| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 41.5 | Very low | 55.6 | Low | 244 Ų | 244 | 132.7 Ų | 132.7 | 100% | 1.202 | 76% | 0.758 | S | S | * | * | 0 | 118.7 | 0 | -81.1 | 172.1 | 148.8 | 0 | 0 | 106.7 | |||||
| 2 | E | 41.9 | Very low | 57.7 | Low | 183 Ų | 183 | 128.2 Ų | 128.2 | 86% | 0.855 | 73% | 0.728 | S | S | * | * | trans | -56.9 | 129.3 | -157.9 | -74.4 | 138.7 | 112.9 | 0 | 0 | 114.8 | S4 | E2-S4 PolarHBondContact O-N 3.44Š| ||
| 3 | S | 43.4 | Very low | 59.5 | Low | 109 Ų | 109 | 123.4 Ų | 123.4 | 76% | 0.762 | 70% | 0.703 | S | S | * | * | trans | -71.1 | 85.7 | 170.6 | 47.5 | 0 | 0 | 0 | 0 | 110.4 | H5 | S3-H5 VanDerWaalsContact C-N 3.26Å; S3-H5 PolarHBondContact O-N 2.99Å | ||
| 4 | S | 46.9 | Very low | 61.1 | Low | 108 Ų | 108 | 121.1 Ų | 121.1 | 76% | 0.755 | 69% | 0.692 | S | S | * | * | trans | -77.9 | 72.4 | 172.6 | -65.4 | 0 | 0 | 0 | 0 | 111.1 | E2 A6 | E2-S4 PolarHBondContact O-N 3.44Å; S4-A6 PolarHBondContact O-N 3.43Å | ||
| 5 | H | 49.8 | Very low | 62.6 | Low | 184 Ų | 184 | 116.3 Ų | 116.3 | 85% | 0.852 | 67% | 0.673 | S | S | * | * | trans | -70.7 | 79.8 | 157.1 | -81.4 | -71 | 0 | 0 | 0 | 108.1 | S3 G7 | S3-H5 VanDerWaalsContact C-N 3.26Å; S3-H5 PolarHBondContact O-N 2.99Å; H5-G7 PolarHBondContact O-N 3.15Å | ||
| 6 | A | 53.4 | Low | 64.1 | Low | 85 Ų | 85 | 115.8 Ų | 115.8 | 70% | 0.702 | 67% | 0.666 | S | S | * | * | trans | -66.2 | 95.9 | 171.9 | 0 | 0 | 0 | 0 | 0 | 108.6 | S4 Y8 | S4-A6 PolarHBondContact O-N 3.43Å; A6-Y8 PolarHBondContact O-N 2.91Å | ||
| 7 | G | 55.9 | Low | 65.3 | Low | 72 Ų | 72 | 116.1 Ų | 116.1 | 74% | 0.742 | 66% | 0.664 | S | S | * | * | P | Polyproline II helix | trans | -56.6 | 123.2 | 174 | 0 | 0 | 0 | 0 | 0 | 110 | H5 S9 | H5-G7 PolarHBondContact O-N 3.15Å; G7-S9 PolarHBondContact O-N 3.06Å |
| 8 | Y | 63.4 | Low | 66.6 | Low | 180 Ų | 180 | 117.2 Ų | 117.2 | 71% | 0.706 | 66% | 0.66 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 125.5 | 170.4 | -66.6 | -84 | 0 | 0 | 0 | 108.5 | A6 L10 I12 | A6-Y8 PolarHBondContact O-N 2.91Å; Y8-L10 PolarHBondContact O-N 3.04Å; Y8-I12 HydrophobicContact CD1-CG2 4.39Å |
| 9 | S | 72.4 | Confident | 67.8 | Low | 59 Ų | 59 | 116.1 Ų | 116.1 | 41% | 0.413 | 66% | 0.656 | S | S | . | * | P | Polyproline II helix | trans | -60.3 | 132.2 | 174.8 | 54.4 | 0 | 0 | 0 | 0 | 108.5 | G7 P11 I12 V13 | G7-S9 PolarHBondContact O-N 3.06Å; S9-P11 WeakPolarHBondContact O-CD 3.25Å; S9-I12 WeakPolarHBondContact O-CB 3.46Å; S9-I12 PolarHBondContact O-N 3.47Å; S9-I12 WeakPolarHBondContact OG-CD1 3.35Å; S9-I12 WeakPolarHBondContact OG-CG1 3.49Å; S9-V13 PolarHBondContact O-N 2.95Å |
| 10 | L | 65.6 | Low | 69 | Low | 145 Ų | 145 | 113.5 Ų | 113.5 | 76% | 0.759 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -38.7 | -41.6 | 177.2 | -76.3 | 164.4 | 0 | 0 | 0 | 115.1 | Y8 I12 V13 V14 | Y8-L10 PolarHBondContact O-N 3.04Å; L10-I12 VanDerWaalsContact C-N 3.29Å; L10-I12 PolarHBondContact O-N 3.26Å; L10-V13 PolarHBondContact O-N 3.23Å; L10-V14 WeakPolarHBondContact O-CG2 3.21Å; L10-V14 PolarHBondContact O-N 3.25Å; L10-V14 VanDerWaalsContact O-N 3.07Å |
| 11 | P | 77.9 | Confident | 70.1 | Confident | 91 Ų | 91 | 110.9 Ų | 110.9 | 59% | 0.591 | 64% | 0.637 | S | S | * | * | H | α-helix | trans | -61.6 | -32.1 | 176.3 | 23.7 | -37.1 | 0 | 0 | 0 | 114.2 | S9 A15 | S9-P11 WeakPolarHBondContact O-CD 3.25Å; P11-A15 VanDerWaalsContact O-CB 3.32Å; P11-A15 WeakPolarHBondContact O-CB 3.22Å; P11-A15 PolarHBondContact O-N 3.34Å |
| 12 | I | 80.1 | Confident | 72.5 | Confident | 78 Ų | 78 | 102 Ų | 102 | 40% | 0.4 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -69.4 | -44 | 178.9 | -63.5 | 174.3 | 0 | 0 | 0 | 109.9 | Y8 S9 L10 V14 A15 I16 | Y8-I12 HydrophobicContact CD1-CG2 4.39Å; S9-I12 WeakPolarHBondContact O-CB 3.46Å; S9-I12 PolarHBondContact O-N 3.47Å; S9-I12 WeakPolarHBondContact OG-CD1 3.35Å; S9-I12 WeakPolarHBondContact OG-CG1 3.49Å; L10-I12 VanDerWaalsContact C-N 3.29Å; L10-I12 PolarHBondContact O-N 3.26Å; I12-V14 VanDerWaalsContact C-N 3.34Å; I12-V14 PolarHBondContact O-N 2.8Å; I12-A15 PolarHBondContact O-N 3.1Å; I12-I16 HydrophobicContact CG2-CD1 3.7Å; I12-I16 HydrophobicContact CG2-CG1 4.37Å; I12-I16 WeakPolarHBondContact O-CB 3.44Å; I12-I16 WeakPolarHBondContact O-CG1 3.45Å; I12-I16 PolarHBondContact O-N 3.44Å |
| 13 | V | 81 | Confident | 75 | Confident | 66 Ų | 66 | 98.3 Ų | 98.3 | 40% | 0.4 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -63.8 | -42.3 | 178.1 | -176.7 | 0 | 0 | 0 | 0 | 110.7 | S9 L10 I16 L17 | S9-V13 PolarHBondContact O-N 2.95Å; L10-V13 PolarHBondContact O-N 3.23Å; V13-I16 PolarHBondContact O-N 2.81Å; V13-L17 HydrophobicContact CG1-CD1 4.41Å; V13-L17 PolarHBondContact O-N 3.05Å; V13-L17 VanDerWaalsContact O-N 3.14Å |
| 14 | V | 82.4 | Confident | 77.4 | Confident | 91 Ų | 91 | 97.1 Ų | 97.1 | 55% | 0.552 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -63.8 | -44 | 176.2 | 175.4 | 0 | 0 | 0 | 0 | 111 | L10 I12 I16 L17 F18 | L10-V14 WeakPolarHBondContact O-CG2 3.21Å; L10-V14 PolarHBondContact O-N 3.25Å; L10-V14 VanDerWaalsContact O-N 3.07Å; I12-V14 VanDerWaalsContact C-N 3.34Å; I12-V14 PolarHBondContact O-N 2.8Å; V14-I16 PolarHBondContact O-N 3.02Å; V14-L17 PolarHBondContact O-N 3.45Å; V14-F18 WeakPolarHBondContact O-CB 3.33Å; V14-F18 PolarHBondContact O-N 3.14Å |
| 15 | A | 83.4 | Confident | 79.6 | Confident | 49 Ų | 49 | 98.3 Ų | 98.3 | 41% | 0.405 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -62 | -43 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112 | P11 I12 L17 F18 V19 | P11-A15 VanDerWaalsContact O-CB 3.32Å; P11-A15 WeakPolarHBondContact O-CB 3.22Å; P11-A15 PolarHBondContact O-N 3.34Å; I12-A15 PolarHBondContact O-N 3.1Å; A15-L17 VanDerWaalsContact C-N 3.27Å; A15-L17 PolarHBondContact O-N 2.8Å; A15-F18 PolarHBondContact O-N 2.71Å; A15-V19 WeakPolarHBondContact O-CB 3.28Å; A15-V19 WeakPolarHBondContact O-CG2 3.49Å; A15-V19 PolarHBondContact O-N 2.79Å |
| 16 | I | 86.3 | Confident | 81.6 | Confident | 109 Ų | 109 | 94.2 Ų | 94.2 | 56% | 0.559 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -62.4 | -33.8 | 178.9 | -70 | 167.5 | 0 | 0 | 0 | 111.8 | I12 V13 V14 P20 | I12-I16 HydrophobicContact CG2-CD1 3.7Å; I12-I16 HydrophobicContact CG2-CG1 4.37Å; I12-I16 WeakPolarHBondContact O-CB 3.44Å; I12-I16 WeakPolarHBondContact O-CG1 3.45Å; I12-I16 PolarHBondContact O-N 3.44Å; V13-I16 PolarHBondContact O-N 2.81Å; V14-I16 PolarHBondContact O-N 3.02Å; I16-P20 WeakPolarHBondContact O-CD 3.45Å; I16-P20 WeakPolarHBondContact O-CG 3.31Å |
| 17 | L | 85.6 | Confident | 83.5 | Confident | 121 Ų | 121 | 95.4 Ų | 95.4 | 63% | 0.634 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -85 | -36.6 | 177.5 | -68.4 | 175.6 | 0 | 0 | 0 | 113.3 | V13 V14 A15 P20 | V13-L17 HydrophobicContact CG1-CD1 4.41Å; V13-L17 PolarHBondContact O-N 3.05Å; V13-L17 VanDerWaalsContact O-N 3.14Å; V14-L17 PolarHBondContact O-N 3.45Å; A15-L17 VanDerWaalsContact C-N 3.27Å; A15-L17 PolarHBondContact O-N 2.8Å; L17-P20 WeakPolarHBondContact O-CD 3.48Å; L17-P20 WeakPolarHBondContact O-CG 3.34Å |
| 18 | F | 88.4 | Confident | 85.2 | Confident | 136 Ų | 136 | 96.4 Ų | 96.4 | 60% | 0.596 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -75.2 | -40.6 | -174.4 | -170.8 | -103.5 | 0 | 0 | 0 | 112.4 | V14 A15 A21 V22 | V14-F18 WeakPolarHBondContact O-CB 3.33Å; V14-F18 PolarHBondContact O-N 3.14Å; A15-F18 PolarHBondContact O-N 2.71Å; F18-A21 PolarHBondContact O-N 2.86Å; F18-V22 HydrophobicContact CD1-CG2 3.85Å; F18-V22 HydrophobicContact CD2-CG2 4.5Å; F18-V22 HydrophobicContact CE1-CG2 3.47Å; F18-V22 VanDerWaalsContact CE1-CG2 3.47Å; F18-V22 HydrophobicContact CE2-CG2 4.17Å; F18-V22 HydrophobicContact CG-CG2 4.35Å; F18-V22 HydrophobicContact CZ-CG2 3.65Å; F18-V22 WeakPolarHBondContact O-CG2 3.29Å; F18-V22 PolarHBondContact O-N 3.46Å |
| 19 | V | 89.6 | Confident | 86.4 | Confident | 96 Ų | 96 | 90.2 Ų | 90.2 | 58% | 0.582 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -56.6 | -51 | 179.8 | 172.4 | 0 | 0 | 0 | 0 | 113 | A15 A21 V22 L23 | A15-V19 WeakPolarHBondContact O-CB 3.28Å; A15-V19 WeakPolarHBondContact O-CG2 3.49Å; A15-V19 PolarHBondContact O-N 2.79Å; V19-A21 VanDerWaalsContact C-N 3.35Å; V19-A21 PolarHBondContact O-N 2.98Å; V19-V22 PolarHBondContact O-N 2.99Å; V19-L23 WeakPolarHBondContact O-CB 3.4Å; V19-L23 PolarHBondContact O-N 2.8Å |
| 20 | P | 91.9 | Very high | 87.2 | Confident | 63 Ų | 63 | 91.2 Ų | 91.2 | 41% | 0.409 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -66.7 | -34.7 | 178.3 | 23.9 | -32.4 | 0 | 0 | 0 | 112.6 | I16 L17 L23 V24 | I16-P20 WeakPolarHBondContact O-CD 3.45Å; I16-P20 WeakPolarHBondContact O-CG 3.31Å; L17-P20 WeakPolarHBondContact O-CD 3.48Å; L17-P20 WeakPolarHBondContact O-CG 3.34Å; P20-L23 PolarHBondContact O-N 2.88Å; P20-V24 VanDerWaalsContact O-CG2 3.32Å; P20-V24 WeakPolarHBondContact O-CG2 3.21Å; P20-V24 PolarHBondContact O-N 3.3Å |
| 21 | A | 90.6 | Very high | 88.1 | Confident | 60 Ų | 60 | 87.2 Ų | 87.2 | 50% | 0.496 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.1 | -44.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | F18 V19 V24 F25 | F18-A21 PolarHBondContact O-N 2.86Å; V19-A21 VanDerWaalsContact C-N 3.35Å; V19-A21 PolarHBondContact O-N 2.98Å; A21-V24 PolarHBondContact O-N 3.41Å; A21-F25 PolarHBondContact O-N 2.87Å |
| 22 | V | 93.2 | Very high | 88.3 | Confident | 57 Ų | 57 | 86.2 Ų | 86.2 | 35% | 0.345 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -64.8 | -40.8 | 175.6 | 176 | 0 | 0 | 0 | 0 | 111 | F18 V19 V24 F25 L26 | F18-V22 HydrophobicContact CD1-CG2 3.85Å; F18-V22 HydrophobicContact CD2-CG2 4.5Å; F18-V22 HydrophobicContact CE1-CG2 3.47Å; F18-V22 VanDerWaalsContact CE1-CG2 3.47Å; F18-V22 HydrophobicContact CE2-CG2 4.17Å; F18-V22 HydrophobicContact CG-CG2 4.35Å; F18-V22 HydrophobicContact CZ-CG2 3.65Å; F18-V22 WeakPolarHBondContact O-CG2 3.29Å; F18-V22 PolarHBondContact O-N 3.46Å; V19-V22 PolarHBondContact O-N 2.99Å; V22-V24 PolarHBondContact O-N 3.33Å; V22-F25 PolarHBondContact O-N 3.49Å; V22-L26 HydrophobicContact CG1-CD1 4.13Å; V22-L26 HydrophobicContact CG1-CG 4.38Å; V22-L26 WeakPolarHBondContact O-CG 3.33Å; V22-L26 PolarHBondContact O-N 2.85Å |
| 23 | L | 93.4 | Very high | 88.2 | Confident | 106 Ų | 106 | 86.1 Ų | 86.1 | 56% | 0.555 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -61.1 | -45.4 | 177.7 | -171.3 | 71.2 | 0 | 0 | 0 | 111.8 | V19 P20 L26 L27 | V19-L23 WeakPolarHBondContact O-CB 3.4Å; V19-L23 PolarHBondContact O-N 2.8Å; P20-L23 PolarHBondContact O-N 2.88Å; L23-L26 PolarHBondContact O-N 3.37Å; L23-L27 WeakPolarHBondContact O-CG 3.29Å; L23-L27 PolarHBondContact O-N 3.44Å |
| 24 | V | 93.8 | Very high | 87.7 | Confident | 84 Ų | 84 | 91.9 Ų | 91.9 | 51% | 0.509 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -62.2 | -43.6 | 176.6 | 172.2 | 0 | 0 | 0 | 0 | 111 | P20 A21 V22 L26 L27 I28 | P20-V24 VanDerWaalsContact O-CG2 3.32Å; P20-V24 WeakPolarHBondContact O-CG2 3.21Å; P20-V24 PolarHBondContact O-N 3.3Å; A21-V24 PolarHBondContact O-N 3.41Å; V22-V24 PolarHBondContact O-N 3.33Å; V24-L26 PolarHBondContact O-N 3.41Å; V24-L27 PolarHBondContact O-N 3.07Å; V24-I28 HydrophobicContact CG1-CD1 3.96Å; V24-I28 WeakPolarHBondContact O-CG1 3.44Å; V24-I28 PolarHBondContact O-N 2.8Å |
| 25 | F | 93.2 | Very high | 86.5 | Confident | 133 Ų | 133 | 91.2 Ų | 91.2 | 58% | 0.583 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -60.3 | -45.5 | 176.9 | -175 | -98.3 | 0 | 0 | 0 | 112 | A21 V22 L27 I28 C29 | A21-F25 PolarHBondContact O-N 2.87Å; V22-F25 PolarHBondContact O-N 3.49Å; F25-L27 PolarHBondContact O-N 3.08Å; F25-I28 PolarHBondContact O-N 3.02Å; F25-C29 PolarHBondContact O-N 2.79Å; F25-C29 PolarHBondContact O-SG 3Å |
| 26 | L | 92.7 | Very high | 85.2 | Confident | 97 Ų | 97 | 97.3 Ų | 97.3 | 51% | 0.508 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.3 | -40.8 | 176.5 | -71 | 175.9 | 0 | 0 | 0 | 112.4 | V22 L23 V24 I28 C29 V30 | V22-L26 HydrophobicContact CG1-CD1 4.13Å; V22-L26 HydrophobicContact CG1-CG 4.38Å; V22-L26 WeakPolarHBondContact O-CG 3.33Å; V22-L26 PolarHBondContact O-N 2.85Å; L23-L26 PolarHBondContact O-N 3.37Å; V24-L26 PolarHBondContact O-N 3.41Å; L26-I28 VanDerWaalsContact C-N 3.34Å; L26-I28 PolarHBondContact O-N 3.28Å; L26-C29 PolarHBondContact O-N 3.41Å; L26-V30 WeakPolarHBondContact O-CG2 3.44Å; L26-V30 PolarHBondContact O-N 3.27Å |
| 27 | L | 92.9 | Very high | 83.5 | Confident | 111 Ų | 111 | 97.7 Ų | 97.7 | 58% | 0.581 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -62.3 | -40.9 | 176 | -71.7 | 174 | 0 | 0 | 0 | 112 | L23 V24 F25 V30 A31 | L23-L27 WeakPolarHBondContact O-CG 3.29Å; L23-L27 PolarHBondContact O-N 3.44Å; V24-L27 PolarHBondContact O-N 3.07Å; F25-L27 PolarHBondContact O-N 3.08Å; L27-V30 PolarHBondContact O-N 3.46Å; L27-A31 WeakPolarHBondContact O-CB 3.49Å; L27-A31 PolarHBondContact O-N 3.01Å |
| 28 | I | 91 | Very high | 81.8 | Confident | 93 Ų | 93 | 103 Ų | 103 | 48% | 0.477 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -63.2 | -46.9 | 174.8 | -65.8 | 165.4 | 0 | 0 | 0 | 110.2 | V24 F25 L26 V30 A31 C32 | V24-I28 HydrophobicContact CG1-CD1 3.96Å; V24-I28 WeakPolarHBondContact O-CG1 3.44Å; V24-I28 PolarHBondContact O-N 2.8Å; F25-I28 PolarHBondContact O-N 3.02Å; L26-I28 VanDerWaalsContact C-N 3.34Å; L26-I28 PolarHBondContact O-N 3.28Å; I28-V30 VanDerWaalsContact C-N 3.32Å; I28-V30 PolarHBondContact O-N 2.89Å; I28-A31 PolarHBondContact O-N 3.45Å; I28-C32 WeakPolarHBondContact O-CB 3.3Å; I28-C32 PolarHBondContact O-N 3.22Å; I28-C32 PolarHBondContact O-SG 3.31Å |
| 29 | C | 89 | Confident | 79.9 | Confident | 49 Ų | 49 | 106.1 Ų | 106.1 | 33% | 0.331 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -59 | -41.5 | 177.6 | -68.3 | 0 | 0 | 0 | 0 | 112.5 | F25 L26 S33 | F25-C29 PolarHBondContact O-N 2.79Å; F25-C29 PolarHBondContact O-SG 3Å; L26-C29 PolarHBondContact O-N 3.41Å; C29-S33 VanDerWaalsContact O-CB 3.31Å; C29-S33 WeakPolarHBondContact O-CB 3.22Å; C29-S33 PolarHBondContact O-N 3.23Å; C29-S33 PolarHBondContact O-OG 3.47Å |
| 30 | V | 88.7 | Confident | 77.7 | Confident | 80 Ų | 80 | 104.9 Ų | 104.9 | 49% | 0.485 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -66.6 | -42.8 | 176.3 | 172.4 | 0 | 0 | 0 | 0 | 111.2 | L26 L27 I28 S33 R34 | L26-V30 WeakPolarHBondContact O-CG2 3.44Å; L26-V30 PolarHBondContact O-N 3.27Å; L27-V30 PolarHBondContact O-N 3.46Å; I28-V30 VanDerWaalsContact C-N 3.32Å; I28-V30 PolarHBondContact O-N 2.89Å; V30-S33 PolarHBondContact O-N 2.67Å; V30-R34 WeakPolarHBondContact O-CB 3.46Å; V30-R34 WeakPolarHBondContact O-CG 3.26Å; V30-R34 PolarHBondContact O-N 2.85Å |
| 31 | A | 84.9 | Confident | 75.2 | Confident | 62 Ų | 62 | 111.9 Ų | 111.9 | 51% | 0.512 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -61.7 | -45.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | L27 I28 S33 R34 S35 | L27-A31 WeakPolarHBondContact O-CB 3.49Å; L27-A31 PolarHBondContact O-N 3.01Å; I28-A31 PolarHBondContact O-N 3.45Å; A31-S33 PolarHBondContact O-N 2.87Å; A31-R34 PolarHBondContact O-N 2.86Å; A31-S35 PolarHBondContact O-N 2.85Å; A31-S35 VanDerWaalsContact O-N 3.12Å |
| 32 | C | 82 | Confident | 72.7 | Confident | 69 Ų | 69 | 113.4 Ų | 113.4 | 47% | 0.466 | 61% | 0.608 | S | S | . | * | H | α-helix | trans | -62.6 | -41.7 | 176 | -68.6 | 0 | 0 | 0 | 0 | 111.8 | I28 S35 | I28-C32 WeakPolarHBondContact O-CB 3.3Å; I28-C32 PolarHBondContact O-N 3.22Å; I28-C32 PolarHBondContact O-SG 3.31Å; C32-S35 PolarHBondContact O-N 3.41Å; C32-S35 PolarHBondContact O-OG 2.97Å |
| 33 | S | 79.1 | Confident | 70 | Confident | 76 Ų | 76 | 116.9 Ų | 116.9 | 53% | 0.531 | 63% | 0.629 | S | S | . | * | H | α-helix | trans | -68.4 | -38.2 | 179.4 | -59.2 | 0 | 0 | 0 | 0 | 112.7 | C29 V30 A31 S35 K36 T37 | C29-S33 VanDerWaalsContact O-CB 3.31Å; C29-S33 WeakPolarHBondContact O-CB 3.22Å; C29-S33 PolarHBondContact O-N 3.23Å; C29-S33 PolarHBondContact O-OG 3.47Å; V30-S33 PolarHBondContact O-N 2.67Å; A31-S33 PolarHBondContact O-N 2.87Å; S33-S35 VanDerWaalsContact C-N 3.31Å; S33-S35 PolarHBondContact O-N 3.24Å; S33-K36 PolarHBondContact O-N 3.31Å; S33-T37 PolarHBondContact O-OG1 3.05Å |
| 34 | R | 70.2 | Confident | 67.4 | Low | 187 Ų | 187 | 118 Ų | 118 | 71% | 0.706 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -68.9 | -27.8 | 175.2 | -77 | -169.8 | 169.4 | -175.5 | -1.1 | 113.3 | V30 A31 K36 T37 | V30-R34 WeakPolarHBondContact O-CB 3.46Å; V30-R34 WeakPolarHBondContact O-CG 3.26Å; V30-R34 PolarHBondContact O-N 2.85Å; A31-R34 PolarHBondContact O-N 2.86Å; R34-K36 VanDerWaalsContact C-N 3.32Å; R34-K36 PolarHBondContact O-N 3.4Å; R34-T37 PolarHBondContact O-OG1 2.91Å |
| 35 | S | 57.2 | Low | 64.8 | Low | 77 Ų | 77 | 121 Ų | 121 | 54% | 0.538 | 65% | 0.653 | S | S | . | * | H | α-helix | trans | -69.4 | -29.7 | 177.3 | 77.2 | 0 | 0 | 0 | 0 | 113.2 | A31 C32 S33 | A31-S35 PolarHBondContact O-N 2.85Å; A31-S35 VanDerWaalsContact O-N 3.12Å; C32-S35 PolarHBondContact O-N 3.41Å; C32-S35 PolarHBondContact O-OG 2.97Å; S33-S35 VanDerWaalsContact C-N 3.31Å; S33-S35 PolarHBondContact O-N 3.24Å |
| 36 | K | 55.4 | Low | 61.9 | Low | 178 Ų | 178 | 122.4 Ų | 122.4 | 77% | 0.774 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -82.2 | -24.2 | -178 | -70.1 | -176.4 | 178.2 | 179.8 | 0 | 113.6 | S33 R34 | S33-K36 PolarHBondContact O-N 3.31Å; R34-K36 VanDerWaalsContact C-N 3.32Å; R34-K36 PolarHBondContact O-N 3.4Å |
| 37 | T | 50.7 | Low | 59.1 | Low | 116 Ų | 116 | 120.8 Ų | 120.8 | 71% | 0.712 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.1 | -5.3 | -175.7 | 40.3 | 0 | 0 | 0 | 0 | 115.1 | S33 R34 | S33-T37 PolarHBondContact O-OG1 3.05Å; R34-T37 PolarHBondContact O-OG1 2.91Å |
| 38 | R | 49.6 | Very low | 56.5 | Low | 232 Ų | 232 | 124.2 Ų | 124.2 | 88% | 0.875 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -95.9 | -0.2 | -178 | -94.8 | -171.6 | 176.8 | -164.6 | -0.3 | 116.6 | ||
| 39 | K | 48 | Very low | 53.8 | Low | 203 Ų | 203 | 129.6 Ų | 129.6 | 88% | 0.883 | 71% | 0.706 | S | S | * | * | S | Bend | trans | -111.8 | 14.7 | -171.8 | -76.1 | -170.7 | 174.8 | -179.5 | 0 | 116.9 | ||
| 40 | G | 43.2 | Very low | 51.5 | Low | 70 Ų | 70 | 133.2 Ų | 133.2 | 72% | 0.722 | 73% | 0.727 | S | S | * | * | trans | -147 | 56 | -173.6 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 41 | K | 39.9 | Very low | 48.9 | Very low | 210 Ų | 210 | 136.7 Ų | 136.7 | 91% | 0.913 | 74% | 0.742 | S | S | * | * | trans | -101.1 | 78.5 | 157.5 | -87.2 | -173 | 173.4 | -175.1 | 0 | 108 | V43 | K41-V43 PolarHBondContact O-N 2.88Š| ||
| 42 | A | 37.6 | Very low | 46.4 | Very low | 92 Ų | 92 | 138 Ų | 138 | 76% | 0.76 | 76% | 0.762 | S | S | * | * | trans | -77.2 | 109.1 | 164.1 | 0 | 0 | 0 | 0 | 0 | 107 | V44 | A42-V44 PolarHBondContact O-N 2.9Š| ||
| 43 | V | 37.3 | Very low | 43.9 | Very low | 130 Ų | 130 | 137.9 Ų | 137.9 | 79% | 0.788 | 77% | 0.773 | S | S | * | * | trans | -60.1 | 113.3 | 169.7 | 174.4 | 0 | 0 | 0 | 0 | 107 | K41 D45 | K41-V43 PolarHBondContact O-N 2.88Å; V43-D45 PolarHBondContact O-N 3.24Å | ||
| 44 | V | 40 | Very low | 41.7 | Very low | 129 Ų | 129 | 140.4 Ų | 140.4 | 78% | 0.782 | 78% | 0.78 | S | S | * | * | trans | -81 | 100.7 | 166.2 | 178 | 0 | 0 | 0 | 0 | 105.2 | A42 D46 | A42-V44 PolarHBondContact O-N 2.9Å; V44-D46 PolarHBondContact O-N 3.1Å | ||
| 45 | D | 37.5 | Very low | 40 | Very low | 148 Ų | 148 | 137.7 Ų | 137.7 | 79% | 0.791 | 79% | 0.789 | S | S | * | * | trans | -76 | 113.4 | 170.2 | -159.3 | 28.8 | 0 | 0 | 0 | 107.3 | V43 G47 | V43-D45 PolarHBondContact O-N 3.24Å; D45-G47 PolarHBondContact O-N 3.31Å | ||
| 46 | D | 33.6 | Very low | 38.9 | Very low | 162 Ų | 162 | 138.7 Ų | 138.7 | 87% | 0.866 | 80% | 0.795 | S | S | * | * | trans | -86.6 | 94.5 | -175 | -142.2 | -14.3 | 0 | 0 | 0 | 106.9 | V44 | V44-D46 PolarHBondContact O-N 3.1Š| ||
| 47 | G | 34.2 | Very low | 37.8 | Very low | 63 Ų | 63 | 137.8 Ų | 137.8 | 65% | 0.649 | 79% | 0.792 | S | S | * | * | trans | -164.5 | 104.9 | -168.6 | 0 | 0 | 0 | 0 | 0 | 114.6 | D45 | D45-G47 PolarHBondContact O-N 3.31Š| ||
| 48 | E | 37.2 | Very low | 37.1 | Very low | 182 Ų | 182 | 138.1 Ų | 138.1 | 85% | 0.85 | 79% | 0.793 | S | S | * | * | trans | 95 | 104.8 | 151.1 | -143.1 | 170.8 | 132.8 | 0 | 0 | 118.1 | V50 | E48-V50 PolarHBondContact O-N 3.48Š| ||
| 49 | K | 34.9 | Very low | 36.2 | Very low | 207 Ų | 207 | 133.4 Ų | 133.4 | 90% | 0.9 | 78% | 0.781 | S | S | * | * | trans | -52 | 111.4 | 165.6 | -65 | 169.4 | 175.6 | 175 | 0 | 110.6 | ||||
| 50 | V | 40.6 | Very low | 35.7 | Very low | 125 Ų | 125 | 129.8 Ų | 129.8 | 76% | 0.758 | 77% | 0.77 | S | S | * | * | trans | -123.7 | 116.9 | 161.4 | -173.4 | 0 | 0 | 0 | 0 | 108.9 | E48 | E48-V50 PolarHBondContact O-N 3.48Š| ||
| 51 | N | 33.6 | Very low | 35.4 | Very low | 152 Ų | 152 | 134.2 Ų | 134.2 | 81% | 0.813 | 77% | 0.77 | S | S | * | * | trans | -53.3 | 149.7 | 177.9 | -70.3 | -44 | 0 | 0 | 0 | 112.1 | G53 | N51-G53 PolarHBondContact O-N 3.48Š| ||
| 52 | G | 32 | Very low | 35.1 | Very low | 90 Ų | 90 | 131.7 Ų | 131.7 | 93% | 0.928 | 77% | 0.767 | S | S | * | * | S | Bend | trans | -14.9 | 110.8 | -179.6 | 0 | 0 | 0 | 0 | 0 | 117 | ||
| 53 | G | 30.2 | Very low | 35 | Very low | 67 Ų | 67 | 136.1 Ų | 136.1 | 69% | 0.691 | 77% | 0.765 | S | S | * | * | trans | -154.4 | 122.6 | 176 | 0 | 0 | 0 | 0 | 0 | 111 | N51 | N51-G53 PolarHBondContact O-N 3.48Š| ||
| 54 | D | 32 | Very low | 34.8 | Very low | 129 Ų | 129 | 140.8 Ų | 140.8 | 69% | 0.69 | 77% | 0.768 | S | S | * | * | trans | 30 | 93.4 | 156.3 | -80.5 | -34.6 | 0 | 0 | 0 | 118.3 | S56 | D54-S56 PolarHBondContact O-N 2.87Å; D54-S56 VanDerWaalsContact O-N 3.08Å | ||
| 55 | C | 35.1 | Very low | 34.4 | Very low | 130 Ų | 130 | 143.3 Ų | 143.3 | 88% | 0.878 | 78% | 0.776 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.6 | 6.3 | 164.3 | -62.5 | 0 | 0 | 0 | 0 | 113.8 | K57 | C55-K57 VanDerWaalsContact C-N 3.32Å; C55-K57 PolarHBondContact O-N 2.9Å |
| 56 | S | 34.7 | Very low | 34.4 | Very low | 97 Ų | 97 | 142.9 Ų | 142.9 | 68% | 0.678 | 77% | 0.774 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -86.6 | 4 | -178.9 | 78.5 | 0 | 0 | 0 | 0 | 114.5 | D54 | D54-S56 PolarHBondContact O-N 2.87Å; D54-S56 VanDerWaalsContact O-N 3.08Å |
| 57 | K | 33 | Very low | 34.4 | Very low | 160 Ų | 160 | 140.3 Ų | 140.3 | 70% | 0.696 | 77% | 0.766 | S | S | * | * | trans | -128.7 | 54.3 | -178.9 | -70 | -178.8 | -179.4 | 168.8 | 0 | 112.8 | C55 Q59 | C55-K57 VanDerWaalsContact C-N 3.32Å; C55-K57 PolarHBondContact O-N 2.9Å; K57-Q59 PolarHBondContact O-N 2.73Å | ||
| 58 | V | 34.6 | Very low | 34.2 | Very low | 123 Ų | 123 | 146.2 Ų | 146.2 | 75% | 0.745 | 78% | 0.776 | S | S | * | * | trans | -75.4 | 88.5 | 157.6 | -173.4 | 0 | 0 | 0 | 0 | 106.9 | L60 | V58-L60 PolarHBondContact O-N 2.77Š| ||
| 59 | Q | 31.5 | Very low | 34.2 | Very low | 133 Ų | 133 | 143.9 Ų | 143.9 | 62% | 0.621 | 77% | 0.768 | S | S | * | * | trans | -62 | 110.5 | 169.3 | -76 | -174.8 | 25 | 0 | 0 | 107.9 | K57 K61 | K57-Q59 PolarHBondContact O-N 2.73Å; Q59-K61 HydrophobicContact CB-CG 4.42Å; Q59-K61 PolarHBondContact O-N 2.98Å | ||
| 60 | L | 37.7 | Very low | 33.8 | Very low | 126 Ų | 126 | 142.1 Ų | 142.1 | 66% | 0.66 | 76% | 0.763 | S | S | * | * | trans | -70.3 | 62.3 | 165.5 | -70.8 | 161.8 | 0 | 0 | 0 | 109.4 | V58 N62 Y63 | V58-L60 PolarHBondContact O-N 2.77Å; L60-N62 PolarHBondContact O-N 2.83Å; L60-Y63 HydrophobicContact CB-CD2 3.99Å; L60-Y63 HydrophobicContact CB-CE2 3.84Å; L60-Y63 HydrophobicContact CD1-CE2 4.21Å; L60-Y63 HydrophobicContact CD2-CE2 3.62Å; L60-Y63 HydrophobicContact CG-CE2 4.07Å | ||
| 61 | K | 36.1 | Very low | 33.6 | Very low | 163 Ų | 163 | 143 Ų | 143 | 71% | 0.709 | 76% | 0.762 | S | S | * | * | trans | -76.7 | 76.8 | 165.1 | -88 | -179.2 | 172.8 | 172.7 | 0 | 107.1 | Q59 | Q59-K61 HydrophobicContact CB-CG 4.42Å; Q59-K61 PolarHBondContact O-N 2.98Å | ||
| 62 | N | 33.7 | Very low | 33.3 | Very low | 158 Ų | 158 | 141.7 Ų | 141.7 | 85% | 0.845 | 76% | 0.76 | S | S | * | * | trans | 171.7 | 60.9 | 158.7 | -84.6 | -27 | 0 | 0 | 0 | 109.9 | L60 | L60-N62 PolarHBondContact O-N 2.83Š| ||
| 63 | Y | 36.5 | Very low | 33.4 | Very low | 185 Ų | 185 | 148.6 Ų | 148.6 | 73% | 0.725 | 76% | 0.758 | S | S | * | * | S | Bend | trans | -117.6 | 127.2 | 158 | -74.1 | -91 | 0 | 0 | 0 | 108.2 | L60 | L60-Y63 HydrophobicContact CB-CD2 3.99Å; L60-Y63 HydrophobicContact CB-CE2 3.84Å; L60-Y63 HydrophobicContact CD1-CE2 4.21Å; L60-Y63 HydrophobicContact CD2-CE2 3.62Å; L60-Y63 HydrophobicContact CG-CE2 4.07Å |
| 64 | R | 33.1 | Very low | 33.3 | Very low | 228 Ų | 228 | 151.7 Ų | 151.7 | 86% | 0.86 | 76% | 0.763 | S | S | * | * | trans | -12.9 | 125.6 | 170.7 | -94 | 170.9 | 166.5 | 172.3 | -5.1 | 113.3 | L66 | R64-L66 VanDerWaalsContact C-N 3.27Å; R64-L66 PolarHBondContact O-N 2.72Å | ||
| 65 | L | 30.5 | Very low | 33.2 | Very low | 181 Ų | 181 | 151.2 Ų | 151.2 | 95% | 0.948 | 77% | 0.767 | S | S | * | * | trans | -47.8 | 99.7 | 151 | -104.2 | 86.6 | 0 | 0 | 0 | 107.6 | ||||
| 66 | L | 37.6 | Very low | 33 | Very low | 140 Ų | 140 | 149.9 Ų | 149.9 | 73% | 0.733 | 76% | 0.759 | S | S | * | * | trans | -71.4 | 146.5 | 154.5 | -80.6 | 105.8 | 0 | 0 | 0 | 106.8 | R64 E68 | R64-L66 VanDerWaalsContact C-N 3.27Å; R64-L66 PolarHBondContact O-N 2.72Å; L66-E68 PolarHBondContact O-N 3.49Å | ||
| 67 | P | 34.5 | Very low | 32.6 | Very low | 108 Ų | 108 | 150.8 Ų | 150.8 | 70% | 0.701 | 77% | 0.765 | S | S | * | * | trans | -52.9 | 136.3 | 178.9 | 22.3 | -31.7 | 0 | 0 | 0 | 109.6 | I69 | P67-I69 VanDerWaalsContact C-N 3.34Å; P67-I69 PolarHBondContact O-N 3.42Å | ||
| 68 | E | 30.2 | Very low | 32.5 | Very low | 187 Ų | 187 | 147.2 Ų | 147.2 | 87% | 0.874 | 77% | 0.766 | S | S | * | * | trans | -60.1 | 88.7 | -174.9 | -167.9 | 174.9 | -163.3 | 0 | 0 | 110.6 | L66 Q70 | L66-E68 PolarHBondContact O-N 3.49Å; E68-Q70 PolarHBondContact O-N 2.92Å | ||
| 69 | I | 35.8 | Very low | 32.3 | Very low | 133 Ų | 133 | 145.9 Ų | 145.9 | 68% | 0.682 | 77% | 0.768 | S | S | * | * | trans | -85.1 | 109.2 | 170.1 | -61.9 | 167 | 0 | 0 | 0 | 106 | P67 I71 | P67-I69 VanDerWaalsContact C-N 3.34Å; P67-I69 PolarHBondContact O-N 3.42Å; I69-I71 HydrophobicContact CG2-CG1 4.3Å; I69-I71 PolarHBondContact O-N 3.44Å | ||
| 70 | Q | 26.3 | Very low | 32.3 | Very low | 170 Ų | 170 | 145.4 Ų | 145.4 | 79% | 0.794 | 77% | 0.774 | S | S | * | * | trans | -61.8 | 104.5 | 173 | -69.8 | -178.3 | 18.3 | 0 | 0 | 109.5 | E68 | E68-Q70 PolarHBondContact O-N 2.92Š| ||
| 71 | I | 36.7 | Very low | 31.8 | Very low | 143 Ų | 143 | 148.4 Ų | 148.4 | 73% | 0.733 | 79% | 0.785 | S | S | * | * | trans | -98.4 | 99.4 | 170.6 | -57.5 | 173 | 0 | 0 | 0 | 107.5 | I69 R73 | I69-I71 HydrophobicContact CG2-CG1 4.3Å; I69-I71 PolarHBondContact O-N 3.44Å; I71-R73 PolarHBondContact O-N 3.3Å; I71-R73 VanDerWaalsContact O-N 3.15Å | ||
| 72 | T | 28.6 | Very low | 31.6 | Very low | 124 Ų | 124 | 147.5 Ų | 147.5 | 76% | 0.761 | 79% | 0.793 | S | S | * | * | trans | -66.4 | 106.4 | 171.3 | -33.9 | 0 | 0 | 0 | 0 | 108.7 | V74 | T72-V74 PolarHBondContact O-N 3.28Š| ||
| 73 | R | 32.6 | Very low | 31.4 | Very low | 235 Ų | 235 | 151.6 Ų | 151.6 | 89% | 0.887 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -74.2 | 119 | 173.2 | -79.2 | -176.5 | 178.1 | 158.3 | -0.3 | 109.8 | I71 | I71-R73 PolarHBondContact O-N 3.3Å; I71-R73 VanDerWaalsContact O-N 3.15Å |
| 74 | V | 29.4 | Very low | 31 | Very low | 133 Ų | 133 | 147.9 Ų | 147.9 | 81% | 0.806 | 80% | 0.797 | S | S | * | * | P | Polyproline II helix | trans | -97.6 | 122.9 | 164.1 | -175.5 | 0 | 0 | 0 | 0 | 108.1 | T72 | T72-V74 PolarHBondContact O-N 3.28Š|
| 75 | P | 28.5 | Very low | 30.7 | Very low | 118 Ų | 118 | 141.6 Ų | 141.6 | 77% | 0.766 | 79% | 0.789 | S | S | * | * | P | Polyproline II helix | trans | -92.9 | 135.6 | -179.5 | 34.6 | -28.9 | 0 | 0 | 0 | 111.1 | ||
| 76 | S | 31.7 | Very low | 30.6 | Very low | 102 Ų | 102 | 140.6 Ų | 140.6 | 71% | 0.713 | 78% | 0.784 | S | S | * | * | trans | -165.3 | 111.6 | 162.3 | 169.2 | 0 | 0 | 0 | 0 | 105.6 | ||||
| 77 | S | 26.7 | Very low | 30.2 | Very low | 116 Ų | 116 | 141 Ų | 141 | 81% | 0.811 | 79% | 0.792 | S | S | * | * | cis | 58.8 | 73.2 | 42.5 | 87.6 | 0 | 0 | 0 | 0 | 114.2 | ||||
| 78 | A | 30.5 | Very low | 30 | Very low | 85 Ų | 85 | 140.4 Ų | 140.4 | 70% | 0.702 | 79% | 0.791 | S | S | * | * | trans | -167.3 | 114.1 | 149.5 | 0 | 0 | 0 | 0 | 0 | 106.2 | ||||
| 79 | A | 31.2 | Very low | 30 | Very low | 95 Ų | 95 | 139.3 Ų | 139.3 | 79% | 0.785 | 79% | 0.79 | S | S | * | * | 73.4 | 126.6 | 96.7 | 0 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 80 | T | 30.4 | Very low | 29.6 | Very low | 124 Ų | 124 | 143 Ų | 143 | 76% | 0.761 | 80% | 0.795 | S | S | * | * | cis | -163.1 | 152.2 | 3.9 | -57.5 | 0 | 0 | 0 | 0 | 106.4 | T82 | T80-T82 PolarHBondContact O-N 3.41Š| ||
| 81 | Q | 27.6 | Very low | 29.8 | Very low | 189 Ų | 189 | 141.1 Ų | 141.1 | 88% | 0.883 | 80% | 0.795 | S | S | * | * | trans | -51 | 119.9 | 172.2 | -164.8 | 176 | 51.8 | 0 | 0 | 112.7 | ||||
| 82 | T | 31.2 | Very low | 29.7 | Very low | 143 Ų | 143 | 140.5 Ų | 140.5 | 88% | 0.877 | 80% | 0.798 | S | S | * | * | trans | -139.9 | 132.7 | 160 | -5.7 | 0 | 0 | 0 | 0 | 111.2 | T80 | T80-T82 PolarHBondContact O-N 3.41Š| ||
| 83 | R | 29.2 | Very low | 29.8 | Very low | 245 Ų | 245 | 143.3 Ų | 143.3 | 93% | 0.925 | 80% | 0.802 | S | S | * | * | trans | -80.6 | 145.5 | -167.3 | -144.6 | 176.7 | -175.4 | 173.9 | -0.5 | 109.7 | ||||
| 84 | S | 28.7 | Very low | 29.8 | Very low | 106 Ų | 106 | 141.5 Ų | 141.5 | 74% | 0.741 | 80% | 0.801 | S | S | * | * | S | Bend | trans | 78.3 | 103.7 | 163.5 | -140 | 0 | 0 | 0 | 0 | 117.3 | ||
| 85 | S | 27.2 | Very low | 30.2 | Very low | 97 Ų | 97 | 142.3 Ų | 142.3 | 68% | 0.678 | 81% | 0.806 | S | S | * | * | trans | 38.8 | 89.1 | 133.6 | 60.9 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 86 | D | 28.8 | Very low | 30.3 | Very low | 160 Ų | 160 | 143.8 Ų | 143.8 | 86% | 0.856 | 81% | 0.807 | S | S | * | * | trans | -171.8 | 104.4 | 137.2 | -95.6 | -28.6 | 0 | 0 | 0 | 108.5 | S88 | D86-S88 VanDerWaalsContact C-N 3.26Å; D86-S88 PolarHBondContact O-N 2.88Å | ||
| 87 | V | 29.1 | Very low | 30.6 | Very low | 149 Ų | 149 | 147.8 Ų | 147.8 | 90% | 0.903 | 82% | 0.815 | S | S | * | * | trans | -72.4 | 89.1 | 172.6 | 176.6 | 0 | 0 | 0 | 0 | 107.2 | L89 | V87-L89 PolarHBondContact O-N 2.92Š| ||
| 88 | S | 29.2 | Very low | 30.9 | Very low | 95 Ų | 95 | 150.6 Ų | 150.6 | 66% | 0.664 | 82% | 0.819 | S | S | * | * | trans | -68.2 | 96.7 | 172.5 | 166 | 0 | 0 | 0 | 0 | 110.1 | D86 R90 | D86-S88 VanDerWaalsContact C-N 3.26Å; D86-S88 PolarHBondContact O-N 2.88Å; S88-R90 PolarHBondContact O-N 3.36Å | ||
| 89 | L | 30.2 | Very low | 30.9 | Very low | 164 Ų | 164 | 149.9 Ų | 149.9 | 86% | 0.859 | 82% | 0.82 | S | S | * | * | trans | -43.5 | 98.5 | 145.8 | -86.6 | 143.3 | 0 | 0 | 0 | 110.1 | V87 | V87-L89 PolarHBondContact O-N 2.92Š| ||
| 90 | R | 28.9 | Very low | 31.1 | Very low | 210 Ų | 210 | 154.1 Ų | 154.1 | 79% | 0.792 | 83% | 0.829 | S | S | * | * | trans | -165.2 | 126.1 | 158.2 | -111.2 | 167.7 | -170.2 | -179.2 | 4 | 107.6 | S88 | S88-R90 PolarHBondContact O-N 3.36Š| ||
| 91 | T | 30.1 | Very low | 31.1 | Very low | 130 Ų | 130 | 151.8 Ų | 151.8 | 80% | 0.798 | 83% | 0.83 | S | S | * | * | trans | 69.1 | 121.9 | 161.7 | 62.5 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 92 | V | 35 | Very low | 31.5 | Very low | 131 Ų | 131 | 146.2 Ų | 146.2 | 79% | 0.794 | 82% | 0.823 | S | S | * | * | -157.4 | 102.5 | 66 | 172.7 | 0 | 0 | 0 | 0 | 107.6 | |||||
| 93 | H | 29.1 | Very low | 31.9 | Very low | 183 Ų | 183 | 145.6 Ų | 145.6 | 85% | 0.847 | 81% | 0.814 | S | S | * | * | trans | -36.9 | 147.7 | 146.5 | -87.2 | -97.6 | 0 | 0 | 0 | 110.5 | ||||
| 94 | K | 33.5 | Very low | 32.5 | Very low | 197 Ų | 197 | 137.7 Ų | 137.7 | 86% | 0.857 | 79% | 0.794 | S | S | * | * | trans | 107.9 | 42.8 | 158.3 | -147.7 | -176.6 | -162.1 | -177.6 | 0 | 117.7 | ||||
| 95 | V | 37.3 | Very low | 33.4 | Very low | 150 Ų | 150 | 136.1 Ų | 136.1 | 91% | 0.909 | 79% | 0.787 | S | S | * | * | trans | -129.9 | 48.2 | 155.6 | -159.4 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 96 | D | 31.9 | Very low | 34.1 | Very low | 148 Ų | 148 | 137.6 Ų | 137.6 | 79% | 0.791 | 79% | 0.788 | S | S | * | * | trans | -111.7 | 90.4 | 164 | -169.7 | 22.8 | 0 | 0 | 0 | 104.8 | ||||
| 97 | Q | 36.1 | Very low | 34.7 | Very low | 187 Ų | 187 | 132.3 Ų | 132.3 | 87% | 0.874 | 76% | 0.763 | S | S | * | * | S | Bend | trans | -177.8 | -7.2 | 160.2 | -106.9 | 163.9 | 59.5 | 0 | 0 | 118 | ||
| 98 | L | 34 | Very low | 35.5 | Very low | 174 Ų | 174 | 130.1 Ų | 130.1 | 91% | 0.911 | 75% | 0.746 | S | S | * | * | S | Bend | trans | -136.7 | 79.2 | -176.7 | -81.7 | 152.6 | 0 | 0 | 0 | 112.6 | ||
| 99 | G | 29.5 | Very low | 36.5 | Very low | 70 Ų | 70 | 129.6 Ų | 129.6 | 72% | 0.722 | 74% | 0.739 | S | S | * | * | S | Bend | trans | 53.1 | 108.3 | 146 | 0 | 0 | 0 | 0 | 0 | 119 | ||
| 100 | L | 35.5 | Very low | 37.3 | Very low | 184 Ų | 184 | 127.9 Ų | 127.9 | 96% | 0.963 | 72% | 0.722 | S | S | * | * | S | Bend | trans | 71.6 | 54.4 | 171.7 | -63.6 | 134.2 | 0 | 0 | 0 | 113.8 | G102 | L100-G102 PolarHBondContact O-N 3.41Š|
| 101 | G | 31.4 | Very low | 38.3 | Very low | 76 Ų | 76 | 123.2 Ų | 123.2 | 78% | 0.784 | 71% | 0.709 | S | S | * | * | trans | -58.5 | 115.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | L103 | G101-L103 PolarHBondContact O-N 3.33Š| ||
| 102 | G | 35 | Very low | 39.4 | Very low | 71 Ų | 71 | 121.1 Ų | 121.1 | 73% | 0.732 | 69% | 0.692 | S | S | * | * | P | Polyproline II helix | trans | -53.9 | 120.6 | 167 | 0 | 0 | 0 | 0 | 0 | 109.6 | L100 P104 | L100-G102 PolarHBondContact O-N 3.41Å; G102-P104 WeakPolarHBondContact O-CD 3.17Å; G102-P104 VanDerWaalsContact O-N 3.13Å |
| 103 | L | 40.5 | Very low | 40.4 | Very low | 131 Ų | 131 | 118.9 Ų | 118.9 | 69% | 0.686 | 67% | 0.673 | S | S | * | * | P | Polyproline II helix | trans | -52.1 | 120.3 | 168.8 | -82.4 | 157.9 | 0 | 0 | 0 | 107.1 | G101 A105 | G101-L103 PolarHBondContact O-N 3.33Å; L103-A105 PolarHBondContact O-N 3.37Å |
| 104 | P | 42.5 | Very low | 41.7 | Very low | 78 Ų | 78 | 114.5 Ų | 114.5 | 51% | 0.506 | 65% | 0.653 | S | S | . | * | P | Polyproline II helix | trans | -56.8 | 132.8 | 176.6 | 21.3 | -28.3 | 0 | 0 | 0 | 107.2 | G102 D106 S107 | G102-P104 WeakPolarHBondContact O-CD 3.17Å; G102-P104 VanDerWaalsContact O-N 3.13Å; P104-D106 HydrophobicContact CB-CB 4.45Å; P104-D106 PolarHBondContact O-N 3.12Å; P104-S107 WeakPolarHBondContact O-CB 3.47Å; P104-S107 PolarHBondContact O-N 3.39Å |
| 105 | A | 45.7 | Very low | 42.8 | Very low | 74 Ų | 74 | 108.9 Ų | 108.9 | 61% | 0.612 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -52.1 | -24.2 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | L103 L108 T109 | L103-A105 PolarHBondContact O-N 3.37Å; A105-L108 PolarHBondContact O-N 2.91Å; A105-T109 PolarHBondContact O-N 3.1Å; A105-T109 PolarHBondContact O-OG1 3.13Å |
| 106 | D | 43.6 | Very low | 43.8 | Very low | 128 Ų | 128 | 108.6 Ų | 108.6 | 68% | 0.684 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -68.2 | -31.4 | 175.4 | -53.2 | -15.2 | 0 | 0 | 0 | 113.1 | P104 T109 Y110 | P104-D106 HydrophobicContact CB-CB 4.45Å; P104-D106 PolarHBondContact O-N 3.12Å; D106-T109 WeakPolarHBondContact CA-OG1 3.23Å; D106-T109 PolarHBondContact O-OG1 3.06Å; D106-Y110 VanDerWaalsContact O-CB 3.25Å; D106-Y110 WeakPolarHBondContact O-CB 3.22Å; D106-Y110 PolarHBondContact O-N 3.29Å |
| 107 | S | 41 | Very low | 44.8 | Very low | 49 Ų | 49 | 108.1 Ų | 108.1 | 34% | 0.343 | 61% | 0.611 | S | S | . | * | H | α-helix | trans | -75.2 | -34.9 | 175.6 | -176.9 | 0 | 0 | 0 | 0 | 111.8 | P104 E111 | P104-S107 WeakPolarHBondContact O-CB 3.47Å; P104-S107 PolarHBondContact O-N 3.39Å; S107-E111 WeakPolarHBondContact O-CB 3.2Å; S107-E111 VanDerWaalsContact O-CG 3.22Å; S107-E111 WeakPolarHBondContact O-CG 3.41Å; S107-E111 PolarHBondContact O-N 3.03Å |
| 108 | L | 45.5 | Very low | 45.6 | Very low | 103 Ų | 103 | 102.9 Ų | 102.9 | 54% | 0.539 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -78.2 | -33.4 | -179.1 | -148.6 | 143.6 | 0 | 0 | 0 | 111.2 | A105 L112 | A105-L108 PolarHBondContact O-N 2.91Å; L108-L112 HydrophobicContact CD2-CD1 3.87Å; L108-L112 WeakPolarHBondContact O-CB 3.16Å; L108-L112 WeakPolarHBondContact O-CG 3.33Å; L108-L112 PolarHBondContact O-N 3.34Å |
| 109 | T | 49.3 | Very low | 46.3 | Very low | 84 Ų | 84 | 100.1 Ų | 100.1 | 52% | 0.515 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -69.1 | -38.6 | 169.1 | 37.9 | 0 | 0 | 0 | 0 | 112.1 | A105 D106 L112 E113 | A105-T109 PolarHBondContact O-N 3.1Å; A105-T109 PolarHBondContact O-OG1 3.13Å; D106-T109 WeakPolarHBondContact CA-OG1 3.23Å; D106-T109 PolarHBondContact O-OG1 3.06Å; T109-L112 PolarHBondContact O-N 2.7Å; T109-E113 VanDerWaalsContact O-CB 3.31Å; T109-E113 WeakPolarHBondContact O-CB 3.3Å; T109-E113 PolarHBondContact O-N 3.25Å |
| 110 | Y | 48.5 | Very low | 47.2 | Very low | 128 Ų | 128 | 100.2 Ų | 100.2 | 50% | 0.502 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -64.4 | -43.7 | 174.3 | -174.6 | -99 | 0 | 0 | 0 | 112.7 | D106 E113 Q114 | D106-Y110 VanDerWaalsContact O-CB 3.25Å; D106-Y110 WeakPolarHBondContact O-CB 3.22Å; D106-Y110 PolarHBondContact O-N 3.29Å; Y110-E113 PolarHBondContact O-N 3.42Å; Y110-Q114 HydrophobicContact CD1-CG 4.37Å; Y110-Q114 HydrophobicContact CE1-CG 3.97Å; Y110-Q114 WeakPolarHBondContact O-CB 3.36Å; Y110-Q114 PolarHBondContact O-N 3.27Å; Y110-Q114 PolarHBondContact OH-NE2 3.27Å; Y110-Q114 VanDerWaalsContact OH-NE2 3.1Å |
| 111 | E | 48.4 | Very low | 47.8 | Very low | 112 Ų | 112 | 99.2 Ų | 99.2 | 52% | 0.523 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -62.1 | -44.6 | 173.9 | -74.3 | -82 | 145.8 | 0 | 0 | 111.4 | S107 E113 Q114 V115 | S107-E111 WeakPolarHBondContact O-CB 3.2Å; S107-E111 VanDerWaalsContact O-CG 3.22Å; S107-E111 WeakPolarHBondContact O-CG 3.41Å; S107-E111 PolarHBondContact O-N 3.03Å; E111-E113 VanDerWaalsContact C-N 3.34Å; E111-E113 PolarHBondContact O-N 3.22Å; E111-Q114 PolarHBondContact O-N 3.45Å; E111-V115 WeakPolarHBondContact O-CB 3.39Å; E111-V115 VanDerWaalsContact O-CG2 3.28Å; E111-V115 WeakPolarHBondContact O-CG2 3.39Å; E111-V115 PolarHBondContact O-N 2.96Å |
| 112 | L | 54.1 | Low | 48.4 | Very low | 85 Ų | 85 | 99.2 Ų | 99.2 | 45% | 0.445 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -61.8 | -41.1 | 174.7 | -87.8 | 163.1 | 0 | 0 | 0 | 112.3 | L108 T109 V115 Q116 L145 | L108-L112 HydrophobicContact CD2-CD1 3.87Å; L108-L112 WeakPolarHBondContact O-CB 3.16Å; L108-L112 WeakPolarHBondContact O-CG 3.33Å; L108-L112 PolarHBondContact O-N 3.34Å; T109-L112 PolarHBondContact O-N 2.7Å; L112-V115 PolarHBondContact O-N 3.05Å; L112-Q116 WeakPolarHBondContact O-CB 3.39Å; L112-Q116 PolarHBondContact O-N 2.99Å; L112-L145 HydrophobicContact CD2-CD1 4.31Å |
| 113 | E | 55.3 | Low | 48.7 | Very low | 85 Ų | 85 | 102.3 Ų | 102.3 | 40% | 0.397 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -69.8 | -35.1 | 178.4 | -152 | -168.2 | -166.5 | 0 | 0 | 111.4 | T109 Y110 E111 R117 | T109-E113 VanDerWaalsContact O-CB 3.31Å; T109-E113 WeakPolarHBondContact O-CB 3.3Å; T109-E113 PolarHBondContact O-N 3.25Å; Y110-E113 PolarHBondContact O-N 3.42Å; E111-E113 VanDerWaalsContact C-N 3.34Å; E111-E113 PolarHBondContact O-N 3.22Å; E113-R117 WeakPolarHBondContact O-CB 3.03Å; E113-R117 WeakPolarHBondContact O-CG 3.32Å; E113-R117 PolarHBondContact O-N 2.85Å; E113-R117 IonicContact OE1-CZ 3.51Å; E113-R117 IonicContact OE1-NH1 3.62Å; E113-R117 IonicContact OE1-NH2 2.81Å; E113-R117 PolarHBondContact OE1-NH2 3.42Å; E113-R117 IonicContact OE2-CZ 3.57Å; E113-R117 IonicContact OE2-NH1 2.88Å; E113-R117 PolarHBondContact OE2-NH1 3.48Å; E113-R117 IonicContact OE2-NH2 3.44Å; E113-R117 PolarHBondContact OE2-NH2 3.5Å |
| 114 | Q | 57.9 | Low | 48.5 | Very low | 91 Ų | 91 | 104.4 Ų | 104.4 | 43% | 0.425 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -66.3 | -46.1 | 171.7 | -85.4 | -154.2 | 7.6 | 0 | 0 | 112.2 | Y110 E111 Q116 R117 S118 | Y110-Q114 HydrophobicContact CD1-CG 4.37Å; Y110-Q114 HydrophobicContact CE1-CG 3.97Å; Y110-Q114 WeakPolarHBondContact O-CB 3.36Å; Y110-Q114 PolarHBondContact O-N 3.27Å; Y110-Q114 PolarHBondContact OH-NE2 3.27Å; Y110-Q114 VanDerWaalsContact OH-NE2 3.1Å; E111-Q114 PolarHBondContact O-N 3.45Å; Q114-Q116 VanDerWaalsContact C-N 3.28Å; Q114-Q116 PolarHBondContact O-N 3.2Å; Q114-R117 PolarHBondContact O-N 3.16Å; Q114-S118 WeakPolarHBondContact O-CB 3.34Å; Q114-S118 PolarHBondContact O-N 3.1Å |
| 115 | V | 56.1 | Low | 48.1 | Very low | 79 Ų | 79 | 105.8 Ų | 105.8 | 48% | 0.479 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -63.2 | -39.7 | 177.2 | 172.3 | 0 | 0 | 0 | 0 | 110.1 | E111 L112 S118 L119 | E111-V115 WeakPolarHBondContact O-CB 3.39Å; E111-V115 VanDerWaalsContact O-CG2 3.28Å; E111-V115 WeakPolarHBondContact O-CG2 3.39Å; E111-V115 PolarHBondContact O-N 2.96Å; L112-V115 PolarHBondContact O-N 3.05Å; V115-S118 PolarHBondContact O-N 3.47Å; V115-L119 HydrophobicContact CG1-CD1 4.05Å; V115-L119 WeakPolarHBondContact O-CB 3.31Å; V115-L119 WeakPolarHBondContact O-CD1 3.46Å; V115-L119 PolarHBondContact O-N 3.34Å |
| 116 | Q | 57.2 | Low | 47.3 | Very low | 143 Ų | 143 | 108.5 Ų | 108.5 | 67% | 0.668 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -67.2 | -39.8 | 176.3 | -168.5 | 175.9 | -3.6 | 0 | 0 | 112.4 | L112 Q114 A120 | L112-Q116 WeakPolarHBondContact O-CB 3.39Å; L112-Q116 PolarHBondContact O-N 2.99Å; Q114-Q116 VanDerWaalsContact C-N 3.28Å; Q114-Q116 PolarHBondContact O-N 3.2Å; Q116-A120 VanDerWaalsContact O-CB 3.29Å; Q116-A120 WeakPolarHBondContact O-CB 3.46Å; Q116-A120 PolarHBondContact O-N 3.28Å |
| 117 | R | 52.7 | Low | 46.6 | Very low | 138 Ų | 138 | 106.3 Ų | 106.3 | 52% | 0.521 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -65.9 | -43.5 | 172.4 | -77.8 | -177 | -177.7 | 111.3 | 8.9 | 111.6 | E113 Q114 L119 A120 E121 | E113-R117 WeakPolarHBondContact O-CB 3.03Å; E113-R117 WeakPolarHBondContact O-CG 3.32Å; E113-R117 PolarHBondContact O-N 2.85Å; E113-R117 IonicContact OE1-CZ 3.51Å; E113-R117 IonicContact OE1-NH1 3.62Å; E113-R117 IonicContact OE1-NH2 2.81Å; E113-R117 PolarHBondContact OE1-NH2 3.42Å; E113-R117 IonicContact OE2-CZ 3.57Å; E113-R117 IonicContact OE2-NH1 2.88Å; E113-R117 PolarHBondContact OE2-NH1 3.48Å; E113-R117 IonicContact OE2-NH2 3.44Å; E113-R117 PolarHBondContact OE2-NH2 3.5Å; Q114-R117 PolarHBondContact O-N 3.16Å; R117-L119 VanDerWaalsContact C-N 3.35Å; R117-L119 PolarHBondContact O-N 3.12Å; R117-A120 PolarHBondContact O-N 3.42Å; R117-E121 VanDerWaalsContact O-CB 3.29Å; R117-E121 WeakPolarHBondContact O-CB 3.46Å; R117-E121 PolarHBondContact O-N 2.93Å |
| 118 | S | 53.5 | Low | 45.9 | Very low | 77 Ų | 77 | 113 Ų | 113 | 54% | 0.538 | 60% | 0.601 | S | S | . | * | H | α-helix | trans | -65.1 | -36.3 | 178.6 | -174.3 | 0 | 0 | 0 | 0 | 112.5 | Q114 V115 S122 | Q114-S118 WeakPolarHBondContact O-CB 3.34Å; Q114-S118 PolarHBondContact O-N 3.1Å; V115-S118 PolarHBondContact O-N 3.47Å; S118-S122 VanDerWaalsContact O-CB 3.23Å; S118-S122 WeakPolarHBondContact O-CB 3.36Å; S118-S122 PolarHBondContact O-N 3.31Å; S118-S122 VanDerWaalsContact O-N 3.1Å |
| 119 | L | 49.3 | Very low | 45 | Very low | 117 Ų | 117 | 113.2 Ų | 113.2 | 61% | 0.613 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -71.7 | -39.8 | 173.7 | -101.9 | 76.5 | 0 | 0 | 0 | 111.9 | V115 R117 E121 S122 | V115-L119 HydrophobicContact CG1-CD1 4.05Å; V115-L119 WeakPolarHBondContact O-CB 3.31Å; V115-L119 WeakPolarHBondContact O-CD1 3.46Å; V115-L119 PolarHBondContact O-N 3.34Å; R117-L119 VanDerWaalsContact C-N 3.35Å; R117-L119 PolarHBondContact O-N 3.12Å; L119-E121 VanDerWaalsContact C-N 3.31Å; L119-E121 PolarHBondContact O-N 3.34Å; L119-S122 PolarHBondContact O-N 2.92Å |
| 120 | A | 47.3 | Very low | 44 | Very low | 72 Ų | 72 | 114.2 Ų | 114.2 | 60% | 0.595 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -70.3 | -26.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | Q116 R117 | Q116-A120 VanDerWaalsContact O-CB 3.29Å; Q116-A120 WeakPolarHBondContact O-CB 3.46Å; Q116-A120 PolarHBondContact O-N 3.28Å; R117-A120 PolarHBondContact O-N 3.42Å |
| 121 | E | 48.6 | Very low | 43.1 | Very low | 162 Ų | 162 | 115.6 Ų | 115.6 | 76% | 0.757 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -85.6 | -20.7 | 174.8 | -163 | 162.9 | -163.1 | 0 | 0 | 112.1 | R117 L119 D123 | R117-E121 VanDerWaalsContact O-CB 3.29Å; R117-E121 WeakPolarHBondContact O-CB 3.46Å; R117-E121 PolarHBondContact O-N 2.93Å; L119-E121 VanDerWaalsContact C-N 3.31Å; L119-E121 PolarHBondContact O-N 3.34Å; E121-D123 VanDerWaalsContact C-N 3.34Å; E121-D123 PolarHBondContact O-N 3.35Å |
| 122 | S | 45.2 | Very low | 42.3 | Very low | 76 Ų | 76 | 116.1 Ų | 116.1 | 53% | 0.531 | 65% | 0.653 | S | S | . | * | G | 310 helix | trans | -78.9 | -7.6 | 176.6 | -178.5 | 0 | 0 | 0 | 0 | 114.5 | S118 L119 H124 | S118-S122 VanDerWaalsContact O-CB 3.23Å; S118-S122 WeakPolarHBondContact O-CB 3.36Å; S118-S122 PolarHBondContact O-N 3.31Å; S118-S122 VanDerWaalsContact O-N 3.1Å; L119-S122 PolarHBondContact O-N 2.92Å; S122-H124 PolarHBondContact O-N 3.36Å |
| 123 | D | 40.8 | Very low | 41 | Very low | 136 Ų | 136 | 116.8 Ų | 116.8 | 73% | 0.727 | 66% | 0.664 | S | S | * | * | G | 310 helix | trans | -71.4 | 3 | 178.7 | -88.7 | -22 | 0 | 0 | 0 | 113.7 | E121 | E121-D123 VanDerWaalsContact C-N 3.34Å; E121-D123 PolarHBondContact O-N 3.35Å |
| 124 | H | 36.6 | Very low | 39.9 | Very low | 175 Ų | 175 | 120.2 Ų | 120.2 | 81% | 0.81 | 68% | 0.68 | S | S | * | * | G | 310 helix | trans | -129.1 | 44.3 | 176.2 | -68.8 | -25.8 | 0 | 0 | 0 | 113.7 | S122 | S122-H124 PolarHBondContact O-N 3.36Š|
| 125 | V | 33.4 | Very low | 38.8 | Very low | 107 Ų | 107 | 121.5 Ų | 121.5 | 65% | 0.648 | 69% | 0.694 | S | S | * | * | trans | -135.3 | 87.2 | 159.7 | -171.2 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 126 | T | 28.5 | Very low | 37.7 | Very low | 132 Ų | 132 | 125.7 Ų | 125.7 | 81% | 0.81 | 71% | 0.706 | S | S | * | * | trans | -46.8 | 132.3 | 149.4 | 41.4 | 0 | 0 | 0 | 0 | 111.4 | ||||
| 127 | A | 28.8 | Very low | 36.6 | Very low | 82 Ų | 82 | 123 Ų | 123 | 68% | 0.678 | 70% | 0.696 | S | S | * | * | S | Bend | trans | 68.1 | 132.9 | 160.8 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||
| 128 | E | 25.9 | Very low | 35.6 | Very low | 190 Ų | 190 | 119.6 Ų | 119.6 | 89% | 0.888 | 69% | 0.693 | S | S | * | * | trans | 67.5 | 75.8 | 165.5 | -60.7 | -175.9 | 150.2 | 0 | 0 | 117.8 | ||||
| 129 | C | 28.4 | Very low | 34.9 | Very low | 106 Ų | 106 | 120.6 Ų | 120.6 | 72% | 0.716 | 70% | 0.698 | S | S | * | * | trans | -142.8 | 72.4 | 153.6 | -93.5 | 0 | 0 | 0 | 0 | 110.6 | N131 | C129-N131 PolarHBondContact O-N 3.15Å; C129-N131 VanDerWaalsContact O-N 3.12Å | ||
| 130 | A | 28 | Very low | 34.4 | Very low | 105 Ų | 105 | 124.8 Ų | 124.8 | 87% | 0.868 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.3 | 23.6 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||
| 131 | N | 29.3 | Very low | 34.2 | Very low | 157 Ų | 157 | 125.9 Ų | 125.9 | 84% | 0.84 | 70% | 0.701 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -139.7 | 17.4 | -169.5 | -92.7 | -12.7 | 0 | 0 | 0 | 115 | C129 S133 | C129-N131 PolarHBondContact O-N 3.15Å; C129-N131 VanDerWaalsContact O-N 3.12Å; N131-S133 PolarHBondContact O-N 3Å; N131-S133 VanDerWaalsContact O-N 3.13Å |
| 132 | V | 30.7 | Very low | 34.1 | Very low | 124 Ų | 124 | 123.9 Ų | 123.9 | 75% | 0.752 | 69% | 0.692 | S | S | * | * | trans | -81.1 | 99.8 | 168.9 | -170.9 | 0 | 0 | 0 | 0 | 107.5 | E134 | V132-E134 PolarHBondContact O-N 2.98Š| ||
| 133 | S | 28.3 | Very low | 34 | Very low | 99 Ų | 99 | 124.4 Ų | 124.4 | 69% | 0.692 | 69% | 0.694 | S | S | * | * | trans | -43.3 | 131.4 | 175.5 | -61.6 | 0 | 0 | 0 | 0 | 111 | N131 V135 | N131-S133 PolarHBondContact O-N 3Å; N131-S133 VanDerWaalsContact O-N 3.13Å; S133-V135 VanDerWaalsContact C-N 3.29Å; S133-V135 PolarHBondContact O-N 3.45Å | ||
| 134 | E | 31.7 | Very low | 34.2 | Very low | 156 Ų | 156 | 122.7 Ų | 122.7 | 73% | 0.729 | 69% | 0.685 | S | S | * | * | trans | -50.3 | 94.8 | 165.8 | -73.5 | 175.5 | 143.4 | 0 | 0 | 108.8 | V132 F136 | V132-E134 PolarHBondContact O-N 2.98Å; E134-F136 HydrophobicContact CB-CD2 3.89Å; E134-F136 HydrophobicContact CB-CE2 3.64Å; E134-F136 HydrophobicContact CB-CZ 4.3Å; E134-F136 HydrophobicContact CG-CE2 4.43Å; E134-F136 WeakPolarHBondContact O-CD2 3.48Å; E134-F136 PolarHBondContact O-N 3.07Å; E134-F136 VanDerWaalsContact OE2-CE2 3.3Å; E134-F136 WeakPolarHBondContact OE2-CE2 3.34Å; E134-F136 WeakPolarHBondContact OE2-CZ 3.32Å | ||
| 135 | V | 35.2 | Very low | 34.9 | Very low | 119 Ų | 119 | 118.3 Ų | 118.3 | 72% | 0.721 | 67% | 0.667 | S | S | * | * | trans | -70.2 | 92.6 | 160.2 | 179.1 | 0 | 0 | 0 | 0 | 103.9 | S133 L137 | S133-V135 VanDerWaalsContact C-N 3.29Å; S133-V135 PolarHBondContact O-N 3.45Å; V135-L137 PolarHBondContact O-N 2.96Å | ||
| 136 | F | 31.8 | Very low | 35.8 | Very low | 167 Ų | 167 | 116 Ų | 116 | 73% | 0.732 | 66% | 0.659 | S | S | * | * | trans | -58.7 | 87.5 | 170.7 | -80.4 | -89.4 | 0 | 0 | 0 | 108.1 | E134 S138 | E134-F136 HydrophobicContact CB-CD2 3.89Å; E134-F136 HydrophobicContact CB-CE2 3.64Å; E134-F136 HydrophobicContact CB-CZ 4.3Å; E134-F136 HydrophobicContact CG-CE2 4.43Å; E134-F136 WeakPolarHBondContact O-CD2 3.48Å; E134-F136 PolarHBondContact O-N 3.07Å; E134-F136 VanDerWaalsContact OE2-CE2 3.3Å; E134-F136 WeakPolarHBondContact OE2-CE2 3.34Å; E134-F136 WeakPolarHBondContact OE2-CZ 3.32Å; F136-S138 PolarHBondContact O-N 3.25Å | ||
| 137 | L | 35 | Very low | 37 | Very low | 86 Ų | 86 | 115.4 Ų | 115.4 | 45% | 0.45 | 65% | 0.65 | S | S | . | * | trans | -62.6 | 105.1 | 163.5 | -74.3 | 164.3 | 0 | 0 | 0 | 105.6 | V135 L141 E142 | V135-L137 PolarHBondContact O-N 2.96Å; L137-L141 HydrophobicContact CD2-CB 4.23Å; L137-L141 HydrophobicContact CD2-CD2 3.22Å; L137-L141 HydrophobicContact CD2-CG 4.31Å; L137-E142 HydrophobicContact CB-CG 4.4Å | ||
| 138 | S | 30.6 | Very low | 38.1 | Very low | 66 Ų | 66 | 114.1 Ų | 114.1 | 46% | 0.462 | 64% | 0.64 | S | S | . | * | trans | -48.3 | 139.3 | 175.4 | 56.5 | 0 | 0 | 0 | 0 | 109.2 | F136 R140 L141 | F136-S138 PolarHBondContact O-N 3.25Å; S138-R140 CarbonylContact O-C 3.56Å; S138-R140 PolarHBondContact O-N 3.31Å; S138-L141 WeakPolarHBondContact O-CA 3.42Å; S138-L141 WeakPolarHBondContact O-CB 3.4Å; S138-L141 PolarHBondContact O-N 3.25Å | ||
| 139 | P | 40.2 | Very low | 39.4 | Very low | 99 Ų | 99 | 108.1 Ų | 108.1 | 64% | 0.643 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -58.4 | -13 | -173.9 | 16.5 | -29.3 | 0 | 0 | 0 | 114.2 | C143 | P139-C143 PolarHBondContact O-N 3.28Å |
| 140 | R | 37.6 | Very low | 40.5 | Very low | 205 Ų | 205 | 106.6 Ų | 106.6 | 77% | 0.774 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -69.8 | -41.8 | 167.3 | -79.7 | -173.4 | 167.8 | 173 | -2.7 | 113 | S138 E142 C143 D144 | S138-R140 CarbonylContact O-C 3.56Å; S138-R140 PolarHBondContact O-N 3.31Å; R140-E142 VanDerWaalsContact C-N 3.35Å; R140-C143 PolarHBondContact O-N 3.48Å; R140-D144 PolarHBondContact O-N 3.19Å |
| 141 | L | 44.3 | Very low | 41.6 | Very low | 94 Ų | 94 | 107.6 Ų | 107.6 | 49% | 0.492 | 60% | 0.599 | S | S | . | * | H | α-helix | trans | -66.5 | -37.3 | 178.5 | -133 | 89.3 | 0 | 0 | 0 | 111.6 | L137 S138 C143 D144 L145 | L137-L141 HydrophobicContact CD2-CB 4.23Å; L137-L141 HydrophobicContact CD2-CD2 3.22Å; L137-L141 HydrophobicContact CD2-CG 4.31Å; S138-L141 WeakPolarHBondContact O-CA 3.42Å; S138-L141 WeakPolarHBondContact O-CB 3.4Å; S138-L141 PolarHBondContact O-N 3.25Å; L141-C143 VanDerWaalsContact C-N 3.33Å; L141-C143 PolarHBondContact O-N 3.03Å; L141-D144 PolarHBondContact O-N 3.47Å; L141-L145 WeakPolarHBondContact O-CB 2.96Å; L141-L145 PolarHBondContact O-N 3.41Å |
| 142 | E | 46.8 | Very low | 42.4 | Very low | 121 Ų | 121 | 103.6 Ų | 103.6 | 57% | 0.565 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -62.8 | -40.4 | 174.2 | -69.2 | -175.5 | 157.4 | 0 | 0 | 111.9 | L137 R140 A146 | L137-E142 HydrophobicContact CB-CG 4.4Å; R140-E142 VanDerWaalsContact C-N 3.35Å; E142-A146 WeakPolarHBondContact O-CB 3.17Å; E142-A146 PolarHBondContact O-N 2.75Å |
| 143 | C | 42.9 | Very low | 43.1 | Very low | 86 Ų | 86 | 105.9 Ų | 105.9 | 58% | 0.581 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -69.4 | -42.8 | 175.9 | -79.4 | 0 | 0 | 0 | 0 | 112.7 | P139 R140 L141 L145 A146 L147 | P139-C143 PolarHBondContact O-N 3.28Å; R140-C143 PolarHBondContact O-N 3.48Å; L141-C143 VanDerWaalsContact C-N 3.33Å; L141-C143 PolarHBondContact O-N 3.03Å; C143-L145 VanDerWaalsContact C-N 3.34Å; C143-A146 PolarHBondContact O-N 2.93Å; C143-L147 VanDerWaalsContact O-CB 3.26Å; C143-L147 WeakPolarHBondContact O-CB 3.35Å; C143-L147 PolarHBondContact O-N 3.34Å |
| 144 | D | 44.9 | Very low | 43.7 | Very low | 101 Ų | 101 | 105 Ų | 105 | 54% | 0.54 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -68.8 | -35.5 | 179.1 | -70.4 | -21.7 | 0 | 0 | 0 | 111.1 | R140 L141 L147 A148 | R140-D144 PolarHBondContact O-N 3.19Å; L141-D144 PolarHBondContact O-N 3.47Å; D144-L147 PolarHBondContact O-N 2.93Å; D144-A148 VanDerWaalsContact O-CB 3.3Å; D144-A148 WeakPolarHBondContact O-CB 3.48Å; D144-A148 PolarHBondContact O-N 3.36Å |
| 145 | L | 50.3 | Low | 44 | Very low | 82 Ų | 82 | 103.8 Ų | 103.8 | 43% | 0.429 | 58% | 0.578 | S | S | . | * | H | α-helix | trans | -69.3 | -44.3 | 173.7 | -171 | 71.1 | 0 | 0 | 0 | 111.6 | L112 L141 C143 L147 A148 I149 | L112-L145 HydrophobicContact CD2-CD1 4.31Å; L141-L145 WeakPolarHBondContact O-CB 2.96Å; L141-L145 PolarHBondContact O-N 3.41Å; C143-L145 VanDerWaalsContact C-N 3.34Å; L145-L147 VanDerWaalsContact C-N 3.28Å; L145-L147 PolarHBondContact O-N 2.94Å; L145-A148 PolarHBondContact O-N 3.29Å; L145-I149 HydrophobicContact CG-CD1 3.96Å; L145-I149 WeakPolarHBondContact O-CB 3.39Å; L145-I149 VanDerWaalsContact O-CG1 3.22Å; L145-I149 WeakPolarHBondContact O-CG1 3.17Å; L145-I149 PolarHBondContact O-N 3.43Å |
| 146 | A | 53.1 | Low | 44.2 | Very low | 58 Ų | 58 | 108.4 Ų | 108.4 | 48% | 0.479 | 58% | 0.583 | S | S | . | * | H | α-helix | trans | -62.7 | -36.8 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | E142 C143 A150 | E142-A146 WeakPolarHBondContact O-CB 3.17Å; E142-A146 PolarHBondContact O-N 2.75Å; C143-A146 PolarHBondContact O-N 2.93Å; A146-A150 WeakPolarHBondContact O-CB 3.15Å; A146-A150 PolarHBondContact O-N 3.05Å |
| 147 | L | 53.2 | Low | 44.6 | Very low | 120 Ų | 120 | 102.7 Ų | 102.7 | 63% | 0.628 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -69.4 | -39.7 | 174.6 | -161.5 | 78.5 | 0 | 0 | 0 | 111.4 | C143 D144 L145 A150 N151 | C143-L147 VanDerWaalsContact O-CB 3.26Å; C143-L147 WeakPolarHBondContact O-CB 3.35Å; C143-L147 PolarHBondContact O-N 3.34Å; D144-L147 PolarHBondContact O-N 2.93Å; L145-L147 VanDerWaalsContact C-N 3.28Å; L145-L147 PolarHBondContact O-N 2.94Å; L147-A150 PolarHBondContact O-N 3.07Å; L147-N151 WeakPolarHBondContact O-CB 3.37Å; L147-N151 PolarHBondContact O-N 3.3Å |
| 148 | A | 51.5 | Low | 44.7 | Very low | 56 Ų | 56 | 103 Ų | 103 | 46% | 0.463 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -64.3 | -43.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | D144 L145 N151 D152 | D144-A148 VanDerWaalsContact O-CB 3.3Å; D144-A148 WeakPolarHBondContact O-CB 3.48Å; D144-A148 PolarHBondContact O-N 3.36Å; L145-A148 PolarHBondContact O-N 3.29Å; A148-N151 PolarHBondContact O-N 3.01Å; A148-D152 PolarHBondContact O-N 3.45Å |
| 149 | I | 53.8 | Low | 45.1 | Very low | 63 Ų | 63 | 103.6 Ų | 103.6 | 32% | 0.323 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -65.8 | -38.6 | 175.9 | -66 | 165.2 | 0 | 0 | 0 | 111 | L145 N151 | L145-I149 HydrophobicContact CG-CD1 3.96Å; L145-I149 WeakPolarHBondContact O-CB 3.39Å; L145-I149 VanDerWaalsContact O-CG1 3.22Å; L145-I149 WeakPolarHBondContact O-CG1 3.17Å; L145-I149 PolarHBondContact O-N 3.43Å; I149-N151 VanDerWaalsContact C-N 3.35Å |
| 150 | A | 51.6 | Low | 45.1 | Very low | 74 Ų | 74 | 104.8 Ų | 104.8 | 61% | 0.612 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -72.3 | -27.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | A146 L147 | A146-A150 WeakPolarHBondContact O-CB 3.15Å; A146-A150 PolarHBondContact O-N 3.05Å; L147-A150 PolarHBondContact O-N 3.07Å |
| 151 | N | 50.1 | Low | 45.3 | Very low | 127 Ų | 127 | 100 Ų | 100 | 68% | 0.679 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -90.7 | -14.5 | 179.9 | -157.8 | 31.4 | 0 | 0 | 0 | 112.9 | L147 A148 I149 Q153 | L147-N151 WeakPolarHBondContact O-CB 3.37Å; L147-N151 PolarHBondContact O-N 3.3Å; A148-N151 PolarHBondContact O-N 3.01Å; I149-N151 VanDerWaalsContact C-N 3.35Å; N151-Q153 PolarHBondContact O-N 2.94Å |
| 152 | D | 47 | Very low | 45 | Very low | 73 Ų | 73 | 98.1 Ų | 98.1 | 39% | 0.39 | 55% | 0.549 | S | S | . | . | trans | -71.1 | 84.1 | 167.8 | -170.6 | 12.2 | 0 | 0 | 0 | 109.6 | A148 T154 N157 | A148-D152 PolarHBondContact O-N 3.45Å; D152-T154 VanDerWaalsContact CG-OG1 3.26Å; D152-T154 PolarHBondContact O-N 3.49Å; D152-T154 WeakPolarHBondContact OD1-CB 3.32Å; D152-T154 WeakPolarHBondContact OD1-CG2 3.21Å; D152-T154 PolarHBondContact OD1-N 3.26Å; D152-T154 PolarHBondContact OD1-OG1 3.46Å; D152-T154 PolarHBondContact OD2-OG1 3.3Å; D152-N157 PolarHBondContact OD2-ND2 3Å | ||
| 153 | Q | 46.3 | Very low | 44.6 | Very low | 172 Ų | 172 | 98.4 Ų | 98.4 | 80% | 0.804 | 55% | 0.55 | S | S | * | * | trans | -68.9 | 10.8 | 176.8 | -75.3 | -164.6 | -14 | 0 | 0 | 113.7 | N151 C155 | N151-Q153 PolarHBondContact O-N 2.94Å; Q153-C155 PolarHBondContact O-N 2.87Å | ||
| 154 | T | 40.8 | Very low | 44.6 | Very low | 79 Ų | 79 | 100.4 Ų | 100.4 | 49% | 0.485 | 56% | 0.555 | S | S | . | * | trans | -69.7 | 121.4 | 170.7 | 60.9 | 0 | 0 | 0 | 0 | 108.5 | D152 R156 | D152-T154 VanDerWaalsContact CG-OG1 3.26Å; D152-T154 PolarHBondContact O-N 3.49Å; D152-T154 WeakPolarHBondContact OD1-CB 3.32Å; D152-T154 WeakPolarHBondContact OD1-CG2 3.21Å; D152-T154 PolarHBondContact OD1-N 3.26Å; D152-T154 PolarHBondContact OD1-OG1 3.46Å; D152-T154 PolarHBondContact OD2-OG1 3.3Å; T154-R156 PolarHBondContact O-N 2.95Å | ||
| 155 | C | 37.9 | Very low | 44.5 | Very low | 132 Ų | 132 | 100 Ų | 100 | 89% | 0.892 | 57% | 0.565 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -61.5 | 23.3 | -174.1 | -61.2 | 0 | 0 | 0 | 0 | 115.6 | Q153 | Q153-C155 PolarHBondContact O-N 2.87Š|
| 156 | R | 39.4 | Very low | 44 | Very low | 216 Ų | 216 | 106 Ų | 106 | 82% | 0.815 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.2 | -11.4 | -176.5 | -72.4 | -173.7 | 172.5 | -175.4 | -2.2 | 114.3 | T154 | T154-R156 PolarHBondContact O-N 2.95Š|
| 157 | N | 39.1 | Very low | 43.1 | Very low | 47 Ų | 47 | 107.6 Ų | 107.6 | 25% | 0.251 | 59% | 0.589 | S | S | . | * | trans | -104.1 | 15.9 | -171.1 | -68.8 | -21 | 0 | 0 | 0 | 116.2 | D152 V159 F160 | D152-N157 PolarHBondContact OD2-ND2 3Å; N157-V159 PolarHBondContact O-N 3.31Å; N157-F160 PolarHBondContact O-N 3.35Å | ||
| 158 | S | 37.5 | Very low | 42.5 | Very low | 92 Ų | 92 | 106.9 Ų | 106.9 | 64% | 0.643 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -67.4 | -20.8 | 173.9 | 61.1 | 0 | 0 | 0 | 0 | 113.7 | S162 | S158-S162 PolarHBondContact O-OG 3.29Å |
| 159 | V | 39.7 | Very low | 41.8 | Very low | 79 Ų | 79 | 111 Ų | 111 | 48% | 0.479 | 61% | 0.612 | S | S | . | * | H | α-helix | trans | -80.4 | -28 | 176.9 | -176.5 | 0 | 0 | 0 | 0 | 111.6 | N157 S162 Q163 | N157-V159 PolarHBondContact O-N 3.31Å; V159-S162 WeakPolarHBondContact CA-OG 3.44Å; V159-S162 PolarHBondContact O-OG 3.36Å; V159-Q163 WeakPolarHBondContact O-CG 3.37Å; V159-Q163 PolarHBondContact O-N 3.04Å |
| 160 | F | 40.5 | Very low | 41 | Very low | 123 Ų | 123 | 113.2 Ų | 113.2 | 54% | 0.539 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -74.2 | -41.7 | -178.5 | -94.7 | -86.2 | 0 | 0 | 0 | 113 | N157 S162 Q163 L164 | N157-F160 PolarHBondContact O-N 3.35Å; F160-S162 VanDerWaalsContact C-N 3.29Å; F160-S162 PolarHBondContact O-N 3.4Å; F160-Q163 PolarHBondContact O-N 2.84Å; F160-L164 PolarHBondContact O-N 3.34Å; F160-L164 VanDerWaalsContact O-N 3.1Å |
| 161 | L | 40.2 | Very low | 40 | Very low | 106 Ų | 106 | 119.3 Ų | 119.3 | 56% | 0.555 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -69.5 | -28.3 | 176.6 | -71.6 | 173.8 | 0 | 0 | 0 | 112.8 | A165 | L161-A165 WeakPolarHBondContact O-CB 3.14Å; L161-A165 PolarHBondContact O-N 3.32Å |
| 162 | S | 39.4 | Very low | 39.2 | Very low | 53 Ų | 53 | 124.8 Ų | 124.8 | 37% | 0.371 | 65% | 0.652 | S | S | . | * | H | α-helix | trans | -80.2 | -16.8 | 176.4 | 50.7 | 0 | 0 | 0 | 0 | 113.5 | S158 V159 F160 R166 | S158-S162 PolarHBondContact O-OG 3.29Å; V159-S162 WeakPolarHBondContact CA-OG 3.44Å; V159-S162 PolarHBondContact O-OG 3.36Å; F160-S162 VanDerWaalsContact C-N 3.29Å; F160-S162 PolarHBondContact O-N 3.4Å; S162-R166 WeakPolarHBondContact O-CB 3.33Å |
| 163 | Q | 38.2 | Very low | 38.4 | Very low | 128 Ų | 128 | 130.5 Ų | 130.5 | 60% | 0.598 | 68% | 0.676 | S | S | * | * | H | α-helix | trans | -88.5 | -35.3 | 171.3 | -71.7 | -177.9 | 12.3 | 0 | 0 | 112.3 | V159 F160 A165 R166 | V159-Q163 WeakPolarHBondContact O-CG 3.37Å; V159-Q163 PolarHBondContact O-N 3.04Å; F160-Q163 PolarHBondContact O-N 2.84Å; Q163-A165 VanDerWaalsContact C-N 3.31Å; Q163-A165 PolarHBondContact O-N 3.14Å; Q163-R166 PolarHBondContact O-N 3.06Å |
| 164 | L | 42.5 | Very low | 37.7 | Very low | 128 Ų | 128 | 126.7 Ų | 126.7 | 67% | 0.67 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -64.8 | -32.9 | 171.4 | -88.6 | 152.4 | 0 | 0 | 0 | 112.9 | F160 | F160-L164 PolarHBondContact O-N 3.34Å; F160-L164 VanDerWaalsContact O-N 3.1Å |
| 165 | A | 42.3 | Very low | 37.6 | Very low | 91 Ų | 91 | 130.8 Ų | 130.8 | 75% | 0.752 | 69% | 0.686 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84 | -4.8 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | L161 Q163 | L161-A165 WeakPolarHBondContact O-CB 3.14Å; L161-A165 PolarHBondContact O-N 3.32Å; Q163-A165 VanDerWaalsContact C-N 3.31Å; Q163-A165 PolarHBondContact O-N 3.14Å |
| 166 | R | 41 | Very low | 37.5 | Very low | 210 Ų | 210 | 132.2 Ų | 132.2 | 79% | 0.792 | 68% | 0.684 | S | S | * | * | trans | -127.1 | 16.4 | -166 | -149.5 | 174.7 | -159.6 | 173.9 | 4 | 113.7 | S162 Q163 | S162-R166 WeakPolarHBondContact O-CB 3.33Å; Q163-R166 PolarHBondContact O-N 3.06Å | ||
| 167 | S | 34.2 | Very low | 37.2 | Very low | 91 Ų | 91 | 126.7 Ų | 126.7 | 64% | 0.636 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -70.4 | 147 | 172.6 | 83.6 | 0 | 0 | 0 | 0 | 111.3 | T169 | S167-T169 PolarHBondContact O-N 3.33Š|
| 168 | P | 39.9 | Very low | 37 | Very low | 104 Ų | 104 | 130.4 Ų | 130.4 | 68% | 0.675 | 70% | 0.704 | S | S | * | * | trans | -81.9 | 115.8 | -137.2 | 28.7 | -33.7 | 0 | 0 | 0 | 113.9 | T170 | P168-T170 PolarHBondContact O-N 3.07Š| ||
| 169 | T | 36.3 | Very low | 36.6 | Very low | 144 Ų | 144 | 131 Ų | 131 | 88% | 0.883 | 71% | 0.708 | S | S | * | * | trans | -68.2 | 76.5 | 157 | 53.4 | 0 | 0 | 0 | 0 | 109.7 | S167 | S167-T169 PolarHBondContact O-N 3.33Š| ||
| 170 | T | 37 | Very low | 36.3 | Very low | 108 Ų | 108 | 134 Ų | 134 | 66% | 0.663 | 73% | 0.726 | S | S | * | * | trans | -139.7 | 109.4 | 174.2 | 54.4 | 0 | 0 | 0 | 0 | 112.4 | P168 | P168-T170 PolarHBondContact O-N 3.07Š| ||
| 171 | K | 30.5 | Very low | 35.9 | Very low | 203 Ų | 203 | 133.6 Ų | 133.6 | 88% | 0.883 | 74% | 0.735 | S | S | * | * | trans | 45.7 | 97.9 | 145.7 | -64.1 | -175.4 | 176.8 | -177.3 | 0 | 117.4 | ||||
| 172 | R | 34 | Very low | 35.6 | Very low | 242 Ų | 242 | 136.3 Ų | 136.3 | 91% | 0.913 | 75% | 0.749 | S | S | * | * | trans | -133.7 | 67.2 | 152.6 | -134.7 | 175.2 | -172.7 | 145 | 0.3 | 110 | S174 | R172-S174 PolarHBondContact O-N 3.47Š| ||
| 173 | E | 30.3 | Very low | 35.3 | Very low | 193 Ų | 193 | 141.9 Ų | 141.9 | 90% | 0.902 | 77% | 0.774 | S | S | * | * | trans | -71 | 102.2 | 151.5 | -73.6 | 178.1 | 163.9 | 0 | 0 | 106.9 | ||||
| 174 | S | 32.2 | Very low | 34.9 | Very low | 91 Ų | 91 | 140.9 Ų | 140.9 | 64% | 0.636 | 78% | 0.781 | S | S | * | * | trans | 165.7 | 141.6 | 149.6 | 46.8 | 0 | 0 | 0 | 0 | 109.2 | R172 | R172-S174 PolarHBondContact O-N 3.47Š| ||
| 175 | L | 37.1 | Very low | 34.6 | Very low | 165 Ų | 165 | 140.8 Ų | 140.8 | 86% | 0.864 | 79% | 0.788 | S | S | * | * | trans | 93.7 | 76.6 | 173.5 | -46.8 | -177.3 | 0 | 0 | 0 | 114.7 | ||||
| 176 | L | 36.2 | Very low | 34.2 | Very low | 162 Ų | 162 | 144.4 Ų | 144.4 | 85% | 0.848 | 79% | 0.793 | S | S | * | * | trans | -40.2 | 139.7 | 157.3 | -84.5 | 109.4 | 0 | 0 | 0 | 114.6 | ||||
| 177 | S | 33.8 | Very low | 33.9 | Very low | 100 Ų | 100 | 138.8 Ų | 138.8 | 70% | 0.699 | 79% | 0.792 | S | S | * | * | trans | 70.3 | 113.3 | 143.4 | -47.5 | 0 | 0 | 0 | 0 | 116.4 | ||||
| 178 | T | 34.8 | Very low | 34 | Very low | 126 Ų | 126 | 140.1 Ų | 140.1 | 77% | 0.773 | 80% | 0.796 | S | S | * | * | -173.2 | 113.2 | 50.8 | -48.4 | 0 | 0 | 0 | 0 | 110 | |||||
| 179 | S | 29.2 | Very low | 33.7 | Very low | 104 Ų | 104 | 139.4 Ų | 139.4 | 73% | 0.727 | 79% | 0.791 | S | S | * | * | trans | 49.5 | 88.6 | 145.2 | 69.5 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 180 | V | 32.9 | Very low | 34 | Very low | 141 Ų | 141 | 137.5 Ų | 137.5 | 86% | 0.855 | 79% | 0.79 | S | S | * | * | trans | -159.1 | 163.7 | 136 | -133.1 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 181 | P | 33 | Very low | 34 | Very low | 115 Ų | 115 | 139.5 Ų | 139.5 | 75% | 0.747 | 80% | 0.797 | S | S | * | * | -111.1 | 138.3 | -116.6 | 35.3 | -16 | 0 | 0 | 0 | 113.6 | |||||
| 182 | I | 33.7 | Very low | 34.3 | Very low | 164 Ų | 164 | 135.5 Ų | 135.5 | 84% | 0.841 | 78% | 0.784 | S | S | * | * | trans | -134.1 | 118 | 172.9 | -56.1 | 179.7 | 0 | 0 | 0 | 110.1 | S184 | I182-S184 PolarHBondContact O-N 3.47Š| ||
| 183 | L | 31.6 | Very low | 34.2 | Very low | 170 Ų | 170 | 133.4 Ų | 133.4 | 89% | 0.89 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -48.2 | 123 | 174.2 | -76.9 | 127.1 | 0 | 0 | 0 | 110.7 | ||
| 184 | S | 30 | Very low | 34.7 | Very low | 107 Ų | 107 | 131 Ų | 131 | 75% | 0.748 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -51.8 | 136.5 | 174.9 | -49.2 | 0 | 0 | 0 | 0 | 111.4 | I182 L186 | I182-S184 PolarHBondContact O-N 3.47Å; S184-L186 PolarHBondContact O-N 2.93Å; S184-L186 VanDerWaalsContact O-N 3.15Å |
| 185 | P | 37.4 | Very low | 34.8 | Very low | 125 Ų | 125 | 132.7 Ų | 132.7 | 81% | 0.812 | 78% | 0.78 | S | S | * | * | P | Polyproline II helix | trans | -63.5 | 121.5 | 171.9 | 26.7 | -30.1 | 0 | 0 | 0 | 107.9 | A187 | P185-A187 PolarHBondContact O-N 3.38Š|
| 186 | L | 33.3 | Very low | 35.1 | Very low | 167 Ų | 167 | 129.1 Ų | 129.1 | 87% | 0.874 | 77% | 0.774 | S | S | * | * | trans | -54.3 | 114.3 | 177.7 | -162.5 | 71.8 | 0 | 0 | 0 | 108.3 | S184 V188 | S184-L186 PolarHBondContact O-N 2.93Å; S184-L186 VanDerWaalsContact O-N 3.15Å; L186-V188 PolarHBondContact O-N 3.3Å | ||
| 187 | A | 34.2 | Very low | 35.2 | Very low | 93 Ų | 93 | 130 Ų | 130 | 77% | 0.769 | 77% | 0.771 | S | S | * | * | trans | -52.6 | 109 | 177.6 | 0 | 0 | 0 | 0 | 0 | 109.9 | P185 | P185-A187 PolarHBondContact O-N 3.38Š| ||
| 188 | V | 36.5 | Very low | 35.5 | Very low | 118 Ų | 118 | 133.9 Ų | 133.9 | 72% | 0.715 | 78% | 0.778 | S | S | * | * | trans | -64.3 | 127.1 | 166.4 | 178.6 | 0 | 0 | 0 | 0 | 106.7 | L186 A190 | L186-V188 PolarHBondContact O-N 3.3Å; V188-A190 PolarHBondContact O-N 2.92Å | ||
| 189 | P | 34.7 | Very low | 35.9 | Very low | 89 Ų | 89 | 138.6 Ų | 138.6 | 58% | 0.578 | 78% | 0.781 | S | S | * | * | trans | -56 | 130 | 179 | -21.5 | 31.1 | 0 | 0 | 0 | 110.3 | D191 | P189-D191 PolarHBondContact O-N 3.33Š| ||
| 190 | A | 41.7 | Very low | 36.3 | Very low | 104 Ų | 104 | 140.1 Ų | 140.1 | 86% | 0.86 | 79% | 0.787 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.2 | 8.3 | -176.8 | 0 | 0 | 0 | 0 | 0 | 115 | V188 | V188-A190 PolarHBondContact O-N 2.92Š|
| 191 | D | 36.8 | Very low | 36.5 | Very low | 151 Ų | 151 | 141.4 Ų | 141.4 | 81% | 0.807 | 79% | 0.788 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -108.7 | 6.5 | -170 | -71.8 | -30.8 | 0 | 0 | 0 | 114.9 | P189 K193 | P189-D191 PolarHBondContact O-N 3.33Å; D191-K193 PolarHBondContact O-N 3.5Å |
| 192 | I | 36.2 | Very low | 36.8 | Very low | 119 Ų | 119 | 147.7 Ų | 147.7 | 61% | 0.61 | 81% | 0.814 | S | S | * | * | trans | -91.2 | 87.5 | 174.8 | -49 | 178.6 | 0 | 0 | 0 | 109.4 | I194 | I192-I194 VanDerWaalsContact C-N 3.34Å; I192-I194 HydrophobicContact CG2-CG1 3.85Å; I192-I194 PolarHBondContact O-N 2.81Å | ||
| 193 | K | 33.6 | Very low | 37 | Very low | 197 Ų | 197 | 146.9 Ų | 146.9 | 86% | 0.857 | 81% | 0.812 | S | S | * | * | trans | -66.4 | 92.6 | 162.1 | -86 | -177.3 | 176.6 | 176.9 | 0 | 108.9 | D191 V195 | D191-K193 PolarHBondContact O-N 3.5Å; K193-V195 PolarHBondContact O-N 3Å | ||
| 194 | I | 40.5 | Very low | 37.3 | Very low | 143 Ų | 143 | 145.6 Ų | 145.6 | 73% | 0.733 | 81% | 0.808 | S | S | * | * | trans | -72.8 | 98.1 | 164.9 | -56.2 | 178.3 | 0 | 0 | 0 | 106.9 | I192 A196 | I192-I194 VanDerWaalsContact C-N 3.34Å; I192-I194 HydrophobicContact CG2-CG1 3.85Å; I192-I194 PolarHBondContact O-N 2.81Å; I194-A196 VanDerWaalsContact C-N 3.27Å; I194-A196 PolarHBondContact O-N 2.96Å | ||
| 195 | V | 34.6 | Very low | 37.7 | Very low | 127 Ų | 127 | 147.8 Ų | 147.8 | 77% | 0.77 | 81% | 0.812 | S | S | * | * | trans | -73.5 | 87.2 | 168.3 | -178.5 | 0 | 0 | 0 | 0 | 107.2 | K193 K197 | K193-V195 PolarHBondContact O-N 3Å; V195-K197 PolarHBondContact O-N 2.93Å | ||
| 196 | A | 41.6 | Very low | 37.7 | Very low | 89 Ų | 89 | 149.1 Ų | 149.1 | 74% | 0.736 | 81% | 0.812 | S | S | * | * | trans | -69.2 | 100.2 | 166 | 0 | 0 | 0 | 0 | 0 | 107.6 | I194 E198 | I194-A196 VanDerWaalsContact C-N 3.27Å; I194-A196 PolarHBondContact O-N 2.96Å; A196-E198 PolarHBondContact O-N 3.27Å; A196-E198 VanDerWaalsContact O-N 3.1Å | ||
| 197 | K | 38.9 | Very low | 38 | Very low | 181 Ų | 181 | 148 Ų | 148 | 79% | 0.787 | 81% | 0.808 | S | S | * | * | trans | -69.8 | 101.2 | 172.6 | -175.3 | 171.9 | -177.8 | 172.7 | 0 | 108.2 | V195 R199 | V195-K197 PolarHBondContact O-N 2.93Å; K197-R199 PolarHBondContact O-N 3.22Å; K197-R199 VanDerWaalsContact O-N 3.16Å | ||
| 198 | E | 41.1 | Very low | 38.2 | Very low | 181 Ų | 181 | 151.7 Ų | 151.7 | 85% | 0.846 | 81% | 0.81 | S | S | * | * | trans | -56.9 | 114.7 | 165.9 | -123.2 | 175.9 | 174.9 | 0 | 0 | 108.2 | A196 | A196-E198 PolarHBondContact O-N 3.27Å; A196-E198 VanDerWaalsContact O-N 3.1Å | ||
| 199 | R | 42.2 | Very low | 38.3 | Very low | 225 Ų | 225 | 154.1 Ų | 154.1 | 85% | 0.849 | 82% | 0.817 | S | S | * | * | trans | -87.5 | 101.4 | 161.9 | -81.9 | -172.8 | 176.1 | 170.5 | -0.5 | 106.5 | K197 L201 | K197-R199 PolarHBondContact O-N 3.22Å; K197-R199 VanDerWaalsContact O-N 3.16Å; R199-L201 PolarHBondContact O-N 3.07Å | ||
| 200 | T | 37.6 | Very low | 38.6 | Very low | 136 Ų | 136 | 159.1 Ų | 159.1 | 83% | 0.834 | 84% | 0.835 | S | S | * | * | trans | -55.2 | 122.1 | 163.3 | -7.6 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 201 | L | 38.2 | Very low | 38.4 | Very low | 168 Ų | 168 | 163.7 Ų | 163.7 | 88% | 0.88 | 83% | 0.833 | S | S | * | * | trans | -86.2 | 102.3 | 168.9 | -77.5 | 164.1 | 0 | 0 | 0 | 107.8 | R199 | R199-L201 PolarHBondContact O-N 3.07Š| ||
| 202 | L | 39 | Very low | 38.5 | Very low | 247 Ų | 247 | 164.8 Ų | 164.8 | 100% | 1.293 | 84% | 0.836 | S | S | * | * | trans | -169.5 | 0 | 150.5 | -100.5 | 159.6 | 0 | 0 | 0 | 108.6 |
Retrieved 202 of 202 residues in 323.9 ms
(Link to these results)