0 | 0 | 0 | 113.6 | L441 A442 | A439-L441 PolarHBondContact O-N 2.98Å; A439-L441 VanDerWaalsContact O-N 3.1Å; A439-A442 PolarHBondContact O-N 3.23Å |
| 440 | E | 49.7 | Very low | 50.3 | Low | 147 Ų | 147 | 148.5 Ų | 148.5 | 69% | 0.687 | 78% | 0.783 | S | S | * | * | G | 310 helix | trans | -67.7 | -9.4 | -175.4 | -65.2 | -170.6 | 140.7 | 0 | 0 | 114.9 | ||
| 441 | L | 49.5 | Very low | 49.7 | Very low | 156 Ų | 156 | 145.8 Ų | 145.8 | 82% | 0.817 | 78% | 0.781 | S | S | * | * | G | 310 helix | trans | -94.7 | -3.8 | 176.7 | -66 | 177.6 | 0 | 0 | 0 | 113.9 | A439 | A439-L441 PolarHBondContact O-N 2.98Å; A439-L441 VanDerWaalsContact O-N 3.1Å |
| 442 | A | 50.1 | Low | 48.8 | Very low | 88 Ų | 88 | 146.7 Ų | 146.7 | 73% | 0.727 | 79% | 0.79 | S | S | * | * | S | Bend | trans | -103.3 | 7.5 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | A439 | A439-A442 PolarHBondContact O-N 3.23Š|
| 443 | Y | 47.9 | Very low | 48.1 | Very low | 195 Ų | 195 | 146.4 Ų | 146.4 | 77% | 0.765 | 79% | 0.789 | S | S | * | * | S | Bend | trans | -129.7 | 26.6 | -173.6 | -141.4 | -85.2 | 0 | 0 | 0 | 113.6 | ||
| 444 | N | 49.6 | Very low | 47.7 | Very low | 143 Ų | 143 | 144.6 Ų | 144.6 | 77% | 0.765 | 79% | 0.789 | S | S | * | * | trans | -126.7 | 23.6 | 179 | -80.7 | -25.2 | 0 | 0 | 0 | 113 | ||||
| 445 | E | 50 | Low | 47.4 | Very low | 198 Ų | 198 | 143.2 Ų | 143.2 | 93% | 0.925 | 79% | 0.787 | S | S | * | * | S | Bend | trans | -106.5 | 13.8 | 171.9 | -71.2 | -167.4 | 147 | 0 | 0 | 113.1 | ||
| 446 | E | 49.3 | Very low | 47.1 | Very low | 174 Ų | 174 | 144.9 Ų | 144.9 | 81% | 0.813 | 79% | 0.79 | S | S | * | * | trans | -117.8 | 88.1 | 168.8 | -71.9 | -172.6 | -174.7 | 0 | 0 | 110.8 | ||||
| 447 | E | 51 | Low | 46.6 | Very low | 190 Ų | 190 | 146.9 Ų | 146.9 | 89% | 0.888 | 80% | 0.795 | S | S | * | * | S | Bend | trans | 175.9 | 80.2 | 138.6 | -173.4 | 160.5 | -129.7 | 0 | 0 | 110.7 | ||
| 448 | D | 46.5 | Very low | 46.1 | Very low | 177 Ų | 177 | 145.1 Ų | 145.1 | 95% | 0.947 | 79% | 0.794 | S | S | * | * | trans | -164.1 | 93.3 | 150 | -115.6 | -19 | 0 | 0 | 0 | 108.1 | ||||
| 449 | G | 39.2 | Very low | 45.8 | Very low | 83 Ų | 83 | 143.8 Ų | 143.8 | 86% | 0.856 | 79% | 0.792 | S | S | * | * | trans | -108.9 | 131 | -179.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 450 | D | 44.8 | Very low | 45.3 | Very low | 173 Ų | 173 | 148.6 Ų | 148.6 | 93% | 0.925 | 80% | 0.803 | S | S | * | * | trans | -135.2 | 152.4 | 161.2 | -159.8 | 3.7 | 0 | 0 | 0 | 109.9 | ||||
| 451 | G | 40.3 | Very low | 45 | Very low | 71 Ų | 71 | 148.5 Ų | 148.5 | 73% | 0.732 | 81% | 0.807 | S | S | * | * | trans | -106.3 | -171.7 | -166.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 452 | G | 37.8 | Very low | 44.7 | Very low | 68 Ų | 68 | 152.8 Ų | 152.8 | 70% | 0.701 | 81% | 0.812 | S | S | * | * | trans | 120.3 | 72.2 | -170.8 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 453 | E | 39.4 | Very low | 44.4 | Very low | 185 Ų | 185 | 156 Ų | 156 | 86% | 0.864 | 82% | 0.817 | S | S | * | * | 62.6 | 110.7 | 76 | -61.1 | -169.7 | 173.5 | 0 | 0 | 113.3 | |||||
| 454 | E | 43.7 | Very low | 43.9 | Very low | 180 Ų | 180 | 154.1 Ų | 154.1 | 84% | 0.841 | 82% | 0.817 | S | S | * | * | trans | 44.5 | 120.6 | 143.9 | -53.2 | -170.9 | 167.1 | 0 | 0 | 120.3 | ||||
| 455 | D | 48.6 | Very low | 43.4 | Very low | 162 Ų | 162 | 155.9 Ų | 155.9 | 87% | 0.866 | 82% | 0.821 | S | S | * | * | -150.5 | 153.2 | 110 | -127.7 | -28.5 | 0 | 0 | 0 | 111.6 | |||||
| 456 | V | 45.7 | Very low | 42.8 | Very low | 101 Ų | 101 | 149.8 Ų | 149.8 | 61% | 0.612 | 81% | 0.811 | S | S | * | * | trans | -127.3 | 127.4 | -172.1 | 174.9 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 457 | Q | 42.7 | Very low | 42.2 | Very low | 184 Ų | 184 | 149 Ų | 149 | 86% | 0.86 | 81% | 0.812 | S | S | * | * | trans | -176.2 | 102.2 | 148.9 | -103.9 | 142.5 | 90.5 | 0 | 0 | 112 | ||||
| 458 | D | 40.4 | Very low | 41.5 | Very low | 134 Ų | 134 | 150.7 Ų | 150.7 | 72% | 0.717 | 81% | 0.811 | S | S | * | * | 36.1 | 163.5 | 107.8 | -58.7 | -28.6 | 0 | 0 | 0 | 122.9 | |||||
| 459 | D | 44.8 | Very low | 41.2 | Very low | 142 Ų | 142 | 146.7 Ų | 146.7 | 76% | 0.759 | 80% | 0.802 | S | S | * | * | trans | 82.2 | 93.2 | 159.8 | -63.5 | -10.9 | 0 | 0 | 0 | 121.7 | ||||
| 460 | E | 41 | Very low | 41.4 | Very low | 170 Ų | 170 | 148.3 Ų | 148.3 | 79% | 0.794 | 80% | 0.795 | S | S | * | * | 58.4 | 133.4 | 121 | -63.8 | -167.2 | 157.6 | 0 | 0 | 123.4 | |||||
| 461 | D | 42.2 | Very low | 41.3 | Very low | 145 Ų | 145 | 146.8 Ų | 146.8 | 78% | 0.775 | 79% | 0.787 | S | S | * | * | trans | 50.1 | 108.3 | 139.3 | -70.1 | 13 | 0 | 0 | 0 | 121.6 | ||||
| 462 | R | 44.8 | Very low | 41.2 | Very low | 246 Ų | 246 | 152.8 Ų | 152.8 | 93% | 0.928 | 79% | 0.789 | S | S | * | * | -156.5 | 103 | 122.5 | -119.8 | 171 | -168.9 | 141.4 | 10.1 | 116.1 | |||||
| 463 | D | 42.4 | Very low | 41.3 | Very low | 155 Ų | 155 | 152.4 Ų | 152.4 | 83% | 0.829 | 79% | 0.785 | S | S | * | * | trans | -65.7 | 136.9 | 145.6 | -87.3 | -43.8 | 0 | 0 | 0 | 110 | ||||
| 464 | M | 38.8 | Very low | 41.3 | Very low | 155 Ų | 155 | 151.5 Ų | 151.5 | 76% | 0.764 | 78% | 0.778 | S | S | * | * | 171.8 | 135.5 | 124.9 | -97.6 | -166.8 | -154.8 | 0 | 0 | 113.8 | |||||
| 465 | Q | 38.5 | Very low | 41.3 | Very low | 181 Ų | 181 | 153 Ų | 153 | 85% | 0.846 | 78% | 0.776 | S | S | * | * | trans | 66.7 | 154 | 149.9 | -62.6 | 173.1 | 37 | 0 | 0 | 117.5 | ||||
| 466 | G | 35.9 | Very low | 41 | Very low | 69 Ų | 69 | 156 Ų | 156 | 71% | 0.711 | 78% | 0.775 | S | S | * | * | cis | 177.8 | 140.7 | -5.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 467 | D | 37.2 | Very low | 41 | Very low | 158 Ų | 158 | 159.3 Ų | 159.3 | 85% | 0.845 | 78% | 0.784 | S | S | * | * | trans | -67.4 | 132.3 | -172 | -172.9 | 9.6 | 0 | 0 | 0 | 113.3 | ||||
| 468 | R | 37.2 | Very low | 40.9 | Very low | 226 Ų | 226 | 154.7 Ų | 154.7 | 85% | 0.853 | 78% | 0.777 | S | S | * | * | trans | -159.7 | 96.9 | 162.3 | -152.6 | 174.3 | -163 | 85.9 | 2 | 114.5 | ||||
| 469 | A | 40.8 | Very low | 41 | Very low | 92 Ų | 92 | 155.5 Ų | 155.5 | 76% | 0.76 | 78% | 0.78 | S | S | * | * | trans | -70.1 | 141.7 | 164.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | ||||
| 470 | V | 42.8 | Very low | 40.8 | Very low | 118 Ų | 118 | 155 Ų | 155 | 72% | 0.715 | 78% | 0.777 | S | S | * | * | trans | -146.3 | 129.2 | 157.3 | -162.9 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 471 | D | 43 | Very low | 41.1 | Very low | 140 Ų | 140 | 153.9 Ų | 153.9 | 75% | 0.749 | 78% | 0.775 | S | S | * | * | trans | -78.6 | 148.7 | 172 | 163.7 | 43.7 | 0 | 0 | 0 | 112 | ||||
| 472 | Y | 38.1 | Very low | 41.2 | Very low | 198 Ų | 198 | 158.5 Ų | 158.5 | 78% | 0.776 | 80% | 0.799 | S | S | * | * | trans | -160.9 | 103.6 | 155.4 | -104.4 | -60.5 | 0 | 0 | 0 | 114.5 | ||||
| 473 | G | 38.3 | Very low | 41 | Very low | 60 Ų | 60 | 154.1 Ų | 154.1 | 62% | 0.619 | 79% | 0.792 | S | S | * | * | trans | -88.3 | 138.2 | 168.4 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 474 | K | 39.4 | Very low | 40.9 | Very low | 166 Ų | 166 | 154.1 Ų | 154.1 | 72% | 0.722 | 79% | 0.79 | S | S | * | * | trans | 180 | 139.7 | 172.3 | -102.4 | 148.4 | -174.7 | 167.7 | 0 | 108.4 | ||||
| 475 | R | 44.9 | Very low | 41.1 | Very low | 212 Ų | 212 | 154 Ų | 154 | 80% | 0.8 | 79% | 0.792 | S | S | * | * | cis | -144.2 | 154.8 | -6.1 | -58.4 | -175.6 | -170.5 | -139.6 | 3.6 | 107.8 | ||||
| 476 | R | 42.5 | Very low | 41.2 | Very low | 225 Ų | 225 | 152.4 Ų | 152.4 | 85% | 0.849 | 79% | 0.788 | S | S | * | * | 23 | 133.5 | 102.7 | -53.1 | -176.7 | -171.9 | -89.4 | 0.1 | 114.9 | |||||
| 477 | Q | 45.6 | Very low | 41.5 | Very low | 170 Ų | 170 | 157.6 Ų | 157.6 | 79% | 0.794 | 79% | 0.793 | S | S | * | * | cis | -147.4 | 155.2 | 19.2 | -112.2 | 141.2 | -46.3 | 0 | 0 | 110.4 | ||||
| 478 | A | 40.7 | Very low | 41.8 | Very low | 87 Ų | 87 | 157.6 Ų | 157.6 | 72% | 0.719 | 79% | 0.79 | S | S | * | * | 40.1 | 132.6 | 106.6 | 0 | 0 | 0 | 0 | 0 | 115.6 | |||||
| 479 | I | 42.3 | Very low | 42.2 | Very low | 150 Ų | 150 | 152.7 Ų | 152.7 | 77% | 0.769 | 79% | 0.785 | S | S | * | * | -159.6 | 147.2 | 58.9 | -84.1 | 175.3 | 0 | 0 | 0 | 112.5 | |||||
| 480 | D | 41.3 | Very low | 42.3 | Very low | 132 Ų | 132 | 157.4 Ų | 157.4 | 71% | 0.706 | 79% | 0.787 | S | S | * | * | trans | 29 | 133.3 | 149.9 | -54.4 | -14.6 | 0 | 0 | 0 | 125.7 | ||||
| 481 | I | 45.9 | Very low | 42.2 | Very low | 147 Ų | 147 | 160.7 Ų | 160.7 | 75% | 0.754 | 79% | 0.793 | S | S | * | * | 52.3 | 110.9 | 127 | -52.1 | 165.7 | 0 | 0 | 0 | 119.5 | |||||
| 482 | L | 44.9 | Very low | 42.2 | Very low | 241 Ų | 241 | 162.5 Ų | 162.5 | 100% | 1.262 | 80% | 0.797 | S | S | * | * | -149.4 | 0 | 113.5 | -141.4 | 83.8 | 0 | 0 | 0 | 111.4 |
Retrieved 482 of 482 residues in 230.7 ms
(Link to these results)