| 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 | 28 | Very low | 24.4 | Very low | 219 Ų | 219 | 121.7 Ų | 121.7 | 100% | 1.079 | 69% | 0.689 | S | S | * | * | 0 | 51.5 | 0 | -64.5 | -168.4 | -178.2 | 0 | 0 | 107.4 | |||||
| 2 | D | 26.4 | Very low | 25.4 | Very low | 141 Ų | 141 | 118.8 Ų | 118.8 | 75% | 0.754 | 66% | 0.663 | S | S | * | * | 88 | 92.3 | 75.6 | -57.8 | -20.2 | 0 | 0 | 0 | 107.4 | |||||
| 3 | Q | 21 | Very low | 27.2 | Very low | 167 Ų | 167 | 115.8 Ų | 115.8 | 78% | 0.78 | 64% | 0.641 | S | S | * | * | 63.6 | 123.8 | 99.9 | -75.1 | -150.2 | 0.6 | 0 | 0 | 113.4 | |||||
| 4 | I | 24.8 | Very low | 28.9 | Very low | 162 Ų | 162 | 109.2 Ų | 109.2 | 83% | 0.831 | 61% | 0.606 | S | S | * | * | trans | 163.9 | 81.1 | 145 | -78.6 | 151 | 0 | 0 | 0 | 103.9 | ||||
| 5 | E | 22.1 | Very low | 30.2 | Very low | 170 Ų | 170 | 103.3 Ų | 103.3 | 79% | 0.794 | 57% | 0.571 | S | S | * | * | 64.2 | 134.1 | 85.6 | -82.2 | -169.3 | 141 | 0 | 0 | 115.1 | A7 | E5-A7 PolarHBondContact O-N 3.47Š| |||
| 6 | A | 22.9 | Very low | 31 | Very low | 98 Ų | 98 | 96.8 Ų | 96.8 | 81% | 0.81 | 54% | 0.536 | S | S | * | . | trans | -60 | 122.7 | -168.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | G8 | A6-G8 PolarHBondContact O-N 2.81Š| ||
| 7 | A | 22.6 | Very low | 31.9 | Very low | 102 Ų | 102 | 91.1 Ų | 91.1 | 84% | 0.843 | 50% | 0.504 | S | S | * | . | trans | -72.2 | 75.6 | 156.9 | 0 | 0 | 0 | 0 | 0 | 108.9 | E5 V9 | E5-A7 PolarHBondContact O-N 3.47Å; A7-V9 PolarHBondContact O-N 2.7Å | ||
| 8 | G | 21.8 | Very low | 32.3 | Very low | 52 Ų | 52 | 86.2 Ų | 86.2 | 54% | 0.536 | 48% | 0.477 | S | S | . | . | trans | -64.4 | 109.1 | 167.8 | 0 | 0 | 0 | 0 | 0 | 109.3 | A6 E10 | A6-G8 PolarHBondContact O-N 2.81Å; G8-E10 PolarHBondContact O-N 3.04Å | ||
| 9 | V | 25 | Very low | 32.4 | Very low | 48 Ų | 48 | 82.9 Ų | 82.9 | 29% | 0.291 | 46% | 0.46 | S | S | . | . | trans | -66 | 102.7 | 167.2 | -174.6 | 0 | 0 | 0 | 0 | 107.4 | A7 L11 R271 | A7-V9 PolarHBondContact O-N 2.7Å; V9-L11 HydrophobicContact CG1-CG 4.38Å; V9-L11 PolarHBondContact O-N 3.36Å; V9-R271 PolarHBondContact O-NH1 3.06Å | ||
| 10 | E | 25.1 | Very low | 32.4 | Very low | 147 Ų | 147 | 80 Ų | 80 | 69% | 0.687 | 45% | 0.446 | S | S | * | . | trans | -66.2 | 105.8 | 165.5 | -70.3 | -173.9 | 153.8 | 0 | 0 | 108 | G8 F12 | G8-E10 PolarHBondContact O-N 3.04Å; E10-F12 HydrophobicContact CB-CD2 3.91Å; E10-F12 HydrophobicContact CB-CE2 3.57Å; E10-F12 HydrophobicContact CB-CZ 4.36Å; E10-F12 HydrophobicContact CG-CE2 4.41Å; E10-F12 PolarHBondContact O-N 3.28Å; E10-F12 WeakPolarHBondContact OE2-CE2 3.16Å; E10-F12 VanDerWaalsContact OE2-CZ 3.23Å; E10-F12 WeakPolarHBondContact OE2-CZ 2.86Å | ||
| 11 | L | 28.6 | Very low | 32.4 | Very low | 33 Ų | 33 | 78.9 Ų | 78.9 | 17% | 0.173 | 44% | 0.441 | C | S | . | . | trans | -87.8 | 97.3 | 169.4 | -79 | 169.1 | 0 | 0 | 0 | 106.8 | V9 E13 F15 L198 | V9-L11 HydrophobicContact CG1-CG 4.38Å; V9-L11 PolarHBondContact O-N 3.36Å; L11-E13 PolarHBondContact O-N 2.76Å; L11-F15 HydrophobicContact CB-CE2 3.98Å; L11-F15 HydrophobicContact CD2-CE2 4.3Å; L11-F15 HydrophobicContact CD2-CZ 4.25Å; L11-L198 HydrophobicContact CD1-CD1 4.27Å; L11-L198 HydrophobicContact CD2-CD1 3.52Å | ||
| 12 | F | 36.5 | Very low | 32.4 | Very low | 87 Ų | 87 | 72.6 Ų | 72.6 | 38% | 0.382 | 42% | 0.419 | S | S | . | . | trans | -74.5 | 116.1 | -176.4 | -84.7 | -89.6 | 0 | 0 | 0 | 112.5 | E10 F163 | E10-F12 HydrophobicContact CB-CD2 3.91Å; E10-F12 HydrophobicContact CB-CE2 3.57Å; E10-F12 HydrophobicContact CB-CZ 4.36Å; E10-F12 HydrophobicContact CG-CE2 4.41Å; E10-F12 PolarHBondContact O-N 3.28Å; E10-F12 WeakPolarHBondContact OE2-CE2 3.16Å; E10-F12 VanDerWaalsContact OE2-CZ 3.23Å; E10-F12 WeakPolarHBondContact OE2-CZ 2.86Å; F12-F163 HydrophobicContact CE1-CD2 4.43Å; F12-F163 HydrophobicContact CE1-CE2 4.29Å; F12-F163 HydrophobicContact CE2-CE2 4.49Å; F12-F163 HydrophobicContact CZ-CD2 4.35Å; F12-F163 AromaticContact CZ-CE2 3.93Å; F12-F163 HydrophobicContact CZ-CE2 3.93Å | ||
| 13 | E | 49.3 | Very low | 32.5 | Very low | 80 Ų | 80 | 73.4 Ų | 73.4 | 37% | 0.374 | 42% | 0.423 | S | S | . | . | S | Bend | trans | 46.4 | 137.7 | 149.8 | -65.3 | -160.7 | -162.7 | 0 | 0 | 121 | L11 D272 R276 | L11-E13 PolarHBondContact O-N 2.76Å; E13-D272 VanDerWaalsContact CG-OD2 3.31Å; E13-D272 WeakPolarHBondContact CG-OD2 3.39Å; E13-R276 VanDerWaalsContact CD-NH1 3.26Å; E13-R276 IonicContact OE1-NH1 3.08Å; E13-R276 PolarHBondContact OE1-NH1 3.04Å; E13-R276 IonicContact OE2-CZ 3.55Å; E13-R276 IonicContact OE2-NH1 3.62Å; E13-R276 PolarHBondContact OE2-NH1 3.23Å |
| 14 | P | 50.1 | Low | 32.8 | Very low | 23 Ų | 23 | 70 Ų | 70 | 15% | 0.149 | 41% | 0.414 | C | S | . | . | -89.6 | 130.3 | -86.2 | 32.4 | -22.6 | 0 | 0 | 0 | 111.6 | V16 R276 V277 | P14-V16 PolarHBondContact O-N 3.19Å; P14-R276 HydrophobicContact CG-CB 4.32Å; P14-R276 WeakPolarHBondContact CG-O 3.44Å; P14-V277 HydrophobicContact CB-CG2 4.02Å | |||
| 15 | F | 49.5 | Very low | 32.7 | Very low | 20 Ų | 20 | 68.1 Ų | 68.1 | 9% | 0.088 | 42% | 0.415 | C | S | . | . | trans | -76.8 | -9.3 | 177.7 | -61.1 | -80.9 | 0 | 0 | 0 | 113.3 | L11 E195 M199 V207 L208 H270 | L11-F15 HydrophobicContact CB-CE2 3.98Å; L11-F15 HydrophobicContact CD2-CE2 4.3Å; L11-F15 HydrophobicContact CD2-CZ 4.25Å; F15-E195 HydrophobicContact CE1-CG 3.99Å; F15-E195 HydrophobicContact CZ-CG 3.89Å; F15-M199 HydrophobicContact CD1-CG 3.72Å; F15-M199 HydrophobicContact CD1-SD 4.31Å; F15-M199 HydrophobicContact CE1-CG 3.49Å; F15-M199 VanDerWaalsContact CE1-CG 3.49Å; F15-M199 HydrophobicContact CE1-SD 3.93Å; F15-V207 VanDerWaalsContact O-CG1 3.3Å; F15-V207 WeakPolarHBondContact O-CG1 3.25Å; F15-L208 PolarHBondContact O-N 3.24Å; F15-H270 AromaticContact CD2-NE2 3.79Å; F15-H270 PolarHBondContact N-NE2 3.2Å | ||
| 16 | V | 43.1 | Very low | 32.9 | Very low | 0 Ų | 0 | 69.2 Ų | 69.2 | 0% | 0 | 42% | 0.417 | C | S | . | . | B | Isolated β-bridge | trans | -92.3 | 138.3 | -176.7 | -178.7 | 0 | 0 | 0 | 0 | 109.9 | P14 V256 M260 I263 L273 V277 | P14-V16 PolarHBondContact O-N 3.19Å; V16-V256 HydrophobicContact CG1-CG1 4.36Å; V16-M260 HydrophobicContact CG2-CG 4.43Å; V16-M260 HydrophobicContact CG2-SD 3.67Å; V16-I263 HydrophobicContact CG2-CD1 3.57Å; V16-L273 HydrophobicContact CB-CD1 3.95Å; V16-L273 HydrophobicContact CG1-CD1 4.34Å; V16-L273 HydrophobicContact CG2-CD1 3.82Å; V16-V277 HydrophobicContact CB-CG1 4.44Å; V16-V277 HydrophobicContact CB-CG2 3.95Å; V16-V277 HydrophobicContact CG1-CG1 4.2Å; V16-V277 HydrophobicContact CG1-CG2 4.37Å; V16-V277 WeakPolarHBondContact O-CG1 3.4Å |
| 17 | C | 44.8 | Very low | 32.9 | Very low | 0 Ų | 0 | 67.8 Ų | 67.8 | 0% | 0 | 41% | 0.406 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131 | 140.5 | 176 | -163.4 | 0 | 0 | 0 | 0 | 109.5 | C19 N206 L208 C227 S278 V280 | C17-C19 PolarHBondContact O-N 3.38Å; C17-N206 PolarHBondContact N-O 2.87Å; C17-N206 CarbonylContact O-C 3.57Å; C17-N206 WeakPolarHBondContact O-CA 3.42Å; C17-L208 HydrophobicContact CB-CB 4.06Å; C17-L208 HydrophobicContact CB-CD1 4.39Å; C17-C227 PolarHBondContact SG-SG 2.71Å; C17-S278 CarbonylContact C-O 3.54Å; C17-S278 VanDerWaalsContact CA-O 3.25Å; C17-S278 WeakPolarHBondContact CA-O 3.3Å; C17-S278 PolarHBondContact SG-O 2.84Å; C17-V280 HydrophobicContact CB-CG2 4.41Å; C17-V280 WeakPolarHBondContact SG-CG2 3.3Å |
| 18 | V | 39.3 | Very low | 32.9 | Very low | 3 Ų | 3 | 69.8 Ų | 69.8 | 2% | 0.018 | 41% | 0.408 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.7 | 101.8 | 178.9 | -156.2 | 0 | 0 | 0 | 0 | 108.8 | L252 D255 V256 V277 S278 I279 V280 | V18-L252 HydrophobicContact CB-CD2 4.18Å; V18-L252 HydrophobicContact CG1-CB 4.4Å; V18-L252 HydrophobicContact CG1-CD2 3.55Å; V18-D255 HydrophobicContact CG1-CB 3.28Å; V18-V256 HydrophobicContact CG1-CG2 4.41Å; V18-V256 HydrophobicContact CG2-CG2 3.63Å; V18-V277 HydrophobicContact CG2-CG1 3.56Å; V18-S278 PolarHBondContact N-O 3.4Å; V18-I279 HydrophobicContact CG2-CG1 4.39Å; V18-V280 PolarHBondContact O-N 2.83Å |
| 19 | C | 34.2 | Very low | 33.1 | Very low | 23 Ų | 23 | 74 Ų | 74 | 16% | 0.155 | 42% | 0.417 | C | S | . | . | trans | -105.3 | 122.9 | 170.6 | -92.4 | 0 | 0 | 0 | 0 | 111.7 | C17 T21 P205 N206 D255 V280 | C17-C19 PolarHBondContact O-N 3.38Å; C19-T21 PolarHBondContact O-N 3.28Å; C19-P205 VanDerWaalsContact CB-C 3.44Å; C19-P205 HydrophobicContact CB-CB 4.08Å; C19-P205 WeakPolarHBondContact CB-O 3.2Å; C19-P205 PolarHBondContact SG-O 3.45Å; C19-N206 PolarHBondContact N-ND2 3.21Å; C19-N206 PolarHBondContact O-ND2 3.05Å; C19-D255 VanDerWaalsContact O-CG 3.29Å; C19-V280 VanDerWaalsContact SG-CB 3.58Å; C19-V280 WeakPolarHBondContact SG-CG2 3.37Å | ||
| 20 | S | 33.9 | Very low | 33 | Very low | 24 Ų | 24 | 74.3 Ų | 74.3 | 17% | 0.168 | 43% | 0.429 | C | S | . | . | trans | -70.3 | 112.9 | 165.1 | 160.5 | 0 | 0 | 0 | 0 | 110 | S22 D255 R286 | S20-S22 PolarHBondContact O-N 2.95Å; S20-D255 WeakPolarHBondContact CA-OD2 3.41Å; S20-R286 PolarHBondContact OG-NH2 3.45Å | ||
| 21 | T | 32.2 | Very low | 33 | Very low | 58 Ų | 58 | 71.8 Ų | 71.8 | 36% | 0.356 | 43% | 0.434 | S | S | . | . | trans | -77.7 | 103.4 | 157.6 | 56.1 | 0 | 0 | 0 | 0 | 108.4 | C19 D23 P205 | C19-T21 PolarHBondContact O-N 3.28Å; T21-D23 VanDerWaalsContact C-N 3.27Å; T21-D23 PolarHBondContact O-N 3.08Å; T21-P205 HydrophobicContact CG2-CB 3.87Å; T21-P205 HydrophobicContact CG2-CG 3.82Å | ||
| 22 | S | 27.9 | Very low | 32.9 | Very low | 87 Ų | 87 | 76.8 Ų | 76.8 | 61% | 0.608 | 47% | 0.466 | S | S | * | . | trans | -75.8 | 81.2 | 165.7 | 51 | 0 | 0 | 0 | 0 | 108.9 | S20 | S20-S22 PolarHBondContact O-N 2.95Š| ||
| 23 | D | 27.6 | Very low | 32.5 | Very low | 157 Ų | 157 | 77.6 Ų | 77.6 | 84% | 0.84 | 48% | 0.482 | S | S | * | . | trans | -160.9 | 50.5 | 167.4 | -98.8 | -21 | 0 | 0 | 0 | 111.2 | T21 | T21-D23 VanDerWaalsContact C-N 3.27Å; T21-D23 PolarHBondContact O-N 3.08Å | ||
| 24 | T | 28.3 | Very low | 31.4 | Very low | 97 Ų | 97 | 77.7 Ų | 77.7 | 60% | 0.595 | 49% | 0.492 | S | S | * | . | trans | -128.7 | 98.5 | 155.4 | 51.2 | 0 | 0 | 0 | 0 | 107.7 | F26 | T24-F26 PolarHBondContact O-N 2.7Š| ||
| 25 | S | 22.1 | Very low | 30.4 | Very low | 121 Ų | 121 | 86 Ų | 86 | 85% | 0.846 | 53% | 0.526 | S | S | * | . | trans | -55.4 | 86.7 | 157.3 | 41.7 | 0 | 0 | 0 | 0 | 108.7 | A27 | S25-A27 PolarHBondContact O-N 3.18Š| ||
| 26 | F | 27.1 | Very low | 29.4 | Very low | 193 Ų | 193 | 90.8 Ų | 90.8 | 85% | 0.846 | 55% | 0.552 | S | S | * | * | trans | -74.8 | 86 | 158.6 | -109.6 | -88.7 | 0 | 0 | 0 | 106.4 | T24 T28 | T24-F26 PolarHBondContact O-N 2.7Å; F26-T28 PolarHBondContact O-N 3.16Å | ||
| 27 | A | 22.6 | Very low | 28.7 | Very low | 69 Ų | 69 | 98 Ų | 98 | 57% | 0.57 | 59% | 0.591 | S | S | * | * | trans | -51.2 | 125.2 | 159.1 | 0 | 0 | 0 | 0 | 0 | 107.6 | S25 I29 | S25-A27 PolarHBondContact O-N 3.18Å; A27-I29 VanDerWaalsContact C-N 3.3Å; A27-I29 PolarHBondContact O-N 3.24Å | ||
| 28 | T | 22.4 | Very low | 27.8 | Very low | 143 Ų | 143 | 105.3 Ų | 105.3 | 88% | 0.877 | 63% | 0.629 | S | S | * | * | trans | -51.5 | 93.8 | 166 | -54.9 | 0 | 0 | 0 | 0 | 109 | F26 | F26-T28 PolarHBondContact O-N 3.16Š| ||
| 29 | I | 24.9 | Very low | 27.1 | Very low | 141 Ų | 141 | 116.4 Ų | 116.4 | 72% | 0.723 | 67% | 0.671 | S | S | * | * | trans | -106 | 107.4 | 160.6 | -61.1 | -179.5 | 0 | 0 | 0 | 104.7 | A27 | A27-I29 VanDerWaalsContact C-N 3.3Å; A27-I29 PolarHBondContact O-N 3.24Å | ||
| 30 | G | 24.6 | Very low | 26.7 | Very low | 54 Ų | 54 | 121.4 Ų | 121.4 | 56% | 0.557 | 70% | 0.704 | S | S | * | * | trans | -53.6 | 159.5 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 31 | A | 25.3 | Very low | 26.2 | Very low | 95 Ų | 95 | 125.4 Ų | 125.4 | 79% | 0.785 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -34.5 | 144 | 168.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||
| 32 | T | 25.7 | Very low | 26 | Very low | 137 Ų | 137 | 128.1 Ų | 128.1 | 84% | 0.84 | 75% | 0.751 | S | S | * | * | trans | 94.3 | 73.6 | 177.1 | 75.9 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 33 | S | 27.4 | Very low | 26.1 | Very low | 105 Ų | 105 | 132.2 Ų | 132.2 | 73% | 0.734 | 77% | 0.765 | S | S | * | * | trans | -167.7 | 145.1 | 140.6 | 39.8 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 34 | S | 26.6 | Very low | 26 | Very low | 82 Ų | 82 | 133.7 Ų | 133.7 | 57% | 0.573 | 77% | 0.767 | S | S | * | * | trans | -68.1 | 142.6 | -164.9 | 68.5 | 0 | 0 | 0 | 0 | 113.9 | D36 | S34-D36 WeakPolarHBondContact CB-OD2 3.04Å; S34-D36 PolarHBondContact O-N 2.95Å; S34-D36 PolarHBondContact OG-OD2 3.22Å | ||
| 35 | F | 28.9 | Very low | 26 | Very low | 196 Ų | 196 | 135.4 Ų | 135.4 | 86% | 0.86 | 78% | 0.777 | S | S | * | * | S | Bend | trans | -79 | 48.8 | 169.2 | -96.5 | -87.9 | 0 | 0 | 0 | 111 | L38 | F35-L38 HydrophobicContact CD1-CD1 4.41Å; F35-L38 HydrophobicContact CE1-CD1 4.5Å |
| 36 | D | 29.3 | Very low | 26.2 | Very low | 121 Ų | 121 | 134.7 Ų | 134.7 | 65% | 0.647 | 77% | 0.772 | S | S | * | * | trans | -95.9 | 3 | -179.3 | -72.6 | -42.1 | 0 | 0 | 0 | 114.2 | S34 | S34-D36 WeakPolarHBondContact CB-OD2 3.04Å; S34-D36 PolarHBondContact O-N 2.95Å; S34-D36 PolarHBondContact OG-OD2 3.22Å | ||
| 37 | N | 28.4 | Very low | 26.4 | Very low | 152 Ų | 152 | 133 Ų | 133 | 81% | 0.813 | 77% | 0.772 | S | S | * | * | trans | -115.6 | 16.7 | -169.9 | -79.2 | -38.6 | 0 | 0 | 0 | 116.7 | R39 | N37-R39 PolarHBondContact O-N 2.83Š| ||
| 38 | L | 25.9 | Very low | 26.5 | Very low | 153 Ų | 153 | 134.8 Ų | 134.8 | 80% | 0.801 | 78% | 0.78 | S | S | * | * | trans | -95.5 | 67.3 | 166.5 | -78.5 | 159.9 | 0 | 0 | 0 | 110.5 | F35 C40 | F35-L38 HydrophobicContact CD1-CD1 4.41Å; F35-L38 HydrophobicContact CE1-CD1 4.5Å; L38-C40 PolarHBondContact O-N 3.07Å | ||
| 39 | R | 23.3 | Very low | 26.8 | Very low | 237 Ų | 237 | 139.2 Ų | 139.2 | 89% | 0.894 | 78% | 0.783 | S | S | * | * | trans | -74.5 | 100.8 | 164.2 | -85.5 | -173.6 | 174.2 | -149.7 | -1.3 | 109.1 | N37 | N37-R39 PolarHBondContact O-N 2.83Š| ||
| 40 | C | 26.7 | Very low | 26.8 | Very low | 127 Ų | 127 | 141.3 Ų | 141.3 | 86% | 0.858 | 79% | 0.789 | S | S | * | * | trans | -77.4 | 114.4 | 153.1 | -99.9 | 0 | 0 | 0 | 0 | 108 | L38 | L38-C40 PolarHBondContact O-N 3.07Š| ||
| 41 | S | 23.4 | Very low | 27.1 | Very low | 109 Ų | 109 | 145.3 Ų | 145.3 | 76% | 0.762 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -61 | 126.2 | 176.3 | -57.4 | 0 | 0 | 0 | 0 | 110.8 | L43 | S41-L43 PolarHBondContact O-N 3.36Š|
| 42 | P | 27.3 | Very low | 27.4 | Very low | 114 Ų | 114 | 147.7 Ų | 147.7 | 74% | 0.74 | 80% | 0.802 | S | S | * | * | P | Polyproline II helix | trans | -74.4 | 122.2 | 171.8 | 28 | -28.5 | 0 | 0 | 0 | 109.2 | H44 | P42-H44 PolarHBondContact O-N 3.17Š|
| 43 | L | 30.1 | Very low | 27.7 | Very low | 173 Ų | 173 | 149.2 Ų | 149.2 | 91% | 0.906 | 80% | 0.8 | S | S | * | * | P | Polyproline II helix | trans | -60.7 | 116.6 | 161.9 | -84.4 | 157.5 | 0 | 0 | 0 | 107.8 | S41 T45 | S41-L43 PolarHBondContact O-N 3.36Å; L43-T45 PolarHBondContact O-N 3.43Å |
| 44 | H | 26.4 | Very low | 27.8 | Very low | 188 Ų | 188 | 151.2 Ų | 151.2 | 87% | 0.87 | 80% | 0.801 | S | S | * | * | trans | -41.7 | 119 | -179 | -91.9 | -100.3 | 0 | 0 | 0 | 113.2 | P42 | P42-H44 PolarHBondContact O-N 3.17Š| ||
| 45 | T | 29 | Very low | 28 | Very low | 134 Ų | 134 | 153 Ų | 153 | 82% | 0.822 | 81% | 0.811 | S | S | * | * | trans | -129.5 | 121.3 | 144.7 | 52.9 | 0 | 0 | 0 | 0 | 107.5 | L43 N47 | L43-T45 PolarHBondContact O-N 3.43Å; T45-N47 PolarHBondContact O-N 2.74Å | ||
| 46 | S | 26.3 | Very low | 28 | Very low | 105 Ų | 105 | 148.4 Ų | 148.4 | 73% | 0.734 | 80% | 0.803 | S | S | * | * | trans | -69.1 | 116.1 | -179.5 | 49.7 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 47 | N | 29.3 | Very low | 28.2 | Very low | 159 Ų | 159 | 149.8 Ų | 149.8 | 85% | 0.85 | 81% | 0.81 | S | S | * | * | trans | -169.9 | 109.1 | 140.1 | -89.6 | -19.2 | 0 | 0 | 0 | 108.5 | T45 | T45-N47 PolarHBondContact O-N 2.74Š| ||
| 48 | S | 25.7 | Very low | 28.4 | Very low | 105 Ų | 105 | 149.7 Ų | 149.7 | 73% | 0.734 | 81% | 0.809 | S | S | * | * | trans | -79 | 128.6 | -178.7 | 46.7 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 49 | Y | 28.9 | Very low | 28.7 | Very low | 237 Ų | 237 | 145.5 Ų | 145.5 | 93% | 0.929 | 80% | 0.803 | S | S | * | * | trans | -148.2 | 114.1 | 148.3 | -76.9 | -75.7 | 0 | 0 | 0 | 108.8 | ||||
| 50 | E | 25.3 | Very low | 29.2 | Very low | 185 Ų | 185 | 140.6 Ų | 140.6 | 86% | 0.864 | 80% | 0.799 | S | S | * | * | trans | -73.8 | 142.4 | 170.1 | -75.6 | 167 | 124.2 | 0 | 0 | 110.8 | ||||
| 51 | V | 30.8 | Very low | 29.3 | Very low | 138 Ų | 138 | 142.4 Ų | 142.4 | 84% | 0.836 | 80% | 0.8 | S | S | * | * | trans | -157.1 | 107.2 | 137.9 | -169.6 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 52 | D | 31.3 | Very low | 29.6 | Very low | 145 Ų | 145 | 146.6 Ų | 146.6 | 78% | 0.775 | 80% | 0.8 | S | S | * | * | trans | 40.5 | 121.1 | 133.5 | -51.8 | -31.5 | 0 | 0 | 0 | 125.5 | ||||
| 53 | E | 31.2 | Very low | 29.8 | Very low | 169 Ų | 169 | 146.2 Ų | 146.2 | 79% | 0.79 | 80% | 0.795 | S | S | * | * | trans | 12.2 | 125.8 | 144.3 | -66.5 | -170.2 | 150.1 | 0 | 0 | 125.8 | ||||
| 54 | L | 30.2 | Very low | 29.8 | Very low | 147 Ų | 147 | 144.4 Ų | 144.4 | 77% | 0.77 | 79% | 0.794 | S | S | * | * | 63.6 | 165.2 | 129.1 | -72.9 | 157.7 | 0 | 0 | 0 | 119.8 | |||||
| 55 | P | 29.8 | Very low | 30.1 | Very low | 120 Ų | 120 | 143.7 Ų | 143.7 | 78% | 0.779 | 79% | 0.791 | S | S | * | * | cis | -139.6 | 177.1 | 16.9 | 35.3 | -11.7 | 0 | 0 | 0 | 117.6 | ||||
| 56 | S | 29.3 | Very low | 30.1 | Very low | 98 Ų | 98 | 142.6 Ų | 142.6 | 69% | 0.685 | 78% | 0.777 | S | S | * | * | trans | -71.2 | 152.5 | 175.3 | 53.6 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 57 | L | 33.1 | Very low | 30.2 | Very low | 151 Ų | 151 | 150 Ų | 150 | 79% | 0.791 | 79% | 0.788 | S | S | * | * | trans | 166.9 | 130.5 | 130.8 | -89.8 | 155.5 | 0 | 0 | 0 | 113.2 | ||||
| 58 | D | 33.5 | Very low | 30 | Very low | 150 Ų | 150 | 154.8 Ų | 154.8 | 80% | 0.802 | 80% | 0.795 | S | S | * | * | trans | 25.4 | 128.7 | 139.5 | -58.5 | -14.8 | 0 | 0 | 0 | 122 | ||||
| 59 | G | 30.9 | Very low | 30.1 | Very low | 64 Ų | 64 | 153 Ų | 153 | 66% | 0.66 | 79% | 0.792 | S | S | * | * | 87.6 | 118.9 | 128.8 | 0 | 0 | 0 | 0 | 0 | 118.4 | |||||
| 60 | T | 33.7 | Very low | 30 | Very low | 135 Ų | 135 | 146.2 Ų | 146.2 | 83% | 0.828 | 79% | 0.785 | S | S | * | * | trans | 86.7 | 123.9 | 152.8 | 73.6 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 61 | N | 30.5 | Very low | 30.1 | Very low | 164 Ų | 164 | 147.8 Ų | 147.8 | 88% | 0.877 | 79% | 0.785 | S | S | * | * | trans | 45.3 | 93.1 | 154.6 | -74.9 | -13.3 | 0 | 0 | 0 | 117.5 | ||||
| 62 | R | 28.4 | Very low | 29.8 | Very low | 198 Ų | 198 | 145.1 Ų | 145.1 | 75% | 0.747 | 79% | 0.785 | S | S | * | * | trans | -127.9 | 139 | 149.3 | -64.7 | -158.8 | -164.4 | -175.6 | 4 | 111.6 | E66 | R62-E66 WeakPolarHBondContact CD-OE2 3.44Å; R62-E66 IonicContact CZ-OE2 3.89Å; R62-E66 IonicContact NE-OE2 2.82Å; R62-E66 IonicContact NH1-OE1 3.93Å; R62-E66 PolarHBondContact NH1-OE1 2.9Å; R62-E66 IonicContact NH1-OE2 3.47Å; R62-E66 PolarHBondContact NH1-OE2 3.47Å | ||
| 63 | T | 31.5 | Very low | 29.5 | Very low | 105 Ų | 105 | 146 Ų | 146 | 64% | 0.644 | 78% | 0.784 | S | S | * | * | trans | -62.4 | 165.3 | 178.2 | 46.2 | 0 | 0 | 0 | 0 | 111.4 | E65 | T63-E65 PolarHBondContact O-N 3.34Š| ||
| 64 | P | 31.1 | Very low | 29.3 | Very low | 136 Ų | 136 | 145.2 Ų | 145.2 | 88% | 0.883 | 78% | 0.78 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.5 | 18.6 | -170.1 | -21.1 | 33.4 | 0 | 0 | 0 | 117.7 | ||
| 65 | E | 32 | Very low | 29 | Very low | 173 Ų | 173 | 145.7 Ų | 145.7 | 81% | 0.808 | 78% | 0.783 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -110.9 | 7.5 | -169.3 | -73.6 | -178 | 148.1 | 0 | 0 | 115.6 | T63 | T63-E65 PolarHBondContact O-N 3.34Š|
| 66 | E | 29.1 | Very low | 28.7 | Very low | 111 Ų | 111 | 147.2 Ų | 147.2 | 52% | 0.519 | 78% | 0.777 | S | S | . | * | trans | -131.8 | 87.6 | -178 | -72.4 | -177.5 | 149.4 | 0 | 0 | 113.3 | R62 | R62-E66 WeakPolarHBondContact CD-OE2 3.44Å; R62-E66 IonicContact CZ-OE2 3.89Å; R62-E66 IonicContact NE-OE2 2.82Å; R62-E66 IonicContact NH1-OE1 3.93Å; R62-E66 PolarHBondContact NH1-OE1 2.9Å; R62-E66 IonicContact NH1-OE2 3.47Å; R62-E66 PolarHBondContact NH1-OE2 3.47Å | ||
| 67 | W | 27.6 | Very low | 28.5 | Very low | 260 Ų | 260 | 147.2 Ų | 147.2 | 99% | 0.985 | 77% | 0.773 | S | S | * | * | trans | -133.4 | 96 | 155 | -73.9 | 93.5 | 0 | 0 | 0 | 108.8 | ||||
| 68 | R | 25.9 | Very low | 28 | Very low | 260 Ų | 260 | 150.7 Ų | 150.7 | 98% | 0.981 | 78% | 0.776 | S | S | * | * | trans | -121.5 | 103.4 | 166.2 | -114.2 | -172.3 | -92.4 | -120.1 | -0 | 107.2 | ||||
| 69 | G | 26.8 | Very low | 27.6 | Very low | 66 Ų | 66 | 152.3 Ų | 152.3 | 68% | 0.68 | 78% | 0.776 | S | S | * | * | trans | -118.9 | 144.9 | 174.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 70 | A | 28 | Very low | 27.3 | Very low | 95 Ų | 95 | 152.9 Ų | 152.9 | 79% | 0.785 | 77% | 0.77 | S | S | * | * | S | Bend | trans | -49.2 | 148.1 | -167.7 | 0 | 0 | 0 | 0 | 0 | 115 | ||
| 71 | Y | 27.1 | Very low | 26.7 | Very low | 219 Ų | 219 | 154.3 Ų | 154.3 | 86% | 0.859 | 77% | 0.773 | S | S | * | * | S | Bend | trans | 74.7 | 93.9 | -158.9 | -53.1 | -76.5 | 0 | 0 | 0 | 112.3 | H73 | Y71-H73 VanDerWaalsContact C-N 3.26Å; Y71-H73 PolarHBondContact O-N 3.16Å |
| 72 | G | 25.3 | Very low | 26.4 | Very low | 81 Ų | 81 | 151.7 Ų | 151.7 | 84% | 0.835 | 77% | 0.767 | S | S | * | * | S | Bend | trans | -62.8 | 66.1 | -172.1 | 0 | 0 | 0 | 0 | 0 | 117 | ||
| 73 | H | 25.2 | Very low | 26.2 | Very low | 165 Ų | 165 | 147.1 Ų | 147.1 | 76% | 0.764 | 76% | 0.757 | S | S | * | * | trans | -129 | 120 | 165 | -76.6 | -81.5 | 0 | 0 | 0 | 110.3 | Y71 L75 | Y71-H73 VanDerWaalsContact C-N 3.26Å; Y71-H73 PolarHBondContact O-N 3.16Å; H73-L75 PolarHBondContact O-N 2.96Å | ||
| 74 | E | 25.2 | Very low | 25.8 | Very low | 151 Ų | 151 | 146.5 Ų | 146.5 | 71% | 0.706 | 76% | 0.755 | S | S | * | * | trans | -73 | 102.4 | 177.4 | -163.5 | -179.8 | -157.1 | 0 | 0 | 109.3 | K76 | E74-K76 HydrophobicContact CG-CD 4.21Å; E74-K76 HydrophobicContact CG-CG 4.08Å; E74-K76 PolarHBondContact O-N 2.91Å; E74-K76 WeakPolarHBondContact OE1-CE 3.41Å; E74-K76 IonicContact OE1-NZ 3.39Å; E74-K76 PolarHBondContact OE1-NZ 3.46Å; E74-K76 IonicContact OE2-NZ 2.91Å; E74-K76 PolarHBondContact OE2-NZ 3.28Å; E74-K76 VanDerWaalsContact OE2-NZ 3.08Å | ||
| 75 | L | 24.2 | Very low | 25.4 | Very low | 157 Ų | 157 | 149.1 Ų | 149.1 | 82% | 0.822 | 75% | 0.749 | S | S | * | * | trans | -73.5 | 77.8 | 167.3 | -95.2 | 157 | 0 | 0 | 0 | 109.2 | H73 T77 | H73-L75 PolarHBondContact O-N 2.96Å; L75-T77 HydrophobicContact CD2-CG2 4.42Å; L75-T77 PolarHBondContact O-N 3.46Å | ||
| 76 | K | 23.6 | Very low | 25 | Very low | 153 Ų | 153 | 150.3 Ų | 150.3 | 67% | 0.665 | 75% | 0.746 | S | S | * | * | trans | -82.8 | 82.1 | 166.6 | -96.1 | 172.1 | 176.9 | 148.4 | 0 | 109.4 | E74 R78 | E74-K76 HydrophobicContact CG-CD 4.21Å; E74-K76 HydrophobicContact CG-CG 4.08Å; E74-K76 PolarHBondContact O-N 2.91Å; E74-K76 WeakPolarHBondContact OE1-CE 3.41Å; E74-K76 IonicContact OE1-NZ 3.39Å; E74-K76 PolarHBondContact OE1-NZ 3.46Å; E74-K76 IonicContact OE2-NZ 2.91Å; E74-K76 PolarHBondContact OE2-NZ 3.28Å; E74-K76 VanDerWaalsContact OE2-NZ 3.08Å; K76-R78 VanDerWaalsContact C-N 3.34Å; K76-R78 PolarHBondContact O-N 3.09Å | ||
| 77 | T | 26.6 | Very low | 24.7 | Very low | 97 Ų | 97 | 154.1 Ų | 154.1 | 60% | 0.595 | 76% | 0.764 | S | S | * | * | trans | -81.7 | 84.8 | 162.1 | 55 | 0 | 0 | 0 | 0 | 108.7 | L75 F79 | L75-T77 HydrophobicContact CD2-CG2 4.42Å; L75-T77 PolarHBondContact O-N 3.46Å; T77-F79 PolarHBondContact O-N 3.34Å | ||
| 78 | R | 22.4 | Very low | 24.6 | Very low | 224 Ų | 224 | 147.7 Ų | 147.7 | 85% | 0.845 | 75% | 0.754 | S | S | * | * | trans | -78.8 | 106 | 153.2 | -91 | -170.9 | 179.1 | -170.2 | 0.6 | 106.5 | K76 S80 | K76-R78 VanDerWaalsContact C-N 3.34Å; K76-R78 PolarHBondContact O-N 3.09Å; R78-S80 PolarHBondContact O-N 3.17Å | ||
| 79 | F | 24.4 | Very low | 24.6 | Very low | 184 Ų | 184 | 140.2 Ų | 140.2 | 81% | 0.807 | 74% | 0.739 | S | S | * | * | trans | -68.2 | 84.9 | 162.9 | -90.7 | -93.1 | 0 | 0 | 0 | 107.9 | T77 | T77-F79 PolarHBondContact O-N 3.34Š| ||
| 80 | S | 23.9 | Very low | 24.7 | Very low | 76 Ų | 76 | 142.8 Ų | 142.8 | 53% | 0.531 | 75% | 0.746 | S | S | . | * | S | Bend | trans | -146.7 | 104.7 | 162.7 | 64.3 | 0 | 0 | 0 | 0 | 107.2 | R78 S82 | R78-S80 PolarHBondContact O-N 3.17Å; S80-S82 PolarHBondContact O-N 3.32Å; S80-S82 VanDerWaalsContact O-N 3.11Å |
| 81 | D | 22.8 | Very low | 24.8 | Very low | 166 Ų | 166 | 145.8 Ų | 145.8 | 89% | 0.888 | 75% | 0.748 | S | S | * | * | S | Bend | trans | 36.2 | 58.5 | 160.7 | -56.1 | -19.2 | 0 | 0 | 0 | 117.2 | ||
| 82 | S | 23.3 | Very low | 24.9 | Very low | 108 Ų | 108 | 143.4 Ų | 143.4 | 76% | 0.755 | 75% | 0.75 | S | S | * | * | trans | -173.4 | 120.3 | 167.3 | -81.4 | 0 | 0 | 0 | 0 | 113.4 | S80 | S80-S82 PolarHBondContact O-N 3.32Å; S80-S82 VanDerWaalsContact O-N 3.11Å | ||
| 83 | I | 23.7 | Very low | 25.1 | Very low | 103 Ų | 103 | 149 Ų | 149 | 53% | 0.528 | 75% | 0.751 | S | S | . | * | trans | 13.3 | 117.8 | 148.8 | -55.4 | 166.3 | 0 | 0 | 0 | 117 | Y85 | I83-Y85 HydrophobicContact CB-CE2 4.17Å; I83-Y85 HydrophobicContact CG2-CD2 3.69Å; I83-Y85 HydrophobicContact CG2-CE2 3.41Å; I83-Y85 VanDerWaalsContact CG2-CE2 3.41Å; I83-Y85 HydrophobicContact CG2-CG 4.38Å | ||
| 84 | C | 23.1 | Very low | 25.2 | Very low | 92 Ų | 92 | 144.2 Ų | 144.2 | 62% | 0.622 | 75% | 0.747 | S | S | * | * | trans | -83.5 | 114.6 | 164.6 | -70.7 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 85 | Y | 22.5 | Very low | 25.3 | Very low | 190 Ų | 190 | 142.3 Ų | 142.3 | 75% | 0.745 | 75% | 0.75 | S | S | * | * | trans | -90.1 | 129.3 | 169 | -77.7 | -87 | 0 | 0 | 0 | 110.7 | I83 | I83-Y85 HydrophobicContact CB-CE2 4.17Å; I83-Y85 HydrophobicContact CG2-CD2 3.69Å; I83-Y85 HydrophobicContact CG2-CE2 3.41Å; I83-Y85 VanDerWaalsContact CG2-CE2 3.41Å; I83-Y85 HydrophobicContact CG2-CG 4.38Å | ||
| 86 | W | 24.5 | Very low | 25.3 | Very low | 199 Ų | 199 | 140.9 Ų | 140.9 | 75% | 0.754 | 75% | 0.748 | S | S | * | * | trans | -96.8 | 109.7 | 164.4 | -67.5 | 91.6 | 0 | 0 | 0 | 108.6 | ||||
| 87 | Q | 23 | Very low | 25.3 | Very low | 190 Ų | 190 | 139.4 Ų | 139.4 | 89% | 0.888 | 75% | 0.751 | S | S | * | * | trans | -98.1 | 115.2 | 164.9 | -94.8 | 178.7 | -44.2 | 0 | 0 | 108.6 | ||||
| 88 | T | 24.9 | Very low | 25.2 | Very low | 126 Ų | 126 | 143.3 Ų | 143.3 | 77% | 0.773 | 77% | 0.765 | S | S | * | * | trans | -84 | 135 | 161.6 | 38.7 | 0 | 0 | 0 | 0 | 109.2 | S90 | T88-S90 PolarHBondContact O-N 3.13Š| ||
| 89 | P | 26.8 | Very low | 25.1 | Very low | 103 Ų | 103 | 144.1 Ų | 144.1 | 67% | 0.669 | 77% | 0.768 | S | S | * | * | trans | -64 | 129.3 | 176.8 | -16.7 | 28.9 | 0 | 0 | 0 | 110.6 | L91 | P89-L91 PolarHBondContact O-N 3.31Š| ||
| 90 | S | 28 | Very low | 25 | Very low | 119 Ų | 119 | 141.3 Ų | 141.3 | 83% | 0.832 | 77% | 0.771 | S | S | * | * | trans | -64.5 | 101.8 | 165.8 | 16.3 | 0 | 0 | 0 | 0 | 109.2 | T88 L92 | T88-S90 PolarHBondContact O-N 3.13Å; S90-L92 PolarHBondContact O-N 2.9Å; S90-L92 VanDerWaalsContact O-N 3.16Å | ||
| 91 | L | 30 | Very low | 25.1 | Very low | 158 Ų | 158 | 142.1 Ų | 142.1 | 83% | 0.827 | 78% | 0.783 | S | S | * | * | trans | -70 | 109.3 | 166.5 | -75.6 | 172.4 | 0 | 0 | 0 | 109 | P89 F93 | P89-L91 PolarHBondContact O-N 3.31Å; L91-F93 PolarHBondContact O-N 3.42Å | ||
| 92 | L | 28.6 | Very low | 25.2 | Very low | 170 Ų | 170 | 142.1 Ų | 142.1 | 89% | 0.89 | 78% | 0.783 | S | S | * | * | trans | -55.3 | 108 | 161.3 | -80 | 148.7 | 0 | 0 | 0 | 109.2 | S90 | S90-L92 PolarHBondContact O-N 2.9Å; S90-L92 VanDerWaalsContact O-N 3.16Å | ||
| 93 | F | 29.8 | Very low | 25.3 | Very low | 197 Ų | 197 | 149.4 Ų | 149.4 | 86% | 0.864 | 79% | 0.794 | S | S | * | * | trans | -132.6 | 117.2 | 155.4 | -100.8 | -84.6 | 0 | 0 | 0 | 109.4 | L91 | L91-F93 PolarHBondContact O-N 3.42Š| ||
| 94 | G | 28.6 | Very low | 25.3 | Very low | 65 Ų | 65 | 147.7 Ų | 147.7 | 67% | 0.67 | 80% | 0.802 | S | S | * | * | trans | -74.9 | 159.1 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 95 | S | 26.3 | Very low | 25.5 | Very low | 112 Ų | 112 | 148.8 Ų | 148.8 | 78% | 0.783 | 81% | 0.81 | S | S | * | * | trans | 62.2 | 106.2 | 154.2 | 59 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 96 | T | 23.9 | Very low | 25.7 | Very low | 126 Ų | 126 | 147.2 Ų | 147.2 | 77% | 0.773 | 81% | 0.814 | S | S | * | * | 82.5 | 130 | 127.1 | -36.5 | 0 | 0 | 0 | 0 | 119 | |||||
| 97 | V | 24.7 | Very low | 25.7 | Very low | 122 Ų | 122 | 144.7 Ų | 144.7 | 74% | 0.739 | 82% | 0.815 | S | S | * | * | trans | 78.8 | 114.8 | 166.8 | -159.4 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 98 | M | 23.5 | Very low | 25.9 | Very low | 179 Ų | 179 | 139.3 Ų | 139.3 | 88% | 0.882 | 79% | 0.791 | S | S | * | * | -165.2 | 144.4 | 60.6 | -155.6 | 175.8 | -92.1 | 0 | 0 | 111 | |||||
| 99 | R | 21.8 | Very low | 25.9 | Very low | 242 Ų | 242 | 137.7 Ų | 137.7 | 91% | 0.913 | 79% | 0.785 | S | S | * | * | trans | -62.5 | 154.6 | 171.2 | -72.5 | 171.8 | 168.4 | 176.9 | -4.4 | 111.7 | ||||
| 100 | S | 22.4 | Very low | 25.9 | Very low | 124 Ų | 124 | 133.9 Ų | 133.9 | 87% | 0.867 | 76% | 0.759 | S | S | * | * | trans | 99.9 | 102.1 | 156.3 | -155.4 | 0 | 0 | 0 | 0 | 116.6 | ||||
| 101 | A | 25.4 | Very low | 25.8 | Very low | 94 Ų | 94 | 138.1 Ų | 138.1 | 78% | 0.777 | 76% | 0.758 | S | S | * | * | S | Bend | trans | -169.9 | 113.2 | 133.1 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||
| 102 | N | 24.9 | Very low | 25.8 | Very low | 165 Ų | 165 | 134.5 Ų | 134.5 | 88% | 0.882 | 74% | 0.742 | S | S | * | * | trans | 51.4 | 79.1 | 158.8 | -72.9 | -11.8 | 0 | 0 | 0 | 119.4 | G104 | N102-G104 VanDerWaalsContact C-N 3.34Å; N102-G104 PolarHBondContact O-N 3.05Å | ||
| 103 | R | 24.2 | Very low | 25.6 | Very low | 261 Ų | 261 | 131.9 Ų | 131.9 | 99% | 0.985 | 73% | 0.729 | S | S | * | * | trans | -82.2 | 81.7 | 148.4 | -76.5 | -173.1 | 180 | -176.7 | -0.2 | 109.5 | ||||
| 104 | G | 24.4 | Very low | 25.7 | Very low | 68 Ų | 68 | 130.8 Ų | 130.8 | 70% | 0.701 | 73% | 0.726 | S | S | * | * | trans | -98.6 | 69.8 | 165.2 | 0 | 0 | 0 | 0 | 0 | 110.1 | N102 L106 | N102-G104 VanDerWaalsContact C-N 3.34Å; N102-G104 PolarHBondContact O-N 3.05Å; G104-L106 PolarHBondContact O-N 3.11Å; G104-L106 VanDerWaalsContact O-N 3.14Å | ||
| 105 | S | 26.6 | Very low | 25.9 | Very low | 115 Ų | 115 | 133.7 Ų | 133.7 | 80% | 0.804 | 72% | 0.723 | S | S | * | * | trans | -75.7 | 93.8 | 171.9 | -175.2 | 0 | 0 | 0 | 0 | 108.2 | D107 | S105-D107 PolarHBondContact O-N 3.25Š| ||
| 106 | L | 27.7 | Very low | 26.2 | Very low | 156 Ų | 156 | 132.7 Ų | 132.7 | 82% | 0.817 | 72% | 0.721 | S | S | * | * | trans | -79.3 | 98 | 171.7 | -78.5 | 163.6 | 0 | 0 | 0 | 108.6 | G104 M108 | G104-L106 PolarHBondContact O-N 3.11Å; G104-L106 VanDerWaalsContact O-N 3.14Å; L106-M108 PolarHBondContact O-N 2.89Å; L106-M108 VanDerWaalsContact O-N 3.17Å | ||
| 107 | D | 24.4 | Very low | 26.5 | Very low | 146 Ų | 146 | 130.1 Ų | 130.1 | 78% | 0.781 | 72% | 0.72 | S | S | * | * | trans | -71.1 | 98.7 | 169.8 | -163.6 | 3.4 | 0 | 0 | 0 | 108.7 | S105 S109 | S105-D107 PolarHBondContact O-N 3.25Å; D107-S109 PolarHBondContact O-N 2.91Å | ||
| 108 | M | 26.7 | Very low | 26.8 | Very low | 77 Ų | 77 | 133.5 Ų | 133.5 | 38% | 0.379 | 73% | 0.725 | S | S | . | * | trans | -100.5 | 74.7 | -176.4 | -149.3 | 85.9 | -112.5 | 0 | 0 | 110 | L106 I110 A139 | L106-M108 PolarHBondContact O-N 2.89Å; L106-M108 VanDerWaalsContact O-N 3.17Å; M108-I110 HydrophobicContact CG-CD1 3.9Å; M108-I110 HydrophobicContact CG-CG1 3.92Å; M108-I110 PolarHBondContact O-N 3.36Å; M108-A139 HydrophobicContact CE-CB 3.27Å; M108-A139 HydrophobicContact CG-CB 3.99Å; M108-A139 HydrophobicContact SD-CB 3.17Å; M108-A139 WeakPolarHBondContact SD-CB 3.43Å | ||
| 109 | S | 25 | Very low | 27.1 | Very low | 93 Ų | 93 | 134.7 Ų | 134.7 | 65% | 0.65 | 72% | 0.72 | S | S | * | * | trans | -69.6 | 99.3 | 169.1 | 59.1 | 0 | 0 | 0 | 0 | 109.2 | D107 | D107-S109 PolarHBondContact O-N 2.91Š| ||
| 110 | I | 28.1 | Very low | 27.7 | Very low | 22 Ų | 22 | 132.7 Ų | 132.7 | 11% | 0.113 | 72% | 0.717 | C | S | . | * | trans | -95.1 | 102.2 | 178.3 | -64.9 | 166.7 | 0 | 0 | 0 | 108.2 | M108 V112 L140 L193 | M108-I110 HydrophobicContact CG-CD1 3.9Å; M108-I110 HydrophobicContact CG-CG1 3.92Å; M108-I110 PolarHBondContact O-N 3.36Å; I110-V112 HydrophobicContact CG2-CG2 3.85Å; I110-L140 HydrophobicContact CD1-CD2 4.15Å; I110-L140 HydrophobicContact CD1-CG 4.27Å; I110-L193 HydrophobicContact CD1-CD1 4.22Å; I110-L193 HydrophobicContact CD1-CD2 4.38Å | ||
| 111 | Y | 25.1 | Very low | 28.1 | Very low | 209 Ų | 209 | 136.3 Ų | 136.3 | 82% | 0.82 | 72% | 0.717 | S | S | * | * | trans | -83.3 | 119.7 | 156.3 | -86.6 | -98.3 | 0 | 0 | 0 | 107.6 | ||||
| 112 | V | 30 | Very low | 28.4 | Very low | 81 Ų | 81 | 137.9 Ų | 137.9 | 49% | 0.491 | 71% | 0.713 | S | S | . | * | trans | -96.7 | 111 | 161.4 | -176.7 | 0 | 0 | 0 | 0 | 104.9 | I110 E114 | I110-V112 HydrophobicContact CG2-CG2 3.85Å; V112-E114 PolarHBondContact O-N 3.1Å; V112-E114 VanDerWaalsContact O-N 3.14Å | ||
| 113 | D | 25 | Very low | 28.8 | Very low | 116 Ų | 116 | 137.6 Ų | 137.6 | 62% | 0.62 | 71% | 0.706 | S | S | * | * | trans | -70.9 | 105.3 | 179.4 | -162.5 | -21.1 | 0 | 0 | 0 | 109 | E115 A116 | D113-E115 PolarHBondContact O-N 2.67Å; D113-E115 PolarHBondContact OD1-N 3.34Å; D113-A116 PolarHBondContact O-N 3.45Å | ||
| 114 | E | 31.5 | Very low | 29 | Very low | 173 Ų | 173 | 132.3 Ų | 132.3 | 81% | 0.808 | 70% | 0.698 | S | S | * | * | G | 310 helix | trans | -64.8 | -15.2 | 178.5 | -74.2 | -174.7 | 154.4 | 0 | 0 | 112.4 | V112 | V112-E114 PolarHBondContact O-N 3.1Å; V112-E114 VanDerWaalsContact O-N 3.14Å |
| 115 | E | 32.5 | Very low | 29.3 | Very low | 126 Ų | 126 | 134.1 Ų | 134.1 | 59% | 0.589 | 70% | 0.7 | S | S | * | * | G | 310 helix | trans | -82.6 | -11.5 | -178.9 | -66.9 | -149.7 | 164 | 0 | 0 | 114.6 | D113 G117 K118 R119 | D113-E115 PolarHBondContact O-N 2.67Å; D113-E115 PolarHBondContact OD1-N 3.34Å; E115-G117 PolarHBondContact O-N 3.21Å; E115-K118 PolarHBondContact O-N 3.45Å; E115-R119 IonicContact OE2-NH2 3.51Å |
| 116 | A | 32.2 | Very low | 29.4 | Very low | 91 Ų | 91 | 136.9 Ų | 136.9 | 75% | 0.752 | 70% | 0.697 | S | S | * | * | G | 310 helix | trans | -68.7 | -15 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | D113 | D113-A116 PolarHBondContact O-N 3.45Š|
| 117 | G | 30.5 | Very low | 29.5 | Very low | 73 Ų | 73 | 135 Ų | 135 | 75% | 0.753 | 70% | 0.696 | S | S | * | * | G | 310 helix | trans | -90.4 | -1.4 | -178.1 | 0 | 0 | 0 | 0 | 0 | 116.3 | E115 | E115-G117 PolarHBondContact O-N 3.21Š|
| 118 | K | 30.4 | Very low | 29.8 | Very low | 192 Ų | 192 | 138.7 Ų | 138.7 | 84% | 0.835 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -125.4 | 8.1 | -167.7 | -78.3 | -179.2 | -179.6 | 167.9 | 0 | 117.1 | E115 | E115-K118 PolarHBondContact O-N 3.45Š|
| 119 | R | 30.4 | Very low | 30.1 | Very low | 205 Ų | 205 | 140.7 Ų | 140.7 | 77% | 0.774 | 71% | 0.711 | S | S | * | * | trans | -111.3 | 110.5 | -179 | -71 | -174.3 | -175.2 | -178.7 | 7.9 | 114.5 | E115 | E115-R119 IonicContact OE2-NH2 3.51Š| ||
| 120 | K | 33.9 | Very low | 30.6 | Very low | 200 Ų | 200 | 143.5 Ų | 143.5 | 87% | 0.87 | 72% | 0.718 | S | S | * | * | trans | 77.1 | 97.4 | 149.9 | -74.4 | -178.5 | 172.4 | 179.6 | 0 | 119.8 | N122 | K120-N122 PolarHBondContact O-N 3.06Š| ||
| 121 | K | 30.2 | Very low | 31.1 | Very low | 199 Ų | 199 | 148.3 Ų | 148.3 | 87% | 0.865 | 75% | 0.753 | S | S | * | * | trans | -50.1 | 118.1 | 130.5 | -69 | 176.6 | 175.9 | 178.3 | 0 | 109.2 | ||||
| 122 | N | 32 | Very low | 31.8 | Very low | 128 Ų | 128 | 143.9 Ų | 143.9 | 68% | 0.684 | 75% | 0.747 | S | S | * | * | trans | 157.6 | 137 | 136.6 | -92.5 | 15.5 | 0 | 0 | 0 | 110.1 | K120 | K120-N122 PolarHBondContact O-N 3.06Š| ||
| 123 | E | 33.3 | Very low | 32.5 | Very low | 158 Ų | 158 | 142.9 Ų | 142.9 | 74% | 0.738 | 74% | 0.742 | S | S | * | * | trans | 77.4 | 96.9 | 151.9 | -66.1 | 153 | -146.1 | 0 | 0 | 116.5 | ||||
| 124 | D | 28.2 | Very low | 33.6 | Very low | 151 Ų | 151 | 139.9 Ų | 139.9 | 81% | 0.807 | 73% | 0.73 | S | S | * | * | 43.8 | 137.2 | 123 | -59.6 | -19.9 | 0 | 0 | 0 | 120 | |||||
| 125 | S | 30.7 | Very low | 34.8 | Very low | 106 Ų | 106 | 136.8 Ų | 136.8 | 74% | 0.741 | 73% | 0.725 | S | S | * | * | trans | 90.3 | 108.6 | 163.3 | 79.2 | 0 | 0 | 0 | 0 | 117.2 | C127 | S125-C127 PolarHBondContact O-N 3.22Š| ||
| 126 | F | 29.7 | Very low | 35.8 | Very low | 173 Ų | 173 | 131.7 Ų | 131.7 | 76% | 0.759 | 70% | 0.703 | S | S | * | * | trans | 41.2 | 78.1 | 135.8 | -156.7 | -97.3 | 0 | 0 | 0 | 116.7 | ||||
| 127 | C | 29.2 | Very low | 36.7 | Very low | 117 Ų | 117 | 129.2 Ų | 129.2 | 79% | 0.791 | 68% | 0.68 | S | S | * | * | trans | -122.6 | 89.7 | 160 | -80.1 | 0 | 0 | 0 | 0 | 109.2 | S125 | S125-C127 PolarHBondContact O-N 3.22Š| ||
| 128 | R | 31.4 | Very low | 38 | Very low | 223 Ų | 223 | 128.6 Ų | 128.6 | 84% | 0.842 | 66% | 0.662 | S | S | * | * | trans | -86.4 | 13.5 | 158 | -80.7 | -170.7 | -165.8 | 162.1 | 5.9 | 111.9 | ||||
| 129 | D | 33.1 | Very low | 39.4 | Very low | 119 Ų | 119 | 120.1 Ų | 120.1 | 64% | 0.636 | 63% | 0.627 | S | S | * | * | trans | -98.6 | 112.6 | -173.5 | -68.9 | -37.5 | 0 | 0 | 0 | 112.7 | ||||
| 130 | L | 35.7 | Very low | 40.7 | Very low | 151 Ų | 151 | 111.4 Ų | 111.4 | 79% | 0.791 | 60% | 0.596 | S | S | * | * | trans | 52.3 | 69.9 | 130.9 | -66.1 | 147.5 | 0 | 0 | 0 | 117 | V132 | L130-V132 PolarHBondContact O-N 2.68Š| ||
| 131 | C | 37.2 | Very low | 42 | Very low | 124 Ų | 124 | 108.1 Ų | 108.1 | 84% | 0.838 | 58% | 0.581 | S | S | * | * | trans | -82.6 | 102.5 | 144.3 | -164.7 | 0 | 0 | 0 | 0 | 107.2 | P133 | C131-P133 VanDerWaalsContact O-CD 3.3Å; C131-P133 WeakPolarHBondContact O-CD 3.38Å; C131-P133 VanDerWaalsContact O-N 3.12Å | ||
| 132 | V | 40.5 | Very low | 43.5 | Very low | 116 Ų | 116 | 104.3 Ų | 104.3 | 70% | 0.703 | 57% | 0.571 | S | S | * | * | P | Polyproline II helix | trans | -57.2 | 116.3 | 168.9 | -178.9 | 0 | 0 | 0 | 0 | 106.4 | L130 S134 | L130-V132 PolarHBondContact O-N 2.68Å; V132-S134 PolarHBondContact O-N 3.19Å |
| 133 | P | 45 | Very low | 44.8 | Very low | 59 Ų | 59 | 99.6 Ų | 99.6 | 38% | 0.383 | 55% | 0.55 | S | S | . | . | P | Polyproline II helix | trans | -59.8 | 131.6 | -178.8 | 17.6 | -23 | 0 | 0 | 0 | 108.2 | C131 C137 V138 | C131-P133 VanDerWaalsContact O-CD 3.3Å; C131-P133 WeakPolarHBondContact O-CD 3.38Å; C131-P133 VanDerWaalsContact O-N 3.12Å; P133-C137 HydrophobicContact CB-CB 4.05Å; P133-V138 HydrophobicContact CB-CG2 3.99Å; P133-V138 HydrophobicContact CG-CG2 3.89Å |
| 134 | S | 47.9 | Very low | 46.3 | Very low | 53 Ų | 53 | 92.4 Ų | 92.4 | 37% | 0.371 | 52% | 0.516 | S | S | . | . | P | Polyproline II helix | trans | -52.9 | 151.5 | 179.4 | 62.8 | 0 | 0 | 0 | 0 | 110.3 | V132 S136 C137 V138 | V132-S134 PolarHBondContact O-N 3.19Å; S134-S136 WeakPolarHBondContact CB-OG 3.49Å; S134-S136 PolarHBondContact O-N 2.83Å; S134-S136 PolarHBondContact OG-OG 3.39Å; S134-C137 WeakPolarHBondContact O-CA 3.42Å; S134-C137 WeakPolarHBondContact O-CB 3.42Å; S134-C137 PolarHBondContact O-N 3.36Å; S134-C137 WeakPolarHBondContact OG-CB 3.49Å; S134-C137 PolarHBondContact OG-N 2.89Å; S134-V138 PolarHBondContact O-N 3.3Å |
| 135 | P | 56.1 | Low | 48.4 | Very low | 108 Ų | 108 | 89.8 Ų | 89.8 | 70% | 0.701 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -50.9 | -33.4 | 173 | -28.2 | 35.3 | 0 | 0 | 0 | 112.5 | A139 | P135-A139 WeakPolarHBondContact O-CB 3.4Å; P135-A139 PolarHBondContact O-N 3.42Å |
| 136 | S | 54.2 | Low | 50.9 | Low | 19 Ų | 19 | 91.7 Ų | 91.7 | 13% | 0.133 | 49% | 0.493 | C | S | . | . | H | α-helix | trans | -65.5 | -40.9 | 172.6 | 52.2 | 0 | 0 | 0 | 0 | 113.4 | S134 L140 | S134-S136 WeakPolarHBondContact CB-OG 3.49Å; S134-S136 PolarHBondContact O-N 2.83Å; S134-S136 PolarHBondContact OG-OG 3.39Å; S136-L140 WeakPolarHBondContact O-CB 3.16Å; S136-L140 VanDerWaalsContact O-CG 3.25Å; S136-L140 WeakPolarHBondContact O-CG 3.41Å; S136-L140 PolarHBondContact O-N 3.25Å |
| 137 | C | 50.9 | Low | 53.6 | Low | 40 Ų | 40 | 86.8 Ų | 86.8 | 27% | 0.27 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -68.1 | -42.7 | 176.2 | -175.3 | 0 | 0 | 0 | 0 | 111.9 | P133 S134 A139 L140 K141 | P133-C137 HydrophobicContact CB-CB 4.05Å; S134-C137 WeakPolarHBondContact O-CA 3.42Å; S134-C137 WeakPolarHBondContact O-CB 3.42Å; S134-C137 PolarHBondContact O-N 3.36Å; S134-C137 WeakPolarHBondContact OG-CB 3.49Å; S134-C137 PolarHBondContact OG-N 2.89Å; C137-A139 VanDerWaalsContact C-N 3.35Å; C137-L140 PolarHBondContact O-N 3.29Å; C137-K141 WeakPolarHBondContact O-CB 3.45Å; C137-K141 WeakPolarHBondContact O-CG 3.14Å; C137-K141 PolarHBondContact O-N 3.22Å |
| 138 | V | 57.6 | Low | 56.3 | Low | 60 Ų | 60 | 82.6 Ų | 82.6 | 36% | 0.364 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -62.6 | -45.1 | 175.6 | 177.4 | 0 | 0 | 0 | 0 | 110.4 | P133 S134 K141 N142 | P133-V138 HydrophobicContact CB-CG2 3.99Å; P133-V138 HydrophobicContact CG-CG2 3.89Å; S134-V138 PolarHBondContact O-N 3.3Å; V138-K141 PolarHBondContact O-N 3.42Å; V138-N142 VanDerWaalsContact O-CG 3.27Å; V138-N142 PolarHBondContact O-N 3.04Å; V138-N142 PolarHBondContact O-ND2 3.09Å |
| 139 | A | 59.9 | Low | 59 | Low | 13 Ų | 13 | 79 Ų | 79 | 11% | 0.107 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -61 | -45 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | M108 P135 C137 N142 A143 | M108-A139 HydrophobicContact CE-CB 3.27Å; M108-A139 HydrophobicContact CG-CB 3.99Å; M108-A139 HydrophobicContact SD-CB 3.17Å; M108-A139 WeakPolarHBondContact SD-CB 3.43Å; P135-A139 WeakPolarHBondContact O-CB 3.4Å; P135-A139 PolarHBondContact O-N 3.42Å; C137-A139 VanDerWaalsContact C-N 3.35Å; A139-N142 PolarHBondContact O-N 2.83Å; A139-A143 WeakPolarHBondContact O-CB 3.36Å; A139-A143 PolarHBondContact O-N 3.47Å |
| 140 | L | 58.5 | Low | 61.6 | Low | 23 Ų | 23 | 74.4 Ų | 74.4 | 12% | 0.12 | 40% | 0.404 | C | S | . | . | H | α-helix | trans | -62.7 | -44.8 | 176.7 | -75.8 | 169.3 | 0 | 0 | 0 | 111.2 | I110 S136 C137 N142 A143 V144 L147 L220 | I110-L140 HydrophobicContact CD1-CD2 4.15Å; I110-L140 HydrophobicContact CD1-CG 4.27Å; S136-L140 WeakPolarHBondContact O-CB 3.16Å; S136-L140 VanDerWaalsContact O-CG 3.25Å; S136-L140 WeakPolarHBondContact O-CG 3.41Å; S136-L140 PolarHBondContact O-N 3.25Å; C137-L140 PolarHBondContact O-N 3.29Å; L140-N142 PolarHBondContact O-N 2.97Å; L140-A143 PolarHBondContact O-N 3.4Å; L140-A143 VanDerWaalsContact O-N 3.15Å; L140-V144 WeakPolarHBondContact O-CG2 3.39Å; L140-V144 PolarHBondContact O-N 2.88Å; L140-L147 HydrophobicContact CB-CD1 4.15Å; L140-L220 HydrophobicContact CD2-CD1 4.29Å |
| 141 | K | 59.9 | Low | 64.2 | Low | 130 Ų | 130 | 73.2 Ų | 73.2 | 57% | 0.565 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -58.6 | -33.3 | 175.7 | -77.5 | -179.6 | 177.8 | -178.1 | 0 | 112.8 | C137 V138 L147 | C137-K141 WeakPolarHBondContact O-CB 3.45Å; C137-K141 WeakPolarHBondContact O-CG 3.14Å; C137-K141 PolarHBondContact O-N 3.22Å; V138-K141 PolarHBondContact O-N 3.42Å; K141-L147 HydrophobicContact CG-CD1 4.27Å |
| 142 | N | 62.5 | Low | 66.8 | Low | 119 Ų | 119 | 69.7 Ų | 69.7 | 64% | 0.636 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -83.3 | -31.1 | 177.1 | -67.9 | -23.1 | 0 | 0 | 0 | 112.9 | V138 A139 L140 | V138-N142 VanDerWaalsContact O-CG 3.27Å; V138-N142 PolarHBondContact O-N 3.04Å; V138-N142 PolarHBondContact O-ND2 3.09Å; A139-N142 PolarHBondContact O-N 2.83Å; L140-N142 PolarHBondContact O-N 2.97Å |
| 143 | A | 58.7 | Low | 69.4 | Low | 30 Ų | 30 | 64.2 Ų | 64.2 | 25% | 0.248 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -86.6 | -13.6 | -174.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | A139 L140 R200 | A139-A143 WeakPolarHBondContact O-CB 3.36Å; A139-A143 PolarHBondContact O-N 3.47Å; L140-A143 PolarHBondContact O-N 3.4Å; L140-A143 VanDerWaalsContact O-N 3.15Å; A143-R200 WeakPolarHBondContact O-CD 3.3Å |
| 144 | V | 65.5 | Low | 71.8 | Confident | 6 Ų | 6 | 63.7 Ų | 63.7 | 4% | 0.036 | 33% | 0.331 | C | S | . | . | S | Bend | trans | -126.8 | 140.4 | 175.1 | -61.5 | 0 | 0 | 0 | 0 | 111.5 | L140 R146 L147 V196 F210 A213 L220 | L140-V144 WeakPolarHBondContact O-CG2 3.39Å; L140-V144 PolarHBondContact O-N 2.88Å; V144-R146 PolarHBondContact O-N 3.46Å; V144-L147 HydrophobicContact CG2-CB 4.44Å; V144-L147 HydrophobicContact CG2-CD1 4.21Å; V144-L147 HydrophobicContact CG2-CD2 3.28Å; V144-L147 HydrophobicContact CG2-CG 3.32Å; V144-V196 HydrophobicContact CG1-CG1 3.68Å; V144-F210 HydrophobicContact CG1-CZ 4.47Å; V144-A213 HydrophobicContact CB-CB 4.28Å; V144-A213 HydrophobicContact CG1-CB 3.72Å; V144-L220 HydrophobicContact CG1-CD2 4.47Å |
| 145 | L | 72.9 | Confident | 74 | Confident | 97 Ų | 97 | 64.8 Ų | 64.8 | 51% | 0.508 | 33% | 0.332 | S | S | . | . | S | Bend | trans | -57.9 | -38.9 | -179.6 | -66.4 | 173.8 | 0 | 0 | 0 | 111.6 | R200 F210 | L145-R200 HydrophobicContact CD2-CG 4.32Å; L145-R200 HydrophobicContact CG-CG 4.29Å; L145-F210 HydrophobicContact CD1-CD1 4Å; L145-F210 WeakPolarHBondContact CD1-O 3.42Å; L145-F210 HydrophobicContact CG-CD1 4.24Å |
| 146 | R | 83.2 | Confident | 75.8 | Confident | 145 Ų | 145 | 64 Ų | 64 | 55% | 0.547 | 32% | 0.319 | S | S | . | . | trans | -150.9 | 142.5 | 177.7 | -64.9 | -176.3 | -180 | 150.5 | -3.6 | 109.4 | V144 Y148 G212 A213 | V144-R146 PolarHBondContact O-N 3.46Å; R146-Y148 HydrophobicContact CB-CD2 4.25Å; R146-Y148 HydrophobicContact CB-CE2 3.48Å; R146-Y148 VanDerWaalsContact CB-CE2 3.48Å; R146-Y148 WeakPolarHBondContact CD-OH 3.38Å; R146-G212 CarbonylContact O-C 3.47Å; R146-G212 VanDerWaalsContact O-CA 3.23Å; R146-G212 WeakPolarHBondContact O-CA 3.49Å; R146-A213 PolarHBondContact O-N 2.91Å | ||
| 147 | L | 84.8 | Confident | 77.4 | Confident | 71 Ų | 71 | 68 Ų | 68 | 37% | 0.372 | 35% | 0.345 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.8 | 135 | 170.4 | -75.2 | 170.2 | 0 | 0 | 0 | 109.2 | L140 K141 V144 A213 V215 L220 | L140-L147 HydrophobicContact CB-CD1 4.15Å; K141-L147 HydrophobicContact CG-CD1 4.27Å; V144-L147 HydrophobicContact CG2-CB 4.44Å; V144-L147 HydrophobicContact CG2-CD1 4.21Å; V144-L147 HydrophobicContact CG2-CD2 3.28Å; V144-L147 HydrophobicContact CG2-CG 3.32Å; L147-A213 WeakPolarHBondContact CA-O 3.49Å; L147-V215 HydrophobicContact CD2-CG2 3.76Å; L147-L220 HydrophobicContact CD2-CD1 4.48Å |
| 148 | Y | 87.6 | Confident | 78.8 | Confident | 28 Ų | 28 | 70 Ų | 70 | 11% | 0.11 | 35% | 0.352 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126 | 155.3 | 176 | -61 | -88.3 | 0 | 0 | 0 | 110.3 | R146 F153 H171 A213 C214 V215 L223 | R146-Y148 HydrophobicContact CB-CD2 4.25Å; R146-Y148 HydrophobicContact CB-CE2 3.48Å; R146-Y148 VanDerWaalsContact CB-CE2 3.48Å; R146-Y148 WeakPolarHBondContact CD-OH 3.38Å; Y148-F153 VanDerWaalsContact CB-CE2 3.45Å; Y148-F153 HydrophobicContact CD1-CE2 4.36Å; Y148-F153 AromaticContact CD1-CZ 3.87Å; Y148-F153 HydrophobicContact CD1-CZ 3.87Å; Y148-F153 HydrophobicContact CD2-CZ 4.15Å; Y148-F153 HydrophobicContact CE1-CZ 4.49Å; Y148-F153 AromaticContact CG-CE2 3.94Å; Y148-F153 HydrophobicContact CG-CE2 3.94Å; Y148-F153 AromaticContact CG-CZ 3.66Å; Y148-F153 HydrophobicContact CG-CZ 3.66Å; Y148-H171 AromaticContact CD1-CD2 3.98Å; Y148-H171 AromaticContact CD1-NE2 3.75Å; Y148-H171 AromaticContact CE1-NE2 3.73Å; Y148-A213 PolarHBondContact N-O 3.39Å; Y148-C214 WeakPolarHBondContact O-CA 3.11Å; Y148-V215 PolarHBondContact O-N 3.39Å; Y148-V215 VanDerWaalsContact O-N 3.12Å; Y148-L223 HydrophobicContact CD2-CD1 3.46Å; Y148-L223 VanDerWaalsContact CD2-CD1 3.46Å; Y148-L223 HydrophobicContact CE2-CD1 4.08Å; Y148-L223 HydrophobicContact CG-CD1 4.11Å |
| 149 | R | 87.5 | Confident | 79.8 | Confident | 147 Ų | 147 | 69 Ų | 69 | 56% | 0.555 | 35% | 0.354 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -89.8 | 151.9 | 166.2 | -63.7 | 174.4 | 65.6 | 108.6 | 2.4 | 109.1 | E151 D152 F153 C214 | R149-E151 IonicContact CZ-OE2 3.27Å; R149-E151 VanDerWaalsContact CZ-OE2 3.27Å; R149-E151 IonicContact NE-OE2 2.89Å; R149-E151 PolarHBondContact NE-OE2 3.29Å; R149-E151 IonicContact NH2-OE1 3.2Å; R149-E151 PolarHBondContact NH2-OE1 3Å; R149-E151 IonicContact NH2-OE2 2.84Å; R149-E151 PolarHBondContact NH2-OE2 2.95Å; R149-E151 PolarHBondContact O-N 3.17Å; R149-D152 PolarHBondContact N-OD2 3.2Å; R149-D152 VanDerWaalsContact O-CB 3.3Å; R149-D152 WeakPolarHBondContact O-CB 3.42Å; R149-D152 PolarHBondContact O-N 2.91Å; R149-D152 VanDerWaalsContact O-N 3.07Å; R149-F153 WeakPolarHBondContact O-CD2 3.48Å; R149-C214 VanDerWaalsContact C-SG 3.59Å |
| 150 | M | 88.3 | Confident | 80.6 | Confident | 24 Ų | 24 | 75.3 Ų | 75.3 | 12% | 0.118 | 38% | 0.381 | C | S | . | . | G | 310 helix | trans | -61.4 | -34.8 | 178.4 | -163.3 | 61.3 | -96.8 | 0 | 0 | 111.7 | D152 F153 L155 L180 C214 D216 | M150-D152 PolarHBondContact O-N 2.96Å; M150-F153 HydrophobicContact CE-CB 3.95Å; M150-F153 HydrophobicContact CE-CD2 3.98Å; M150-F153 HydrophobicContact CE-CG 4.36Å; M150-F153 PolarHBondContact O-N 3.28Å; M150-L155 HydrophobicContact CE-CD1 3.45Å; M150-L155 VanDerWaalsContact CE-CD1 3.45Å; M150-L155 HydrophobicContact CE-CD2 3.76Å; M150-L155 HydrophobicContact CE-CG 3.73Å; M150-L155 HydrophobicContact SD-CD2 4.37Å; M150-L180 HydrophobicContact CE-CD2 3.36Å; M150-L180 HydrophobicContact SD-CD2 3.44Å; M150-L180 WeakPolarHBondContact SD-CD2 3.3Å; M150-C214 WeakPolarHBondContact CA-SG 3.44Å; M150-C214 PolarHBondContact N-SG 2.96Å; M150-D216 HydrophobicContact CB-CB 4.11Å |
| 151 | E | 89.8 | Confident | 81.2 | Confident | 125 Ų | 125 | 75.8 Ų | 75.8 | 58% | 0.584 | 39% | 0.392 | S | S | * | . | G | 310 helix | trans | -60.4 | -24.5 | 176.8 | -62.8 | 153.7 | -174.6 | 0 | 0 | 113.4 | R149 F153 R172 | R149-E151 IonicContact CZ-OE2 3.27Å; R149-E151 VanDerWaalsContact CZ-OE2 3.27Å; R149-E151 IonicContact NE-OE2 2.89Å; R149-E151 PolarHBondContact NE-OE2 3.29Å; R149-E151 IonicContact NH2-OE1 3.2Å; R149-E151 PolarHBondContact NH2-OE1 3Å; R149-E151 IonicContact NH2-OE2 2.84Å; R149-E151 PolarHBondContact NH2-OE2 2.95Å; R149-E151 PolarHBondContact O-N 3.17Å; E151-F153 PolarHBondContact O-N 2.93Å; E151-F153 VanDerWaalsContact O-N 3.14Å; E151-R172 WeakPolarHBondContact O-CD 3.44Å; E151-R172 PolarHBondContact O-NE 3.49Å |
| 152 | D | 91.3 | Very high | 81.9 | Confident | 51 Ų | 51 | 77.8 Ų | 77.8 | 27% | 0.273 | 40% | 0.401 | S | S | . | . | G | 310 helix | trans | -70.4 | -7.9 | -179.7 | -59.3 | -29.3 | 0 | 0 | 0 | 112.4 | R149 M150 R172 | R149-D152 PolarHBondContact N-OD2 3.2Å; R149-D152 VanDerWaalsContact O-CB 3.3Å; R149-D152 WeakPolarHBondContact O-CB 3.42Å; R149-D152 PolarHBondContact O-N 2.91Å; R149-D152 VanDerWaalsContact O-N 3.07Å; M150-D152 PolarHBondContact O-N 2.96Å; D152-R172 WeakPolarHBondContact O-CB 3.2Å; D152-R172 VanDerWaalsContact O-CG 3.3Å; D152-R172 WeakPolarHBondContact O-CG 3.45Å; D152-R172 PolarHBondContact O-N 3.28Å |
| 153 | F | 94.4 | Very high | 82.4 | Confident | 1 Ų | 1 | 76 Ų | 76 | 0% | 0.004 | 39% | 0.388 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.6 | 149 | -175 | -63 | -73.9 | 0 | 0 | 0 | 113.3 | Y148 R149 M150 E151 L155 V169 R170 H171 R172 L178 L223 | Y148-F153 VanDerWaalsContact CB-CE2 3.45Å; Y148-F153 HydrophobicContact CD1-CE2 4.36Å; Y148-F153 AromaticContact CD1-CZ 3.87Å; Y148-F153 HydrophobicContact CD1-CZ 3.87Å; Y148-F153 HydrophobicContact CD2-CZ 4.15Å; Y148-F153 HydrophobicContact CE1-CZ 4.49Å; Y148-F153 AromaticContact CG-CE2 3.94Å; Y148-F153 HydrophobicContact CG-CE2 3.94Å; Y148-F153 AromaticContact CG-CZ 3.66Å; Y148-F153 HydrophobicContact CG-CZ 3.66Å; R149-F153 WeakPolarHBondContact O-CD2 3.48Å; M150-F153 HydrophobicContact CE-CB 3.95Å; M150-F153 HydrophobicContact CE-CD2 3.98Å; M150-F153 HydrophobicContact CE-CG 4.36Å; M150-F153 PolarHBondContact O-N 3.28Å; E151-F153 PolarHBondContact O-N 2.93Å; E151-F153 VanDerWaalsContact O-N 3.14Å; F153-L155 HydrophobicContact CB-CD1 4.21Å; F153-V169 HydrophobicContact CB-CB 4.01Å; F153-V169 HydrophobicContact CB-CG1 4.38Å; F153-V169 HydrophobicContact CD1-CB 3.8Å; F153-V169 HydrophobicContact CD1-CG2 3.65Å; F153-V169 HydrophobicContact CE1-CG2 3.97Å; F153-V169 HydrophobicContact CG-CB 4.05Å; F153-V169 HydrophobicContact CG-CG2 4.19Å; F153-R170 WeakPolarHBondContact CA-O 3.45Å; F153-H171 HydrophobicContact CD1-CB 4.07Å; F153-H171 HydrophobicContact CE1-CB 3.74Å; F153-H171 AromaticContact CE1-CD2 3.86Å; F153-R172 PolarHBondContact O-NE 3.32Å; F153-R172 PolarHBondContact O-NH2 3.34Å; F153-L178 HydrophobicContact CE1-CD1 4.05Å; F153-L178 HydrophobicContact CZ-CD1 4.43Å; F153-L223 HydrophobicContact CE2-CD1 3.9Å; F153-L223 HydrophobicContact CE2-CD2 4.45Å; F153-L223 HydrophobicContact CZ-CD1 3.61Å; F153-L223 HydrophobicContact CZ-CD2 4.14Å |
| 154 | S | 95.7 | Very high | 83.5 | Confident | 47 Ų | 47 | 75.6 Ų | 75.6 | 33% | 0.329 | 38% | 0.383 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.1 | 127.1 | 155.2 | 60.3 | 0 | 0 | 0 | 0 | 109.1 | V169 R170 | S154-V169 WeakPolarHBondContact O-CA 3.36Å; S154-R170 PolarHBondContact N-O 3.16Å; S154-R170 PolarHBondContact O-N 3.06Å; S154-R170 WeakPolarHBondContact OG-CB 3.21Å |
| 155 | L | 95.2 | Very high | 84.3 | Confident | 76 Ų | 76 | 77.8 Ų | 77.8 | 40% | 0.398 | 39% | 0.393 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.9 | 139.5 | -174.9 | -65.2 | 69.4 | 0 | 0 | 0 | 111.2 | M150 F153 Y167 V169 | M150-L155 HydrophobicContact CE-CD1 3.45Å; M150-L155 VanDerWaalsContact CE-CD1 3.45Å; M150-L155 HydrophobicContact CE-CD2 3.76Å; M150-L155 HydrophobicContact CE-CG 3.73Å; M150-L155 HydrophobicContact SD-CD2 4.37Å; F153-L155 HydrophobicContact CB-CD1 4.21Å; L155-Y167 HydrophobicContact CB-CD1 3.88Å; L155-Y167 HydrophobicContact CB-CG 4.32Å; L155-Y167 HydrophobicContact CD2-CD1 4.07Å; L155-Y167 HydrophobicContact CD2-CD2 4.34Å; L155-Y167 HydrophobicContact CD2-CE1 4.3Å; L155-Y167 HydrophobicContact CD2-CG 4.1Å; L155-Y167 HydrophobicContact CG-CD1 4.44Å; L155-Y167 HydrophobicContact CG-CG 4.48Å; L155-V169 HydrophobicContact CG-CG1 4.1Å |
| 156 | E | 92.5 | Very high | 85 | Confident | 92 Ų | 92 | 75.2 Ų | 75.2 | 43% | 0.43 | 38% | 0.381 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.4 | 121.3 | 170.8 | 178 | -173.8 | 169.9 | 0 | 0 | 107.8 | L158 Y167 R168 | E156-L158 PolarHBondContact O-N 3.26Å; E156-Y167 CarbonylContact O-C 3.58Å; E156-Y167 VanDerWaalsContact O-CA 3.28Å; E156-Y167 WeakPolarHBondContact O-CA 3.37Å; E156-R168 HydrophobicContact CB-CB 4.23Å; E156-R168 PolarHBondContact N-O 3.18Å; E156-R168 PolarHBondContact O-N 3.43Å; E156-R168 IonicContact OE1-NH1 3.83Å; E156-R168 WeakPolarHBondContact OE2-CD 3.19Å; E156-R168 IonicContact OE2-CZ 3.54Å; E156-R168 IonicContact OE2-NE 3.57Å; E156-R168 IonicContact OE2-NH1 2.65Å; E156-R168 PolarHBondContact OE2-NH1 3.11Å |
| 157 | P | 89.1 | Confident | 85.3 | Confident | 103 Ų | 103 | 70.4 Ų | 70.4 | 67% | 0.669 | 36% | 0.363 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -66.1 | 132.3 | -176.6 | 27.1 | -33.6 | 0 | 0 | 0 | 111.1 | Y167 | P157-Y167 HydrophobicContact CB-CD1 4.2Å; P157-Y167 HydrophobicContact CB-CE1 4.08Å |
| 158 | L | 80.9 | Confident | 85.5 | Confident | 81 Ų | 81 | 70 Ų | 70 | 42% | 0.424 | 36% | 0.357 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.9 | -35.9 | 174.6 | -73 | 177.4 | 0 | 0 | 0 | 112.6 | E156 V166 R168 V179 Y226 | E156-L158 PolarHBondContact O-N 3.26Å; L158-V166 HydrophobicContact CB-CG1 4.28Å; L158-V166 WeakPolarHBondContact CB-O 3.42Å; L158-V166 HydrophobicContact CD1-CG1 4.32Å; L158-V166 PolarHBondContact N-O 3.16Å; L158-R168 HydrophobicContact CD1-CB 3.75Å; L158-R168 HydrophobicContact CD2-CB 3.9Å; L158-R168 HydrophobicContact CG-CB 3.7Å; L158-V179 HydrophobicContact CD1-CG1 4.5Å; L158-V179 HydrophobicContact CD1-CG2 4.15Å; L158-Y226 HydrophobicContact CD1-CE2 4.23Å |
| 159 | G | 77 | Confident | 85.8 | Confident | 39 Ų | 39 | 68.7 Ų | 68.7 | 40% | 0.402 | 35% | 0.351 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -176.9 | 162.8 | -177.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | V166 | G159-V166 PolarHBondContact N-O 2.68Å; G159-V166 PolarHBondContact O-N 3.27Å |
| 160 | E | 77.7 | Confident | 86.2 | Confident | 146 Ų | 146 | 66.9 Ų | 66.9 | 68% | 0.682 | 35% | 0.345 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -132.9 | 128.6 | -177.9 | -175.3 | 178.3 | 175.6 | 0 | 0 | 109.2 | E165 K184 | E160-E165 HydrophobicContact CG-CG 4.33Å; E160-K184 IonicContact OE1-NZ 2.87Å; E160-K184 PolarHBondContact OE1-NZ 3.14Å |
| 161 | G | 70.9 | Confident | 86.5 | Confident | 33 Ų | 33 | 66.5 Ų | 66.5 | 34% | 0.34 | 34% | 0.342 | S | S | . | . | trans | -115.1 | 179.8 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | S164 K184 | G161-S164 WeakPolarHBondContact CA-O 3.25Å; G161-S164 PolarHBondContact N-O 3.19Å; G161-K184 PolarHBondContact O-NZ 3.05Å | ||
| 162 | F | 74.2 | Confident | 86.7 | Confident | 173 Ų | 173 | 68.3 Ų | 68.3 | 76% | 0.759 | 34% | 0.344 | S | S | * | . | S | Bend | trans | -63.7 | -43.4 | 179.7 | -172.5 | -96.1 | 0 | 0 | 0 | 112.3 | ||
| 163 | F | 73.9 | Confident | 86.8 | Confident | 82 Ų | 82 | 71.8 Ų | 71.8 | 36% | 0.36 | 37% | 0.367 | S | S | . | . | S | Bend | trans | -100.3 | -13.5 | -176.3 | -61.6 | -71 | 0 | 0 | 0 | 114.6 | F12 N183 K184 | F12-F163 HydrophobicContact CE1-CD2 4.43Å; F12-F163 HydrophobicContact CE1-CE2 4.29Å; F12-F163 HydrophobicContact CE2-CE2 4.49Å; F12-F163 HydrophobicContact CZ-CD2 4.35Å; F12-F163 AromaticContact CZ-CE2 3.93Å; F12-F163 HydrophobicContact CZ-CE2 3.93Å; F163-N183 PolarHBondContact O-OD1 2.89Å; F163-K184 PolarHBondContact O-N 3.33Å |
| 164 | S | 80.5 | Confident | 86.7 | Confident | 20 Ų | 20 | 75.5 Ų | 75.5 | 14% | 0.14 | 39% | 0.39 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -149.9 | 153.5 | -172.7 | 58.2 | 0 | 0 | 0 | 0 | 113.6 | G161 L182 | G161-S164 WeakPolarHBondContact CA-O 3.25Å; G161-S164 PolarHBondContact N-O 3.19Å; S164-L182 CarbonylContact C-O 2.93Å; S164-L182 WeakPolarHBondContact CA-O 3.39Å; S164-L182 WeakPolarHBondContact CB-O 3.15Å |
| 165 | E | 83.9 | Confident | 86.7 | Confident | 53 Ų | 53 | 74.8 Ų | 74.8 | 25% | 0.248 | 39% | 0.39 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.8 | 143.2 | 165.7 | -57.9 | 178.4 | 127.4 | 0 | 0 | 108.6 | E160 Y167 L182 K184 | E160-E165 HydrophobicContact CG-CG 4.33Å; E165-Y167 HydrophobicContact CB-CD2 4.32Å; E165-Y167 HydrophobicContact CB-CE2 3.53Å; E165-Y167 PolarHBondContact OE2-OH 3.27Å; E165-L182 HydrophobicContact CB-CB 4.37Å; E165-L182 PolarHBondContact N-O 3.35Å; E165-L182 PolarHBondContact O-N 3.01Å; E165-K184 HydrophobicContact CG-CD 4.33Å; E165-K184 HydrophobicContact CG-CG 4.17Å |
| 166 | V | 87.2 | Confident | 86.5 | Confident | 42 Ų | 42 | 74.7 Ų | 74.7 | 26% | 0.255 | 39% | 0.39 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.2 | 124.4 | -178.5 | -174.2 | 0 | 0 | 0 | 0 | 108.7 | L158 G159 V179 L180 | L158-V166 HydrophobicContact CB-CG1 4.28Å; L158-V166 WeakPolarHBondContact CB-O 3.42Å; L158-V166 HydrophobicContact CD1-CG1 4.32Å; L158-V166 PolarHBondContact N-O 3.16Å; G159-V166 PolarHBondContact N-O 2.68Å; G159-V166 PolarHBondContact O-N 3.27Å; V166-V179 HydrophobicContact CG1-CG1 3.4Å; V166-V179 VanDerWaalsContact CG1-CG1 3.4Å; V166-L180 WeakPolarHBondContact CA-O 3.31Å |
| 167 | Y | 88.3 | Confident | 86.5 | Confident | 45 Ų | 45 | 73 Ų | 73 | 18% | 0.176 | 38% | 0.383 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.6 | 139.1 | 179.3 | -62.7 | -91.8 | 0 | 0 | 0 | 110.7 | L155 E156 P157 E165 V179 L180 L182 | L155-Y167 HydrophobicContact CB-CD1 3.88Å; L155-Y167 HydrophobicContact CB-CG 4.32Å; L155-Y167 HydrophobicContact CD2-CD1 4.07Å; L155-Y167 HydrophobicContact CD2-CD2 4.34Å; L155-Y167 HydrophobicContact CD2-CE1 4.3Å; L155-Y167 HydrophobicContact CD2-CG 4.1Å; L155-Y167 HydrophobicContact CG-CD1 4.44Å; L155-Y167 HydrophobicContact CG-CG 4.48Å; E156-Y167 CarbonylContact O-C 3.58Å; E156-Y167 VanDerWaalsContact O-CA 3.28Å; E156-Y167 WeakPolarHBondContact O-CA 3.37Å; P157-Y167 HydrophobicContact CB-CD1 4.2Å; P157-Y167 HydrophobicContact CB-CE1 4.08Å; E165-Y167 HydrophobicContact CB-CD2 4.32Å; E165-Y167 HydrophobicContact CB-CE2 3.53Å; E165-Y167 PolarHBondContact OE2-OH 3.27Å; Y167-V179 CarbonylContact O-C 3.48Å; Y167-V179 WeakPolarHBondContact O-CA 3.01Å; Y167-L180 PolarHBondContact N-O 2.83Å; Y167-L180 PolarHBondContact O-N 3.38Å; Y167-L182 HydrophobicContact CD2-CB 4.44Å; Y167-L182 HydrophobicContact CE2-CB 4.26Å; Y167-L182 HydrophobicContact CE2-CD1 4.28Å |
| 168 | R | 90.2 | Very high | 86.6 | Confident | 62 Ų | 62 | 68.5 Ų | 68.5 | 23% | 0.234 | 35% | 0.353 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.3 | 127.4 | 156.6 | 177.2 | 175.9 | 170.6 | -136.4 | -1.5 | 106.3 | E156 L158 I177 Y226 | E156-R168 HydrophobicContact CB-CB 4.23Å; E156-R168 PolarHBondContact N-O 3.18Å; E156-R168 PolarHBondContact O-N 3.43Å; E156-R168 IonicContact OE1-NH1 3.83Å; E156-R168 WeakPolarHBondContact OE2-CD 3.19Å; E156-R168 IonicContact OE2-CZ 3.54Å; E156-R168 IonicContact OE2-NE 3.57Å; E156-R168 IonicContact OE2-NH1 2.65Å; E156-R168 PolarHBondContact OE2-NH1 3.11Å; L158-R168 HydrophobicContact CD1-CB 3.75Å; L158-R168 HydrophobicContact CD2-CB 3.9Å; L158-R168 HydrophobicContact CG-CB 3.7Å; R168-I177 HydrophobicContact CG-CG2 3.95Å; R168-Y226 HydrophobicContact CB-CE2 4.38Å; R168-Y226 HydrophobicContact CG-CD2 4.17Å; R168-Y226 HydrophobicContact CG-CE2 4.04Å |
| 169 | V | 93.7 | Very high | 87 | Confident | 0 Ų | 0 | 65.9 Ų | 65.9 | 0% | 0 | 34% | 0.34 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.5 | 141.1 | -179.7 | -59 | 0 | 0 | 0 | 0 | 110.6 | F153 S154 L155 I177 L178 L180 L223 | F153-V169 HydrophobicContact CB-CB 4.01Å; F153-V169 HydrophobicContact CB-CG1 4.38Å; F153-V169 HydrophobicContact CD1-CB 3.8Å; F153-V169 HydrophobicContact CD1-CG2 3.65Å; F153-V169 HydrophobicContact CE1-CG2 3.97Å; F153-V169 HydrophobicContact CG-CB 4.05Å; F153-V169 HydrophobicContact CG-CG2 4.19Å; S154-V169 WeakPolarHBondContact O-CA 3.36Å; L155-V169 HydrophobicContact CG-CG1 4.1Å; V169-I177 WeakPolarHBondContact O-CA 3.06Å; V169-L178 HydrophobicContact CG2-CB 3.71Å; V169-L178 PolarHBondContact N-O 3.03Å; V169-L178 PolarHBondContact O-N 3.19Å; V169-L180 HydrophobicContact CG1-CB 3.63Å; V169-L180 HydrophobicContact CG1-CD2 4.12Å; V169-L180 HydrophobicContact CG2-CB 4.23Å; V169-L223 HydrophobicContact CG2-CD2 3.78Å |
| 170 | R | 96.3 | Very high | 87.6 | Confident | 109 Ų | 109 | 64 Ų | 64 | 41% | 0.411 | 32% | 0.321 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.1 | 122.3 | 168.8 | 179.6 | -175.5 | -60.3 | -77.4 | 5 | 108.9 | F153 S154 R172 G175 D176 | F153-R170 WeakPolarHBondContact CA-O 3.45Å; S154-R170 PolarHBondContact N-O 3.16Å; S154-R170 PolarHBondContact O-N 3.06Å; S154-R170 WeakPolarHBondContact OG-CB 3.21Å; R170-R172 PolarHBondContact O-N 3.31Å; R170-G175 PolarHBondContact NH1-O 3.02Å; R170-D176 CarbonylContact C-O 3.51Å; R170-D176 WeakPolarHBondContact CA-O 3.35Å |
| 171 | H | 94.6 | Very high | 88.1 | Confident | 16 Ų | 16 | 59.6 Ų | 59.6 | 7% | 0.074 | 30% | 0.3 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.3 | 122.4 | 174.1 | -173.6 | -127.4 | 0 | 0 | 0 | 109.5 | Y148 F153 V173 T174 G175 D176 | Y148-H171 AromaticContact CD1-CD2 3.98Å; Y148-H171 AromaticContact CD1-NE2 3.75Å; Y148-H171 AromaticContact CE1-NE2 3.73Å; F153-H171 HydrophobicContact CD1-CB 4.07Å; F153-H171 HydrophobicContact CE1-CB 3.74Å; F153-H171 AromaticContact CE1-CD2 3.86Å; H171-V173 VanDerWaalsContact C-N 3.27Å; H171-V173 PolarHBondContact O-N 3.1Å; H171-T174 WeakPolarHBondContact ND1-CB 3.45Å; H171-T174 WeakPolarHBondContact ND1-CG2 3.49Å; H171-T174 PolarHBondContact ND1-N 3.26Å; H171-T174 PolarHBondContact ND1-OG1 2.97Å; H171-G175 VanDerWaalsContact O-CA 3.26Å; H171-G175 WeakPolarHBondContact O-CA 3.32Å; H171-G175 PolarHBondContact O-N 3.49Å; H171-D176 HydrophobicContact CB-CB 4.37Å; H171-D176 PolarHBondContact N-O 3.33Å |
| 172 | R | 94.2 | Very high | 88.9 | Confident | 163 Ų | 163 | 59.4 Ų | 59.4 | 62% | 0.615 | 29% | 0.291 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.5 | -31.2 | -171.2 | -68.1 | 174.1 | -170.1 | -77.5 | -3.5 | 113.2 | E151 D152 F153 R170 | E151-R172 WeakPolarHBondContact O-CD 3.44Å; E151-R172 PolarHBondContact O-NE 3.49Å; D152-R172 WeakPolarHBondContact O-CB 3.2Å; D152-R172 VanDerWaalsContact O-CG 3.3Å; D152-R172 WeakPolarHBondContact O-CG 3.45Å; D152-R172 PolarHBondContact O-N 3.28Å; F153-R172 PolarHBondContact O-NE 3.32Å; F153-R172 PolarHBondContact O-NH2 3.34Å; R170-R172 PolarHBondContact O-N 3.31Å |
| 173 | V | 92.4 | Very high | 89.4 | Confident | 125 Ų | 125 | 51.9 Ų | 51.9 | 76% | 0.758 | 26% | 0.258 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.9 | -48.7 | -176.5 | -178.8 | 0 | 0 | 0 | 0 | 112 | H171 | H171-V173 VanDerWaalsContact C-N 3.27Å; H171-V173 PolarHBondContact O-N 3.1Å |
| 174 | T | 93.2 | Very high | 89.8 | Confident | 79 Ų | 79 | 51.4 Ų | 51.4 | 49% | 0.485 | 26% | 0.256 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.4 | -17.5 | -175.4 | 63.1 | 0 | 0 | 0 | 0 | 113.3 | H171 D176 | H171-T174 WeakPolarHBondContact ND1-CB 3.45Å; H171-T174 WeakPolarHBondContact ND1-CG2 3.49Å; H171-T174 PolarHBondContact ND1-N 3.26Å; H171-T174 PolarHBondContact ND1-OG1 2.97Å; T174-D176 WeakPolarHBondContact CB-OD2 3.45Å; T174-D176 PolarHBondContact O-N 2.92Å; T174-D176 WeakPolarHBondContact OG1-CB 3.37Å; T174-D176 PolarHBondContact OG1-N 2.82Å; T174-D176 PolarHBondContact OG1-OD2 3.08Å |
| 175 | G | 94 | Very high | 89.7 | Confident | 32 Ų | 32 | 53 Ų | 53 | 33% | 0.33 | 27% | 0.265 | S | S | . | . | trans | 77.2 | -2.8 | -173.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | R170 H171 | R170-G175 PolarHBondContact NH1-O 3.02Å; H171-G175 VanDerWaalsContact O-CA 3.26Å; H171-G175 WeakPolarHBondContact O-CA 3.32Å; H171-G175 PolarHBondContact O-N 3.49Å | ||
| 176 | D | 92 | Very high | 89.2 | Confident | 73 Ų | 73 | 54.4 Ų | 54.4 | 39% | 0.39 | 28% | 0.281 | S | S | . | . | trans | -58 | 137.1 | -178.3 | -66.1 | -33.4 | 0 | 0 | 0 | 111.4 | R170 H171 T174 | R170-D176 CarbonylContact C-O 3.51Å; R170-D176 WeakPolarHBondContact CA-O 3.35Å; H171-D176 HydrophobicContact CB-CB 4.37Å; H171-D176 PolarHBondContact N-O 3.33Å; T174-D176 WeakPolarHBondContact CB-OD2 3.45Å; T174-D176 PolarHBondContact O-N 2.92Å; T174-D176 WeakPolarHBondContact OG1-CB 3.37Å; T174-D176 PolarHBondContact OG1-N 2.82Å; T174-D176 PolarHBondContact OG1-OD2 3.08Å | ||
| 177 | I | 92 | Very high | 88.7 | Confident | 56 Ų | 56 | 57.2 Ų | 57.2 | 29% | 0.287 | 30% | 0.302 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.5 | 126 | 174 | -53.4 | -179.6 | 0 | 0 | 0 | 108.4 | R168 V169 Y226 | R168-I177 HydrophobicContact CG-CG2 3.95Å; V169-I177 WeakPolarHBondContact O-CA 3.06Å; I177-Y226 HydrophobicContact CG2-CD1 3.86Å; I177-Y226 HydrophobicContact CG2-CD2 4.28Å; I177-Y226 HydrophobicContact CG2-CG 3.72Å |
| 178 | L | 90.7 | Very high | 88 | Confident | 10 Ų | 10 | 57 Ų | 57 | 5% | 0.052 | 30% | 0.304 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.9 | 171.6 | -176.5 | -56.9 | 173.6 | 0 | 0 | 0 | 110.2 | F153 V169 R211 L223 T224 | F153-L178 HydrophobicContact CE1-CD1 4.05Å; F153-L178 HydrophobicContact CZ-CD1 4.43Å; V169-L178 HydrophobicContact CG2-CB 3.71Å; V169-L178 PolarHBondContact N-O 3.03Å; V169-L178 PolarHBondContact O-N 3.19Å; L178-R211 HydrophobicContact CD2-CB 3.98Å; L178-R211 HydrophobicContact CD2-CG 3.76Å; L178-L223 HydrophobicContact CB-CD2 4.26Å; L178-L223 HydrophobicContact CD1-CD2 4.24Å; L178-T224 WeakPolarHBondContact CA-O 3.39Å; L178-T224 WeakPolarHBondContact CB-O 3.1Å |
| 179 | V | 90.1 | Very high | 87.2 | Confident | 25 Ų | 25 | 56.9 Ų | 56.9 | 15% | 0.152 | 30% | 0.303 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.6 | 125.3 | 167.6 | 176.9 | 0 | 0 | 0 | 0 | 109.3 | L158 V166 Y167 L223 T224 Y226 | L158-V179 HydrophobicContact CD1-CG1 4.5Å; L158-V179 HydrophobicContact CD1-CG2 4.15Å; V166-V179 HydrophobicContact CG1-CG1 3.4Å; V166-V179 VanDerWaalsContact CG1-CG1 3.4Å; Y167-V179 CarbonylContact O-C 3.48Å; Y167-V179 WeakPolarHBondContact O-CA 3.01Å; V179-L223 WeakPolarHBondContact O-CA 3.38Å; V179-T224 PolarHBondContact N-O 2.77Å; V179-T224 PolarHBondContact O-N 2.7Å; V179-Y226 HydrophobicContact CG2-CD2 3.65Å; V179-Y226 HydrophobicContact CG2-CG 4.42Å |
| 180 | L | 89.9 | Confident | 86.2 | Confident | 0 Ų | 0 | 60.3 Ų | 60.3 | 0% | 0 | 33% | 0.327 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.1 | 120.9 | 173.4 | 176 | 70.1 | 0 | 0 | 0 | 109.8 | M150 V166 Y167 V169 C214 H221 A222 L223 | M150-L180 HydrophobicContact CE-CD2 3.36Å; M150-L180 HydrophobicContact SD-CD2 3.44Å; M150-L180 WeakPolarHBondContact SD-CD2 3.3Å; V166-L180 WeakPolarHBondContact CA-O 3.31Å; Y167-L180 PolarHBondContact N-O 2.83Å; Y167-L180 PolarHBondContact O-N 3.38Å; V169-L180 HydrophobicContact CG1-CB 3.63Å; V169-L180 HydrophobicContact CG1-CD2 4.12Å; V169-L180 HydrophobicContact CG2-CB 4.23Å; L180-C214 HydrophobicContact CD1-CB 3.86Å; L180-H221 HydrophobicContact CD1-CB 3.62Å; L180-A222 WeakPolarHBondContact CA-O 3.34Å; L180-L223 HydrophobicContact CB-CD2 3.87Å; L180-L223 HydrophobicContact CD1-CD2 3.8Å; L180-L223 HydrophobicContact CD1-CG 4.06Å; L180-L223 HydrophobicContact CG-CD2 4.44Å |
| 181 | K | 88.2 | Confident | 85.2 | Confident | 54 Ų | 54 | 58.6 Ų | 58.6 | 24% | 0.235 | 33% | 0.326 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.4 | 99.6 | 168 | -173.4 | 177.4 | 179.1 | -177.2 | 0 | 108.5 | E195 H221 A222 | K181-E195 IonicContact NZ-OE1 2.68Å; K181-E195 PolarHBondContact NZ-OE1 3.22Å; K181-E195 IonicContact NZ-OE2 3.48Å; K181-H221 WeakPolarHBondContact O-CA 3.45Å; K181-H221 WeakPolarHBondContact O-CB 3.23Å; K181-A222 HydrophobicContact CB-CB 4.47Å; K181-A222 PolarHBondContact N-O 3.44Å; K181-A222 PolarHBondContact O-N 2.91Å |
| 182 | L | 87.7 | Confident | 84.2 | Confident | 29 Ų | 29 | 58.5 Ų | 58.5 | 15% | 0.152 | 33% | 0.327 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84 | 123.4 | 177.7 | -171.7 | 151.8 | 0 | 0 | 0 | 108.8 | S164 E165 Y167 | S164-L182 CarbonylContact C-O 2.93Å; S164-L182 WeakPolarHBondContact CA-O 3.39Å; S164-L182 WeakPolarHBondContact CB-O 3.15Å; E165-L182 HydrophobicContact CB-CB 4.37Å; E165-L182 PolarHBondContact N-O 3.35Å; E165-L182 PolarHBondContact O-N 3.01Å; Y167-L182 HydrophobicContact CD2-CB 4.44Å; Y167-L182 HydrophobicContact CE2-CB 4.26Å; Y167-L182 HydrophobicContact CE2-CD1 4.28Å |
| 183 | N | 84.4 | Confident | 83.4 | Confident | 14 Ų | 14 | 52.5 Ų | 52.5 | 8% | 0.075 | 31% | 0.307 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.4 | 129 | 177.4 | 178.1 | 12.2 | 0 | 0 | 0 | 109 | F163 V185 V192 Q219 H221 | F163-N183 PolarHBondContact O-OD1 2.89Å; N183-V185 PolarHBondContact ND2-O 3.29Å; N183-V185 PolarHBondContact OD1-N 3.32Å; N183-V185 PolarHBondContact OD1-O 3Å; N183-V192 HydrophobicContact CB-CG2 4.16Å; N183-V192 VanDerWaalsContact ND2-CG2 3.26Å; N183-V192 WeakPolarHBondContact ND2-CG2 3.09Å; N183-Q219 PolarHBondContact O-OE1 2.87Å; N183-Q219 VanDerWaalsContact O-OE1 3.1Å; N183-H221 PolarHBondContact N-ND1 3.34Å; N183-H221 VanDerWaalsContact N-ND1 3.15Å |
| 184 | K | 82.6 | Confident | 82.6 | Confident | 73 Ų | 73 | 52.2 Ų | 52.2 | 32% | 0.317 | 29% | 0.292 | S | S | . | . | S | Bend | trans | -77.8 | -27.6 | 179.5 | -67.3 | 177.1 | 173 | -179.5 | 0 | 112.7 | E160 G161 F163 E165 | E160-K184 IonicContact OE1-NZ 2.87Å; E160-K184 PolarHBondContact OE1-NZ 3.14Å; G161-K184 PolarHBondContact O-NZ 3.05Å; F163-K184 PolarHBondContact O-N 3.33Å; E165-K184 HydrophobicContact CG-CD 4.33Å; E165-K184 HydrophobicContact CG-CG 4.17Å |
| 185 | V | 77.9 | Confident | 81.7 | Confident | 54 Ų | 54 | 49.9 Ų | 49.9 | 33% | 0.327 | 28% | 0.276 | S | S | . | . | trans | -116.4 | 113.4 | -165.8 | -172.6 | 0 | 0 | 0 | 0 | 111.1 | N183 S187 N188 | N183-V185 PolarHBondContact ND2-O 3.29Å; N183-V185 PolarHBondContact OD1-N 3.32Å; N183-V185 PolarHBondContact OD1-O 3Å; V185-S187 VanDerWaalsContact C-N 3.28Å; V185-S187 WeakPolarHBondContact CG1-OG 3.46Å; V185-S187 PolarHBondContact O-N 3.18Å; V185-N188 HydrophobicContact CB-CB 4.47Å; V185-N188 WeakPolarHBondContact O-CB 3.39Å; V185-N188 PolarHBondContact O-N 2.96Å; V185-N188 VanDerWaalsContact O-N 3.13Å | ||
| 186 | S | 74.7 | Confident | 80.9 | Confident | 81 Ų | 81 | 48.5 Ų | 48.5 | 57% | 0.566 | 26% | 0.261 | S | S | * | . | G | 310 helix | trans | -61.8 | -31.9 | 179.3 | 58.6 | 0 | 0 | 0 | 0 | 113.5 | N188 R189 | S186-N188 PolarHBondContact O-N 3.37Å; S186-R189 WeakPolarHBondContact O-CB 3.23Å; S186-R189 PolarHBondContact O-N 3.11Å |
| 187 | S | 75.6 | Confident | 80.3 | Confident | 101 Ų | 101 | 47.6 Ų | 47.6 | 71% | 0.706 | 26% | 0.255 | S | S | * | . | G | 310 helix | trans | -66.5 | -17.5 | 178.3 | 63.6 | 0 | 0 | 0 | 0 | 113.2 | V185 R189 | V185-S187 VanDerWaalsContact C-N 3.28Å; V185-S187 WeakPolarHBondContact CG1-OG 3.46Å; V185-S187 PolarHBondContact O-N 3.18Å; S187-R189 PolarHBondContact O-N 3.3Å |
| 188 | N | 73.5 | Confident | 79.6 | Confident | 40 Ų | 40 | 46.2 Ų | 46.2 | 21% | 0.214 | 25% | 0.248 | C | C | . | . | G | 310 helix | trans | -83.4 | 11.4 | 178.8 | -154.9 | 21.3 | 0 | 0 | 0 | 113.5 | V185 S186 S190 N191 V192 | V185-N188 HydrophobicContact CB-CB 4.47Å; V185-N188 WeakPolarHBondContact O-CB 3.39Å; V185-N188 PolarHBondContact O-N 2.96Å; V185-N188 VanDerWaalsContact O-N 3.13Å; S186-N188 PolarHBondContact O-N 3.37Å; N188-S190 VanDerWaalsContact C-N 3.35Å; N188-S190 PolarHBondContact O-N 3.06Å; N188-N191 PolarHBondContact O-N 3.22Å; N188-N191 VanDerWaalsContact OD1-CB 3.25Å; N188-N191 WeakPolarHBondContact OD1-CB 3.3Å; N188-N191 PolarHBondContact OD1-ND2 2.91Å; N188-V192 PolarHBondContact O-N 2.99Å; N188-V192 VanDerWaalsContact O-N 3.07Å |
| 189 | R | 72.6 | Confident | 79 | Confident | 60 Ų | 60 | 46.4 Ų | 46.4 | 23% | 0.226 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -53.9 | -43.7 | -173.6 | -176.8 | -176.9 | 174.7 | 74 | 19.2 | 114.1 | S186 S187 N191 V192 L193 G218 | S186-R189 WeakPolarHBondContact O-CB 3.23Å; S186-R189 PolarHBondContact O-N 3.11Å; S187-R189 PolarHBondContact O-N 3.3Å; R189-N191 VanDerWaalsContact C-N 3.35Å; R189-V192 PolarHBondContact O-N 3.05Å; R189-L193 HydrophobicContact CG-CD1 4.15Å; R189-L193 WeakPolarHBondContact O-CG 3.09Å; R189-L193 PolarHBondContact O-N 3.29Å; R189-G218 PolarHBondContact NH1-O 3.47Å |
| 190 | S | 74.6 | Confident | 78.6 | Confident | 72 Ų | 72 | 49.4 Ų | 49.4 | 50% | 0.503 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -65.3 | -38.4 | -178.2 | 53.8 | 0 | 0 | 0 | 0 | 112.3 | N188 R194 | N188-S190 VanDerWaalsContact C-N 3.35Å; N188-S190 PolarHBondContact O-N 3.06Å; S190-R194 PolarHBondContact O-N 2.92Å; S190-R194 VanDerWaalsContact O-N 3.09Å |
| 191 | N | 74.3 | Confident | 78.3 | Confident | 73 Ų | 73 | 54.1 Ų | 54.1 | 39% | 0.39 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -69.9 | -42.4 | 176.7 | -67.3 | -28.2 | 0 | 0 | 0 | 111.1 | N188 R189 L193 R194 E195 | N188-N191 PolarHBondContact O-N 3.22Å; N188-N191 VanDerWaalsContact OD1-CB 3.25Å; N188-N191 WeakPolarHBondContact OD1-CB 3.3Å; N188-N191 PolarHBondContact OD1-ND2 2.91Å; R189-N191 VanDerWaalsContact C-N 3.35Å; N191-L193 VanDerWaalsContact C-N 3.34Å; N191-L193 PolarHBondContact O-N 3.44Å; N191-R194 WeakPolarHBondContact O-CB 3.29Å; N191-R194 PolarHBondContact O-N 3.39Å; N191-E195 WeakPolarHBondContact O-CB 2.9Å; N191-E195 PolarHBondContact O-N 3.37Å |
| 192 | V | 74.4 | Confident | 77.9 | Confident | 14 Ų | 14 | 52.3 Ų | 52.3 | 9% | 0.085 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -61.1 | -42.1 | 175.2 | 173.8 | 0 | 0 | 0 | 0 | 111.8 | N183 N188 R189 R194 E195 V196 L220 | N183-V192 HydrophobicContact CB-CG2 4.16Å; N183-V192 VanDerWaalsContact ND2-CG2 3.26Å; N183-V192 WeakPolarHBondContact ND2-CG2 3.09Å; N188-V192 PolarHBondContact O-N 2.99Å; N188-V192 VanDerWaalsContact O-N 3.07Å; R189-V192 PolarHBondContact O-N 3.05Å; V192-R194 VanDerWaalsContact C-N 3.32Å; V192-R194 PolarHBondContact O-N 3.11Å; V192-E195 WeakPolarHBondContact O-CB 3.23Å; V192-E195 PolarHBondContact O-N 3.29Å; V192-V196 HydrophobicContact CG1-CG2 4.37Å; V192-V196 WeakPolarHBondContact O-CB 3.25Å; V192-V196 WeakPolarHBondContact O-CG2 3.39Å; V192-V196 PolarHBondContact O-N 3.28Å; V192-L220 HydrophobicContact CG1-CB 4.36Å; V192-L220 WeakPolarHBondContact CG1-O 3.39Å |
| 193 | L | 76.5 | Confident | 77.9 | Confident | 38 Ų | 38 | 60 Ų | 60 | 20% | 0.199 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -62.4 | -40.9 | 176.2 | -73.7 | 169.8 | 0 | 0 | 0 | 111.8 | I110 R189 N191 E197 L220 | I110-L193 HydrophobicContact CD1-CD1 4.22Å; I110-L193 HydrophobicContact CD1-CD2 4.38Å; R189-L193 HydrophobicContact CG-CD1 4.15Å; R189-L193 WeakPolarHBondContact O-CG 3.09Å; R189-L193 PolarHBondContact O-N 3.29Å; N191-L193 VanDerWaalsContact C-N 3.34Å; N191-L193 PolarHBondContact O-N 3.44Å; L193-E197 WeakPolarHBondContact O-CB 2.93Å; L193-E197 PolarHBondContact O-N 3.28Å; L193-L220 HydrophobicContact CD2-CD2 3.72Å |
| 194 | R | 75.3 | Confident | 77.8 | Confident | 118 Ų | 118 | 61.7 Ų | 61.7 | 45% | 0.445 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -64.1 | -42.9 | 175.2 | -172.2 | -177.8 | -66 | 155.2 | 0.2 | 111.3 | S190 N191 V192 E197 L198 | S190-R194 PolarHBondContact O-N 2.92Å; S190-R194 VanDerWaalsContact O-N 3.09Å; N191-R194 WeakPolarHBondContact O-CB 3.29Å; N191-R194 PolarHBondContact O-N 3.39Å; V192-R194 VanDerWaalsContact C-N 3.32Å; V192-R194 PolarHBondContact O-N 3.11Å; R194-E197 PolarHBondContact O-N 3.38Å; R194-L198 HydrophobicContact CG-CD1 4.17Å; R194-L198 WeakPolarHBondContact O-CB 3.35Å; R194-L198 VanDerWaalsContact O-CG 3.23Å; R194-L198 WeakPolarHBondContact O-CG 3.36Å; R194-L198 PolarHBondContact O-N 2.79Å |
| 195 | E | 74.4 | Confident | 77.9 | Confident | 30 Ų | 30 | 61.2 Ų | 61.2 | 14% | 0.14 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -60.4 | -49.2 | 177 | -166.6 | -177.7 | 156.9 | 0 | 0 | 111 | F15 K181 N191 V192 E197 L198 M199 | F15-E195 HydrophobicContact CE1-CG 3.99Å; F15-E195 HydrophobicContact CZ-CG 3.89Å; K181-E195 IonicContact NZ-OE1 2.68Å; K181-E195 PolarHBondContact NZ-OE1 3.22Å; K181-E195 IonicContact NZ-OE2 3.48Å; N191-E195 WeakPolarHBondContact O-CB 2.9Å; N191-E195 PolarHBondContact O-N 3.37Å; V192-E195 WeakPolarHBondContact O-CB 3.23Å; V192-E195 PolarHBondContact O-N 3.29Å; E195-E197 PolarHBondContact O-N 3.36Å; E195-L198 PolarHBondContact O-N 3.05Å; E195-M199 HydrophobicContact CG-CE 3.92Å; E195-M199 HydrophobicContact CG-SD 4.46Å; E195-M199 WeakPolarHBondContact O-CB 3.15Å; E195-M199 VanDerWaalsContact O-CG 3.32Å; E195-M199 WeakPolarHBondContact O-CG 3.23Å; E195-M199 PolarHBondContact O-N 3.36Å |
| 196 | V | 78.6 | Confident | 78.1 | Confident | 3 Ų | 3 | 58.7 Ų | 58.7 | 2% | 0.018 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -59.8 | -44.5 | 176.8 | 164.8 | 0 | 0 | 0 | 0 | 111.8 | V144 V192 L198 M199 R200 F210 L220 A222 | V144-V196 HydrophobicContact CG1-CG1 3.68Å; V192-V196 HydrophobicContact CG1-CG2 4.37Å; V192-V196 WeakPolarHBondContact O-CB 3.25Å; V192-V196 WeakPolarHBondContact O-CG2 3.39Å; V192-V196 PolarHBondContact O-N 3.28Å; V196-L198 VanDerWaalsContact C-N 3.33Å; V196-L198 PolarHBondContact O-N 3.08Å; V196-M199 HydrophobicContact CG2-CE 4.06Å; V196-M199 PolarHBondContact O-N 3.37Å; V196-R200 VanDerWaalsContact O-CB 3.3Å; V196-R200 WeakPolarHBondContact O-CB 3.46Å; V196-R200 PolarHBondContact O-N 3.07Å; V196-F210 HydrophobicContact CB-CZ 4.39Å; V196-F210 HydrophobicContact CG1-CE1 4.08Å; V196-F210 HydrophobicContact CG1-CE2 4.36Å; V196-F210 HydrophobicContact CG1-CZ 3.61Å; V196-F210 HydrophobicContact CG2-CE2 4.32Å; V196-F210 HydrophobicContact CG2-CZ 4.28Å; V196-L220 HydrophobicContact CB-CD2 4.31Å; V196-L220 HydrophobicContact CG1-CD2 4.2Å; V196-L220 HydrophobicContact CG2-CD2 3.95Å; V196-A222 HydrophobicContact CG2-CB 4.28Å |
| 197 | E | 77.4 | Confident | 78.4 | Confident | 55 Ų | 55 | 55 Ų | 55 | 26% | 0.257 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -67 | -34.1 | 179.2 | 179.8 | 57.9 | -165.1 | 0 | 0 | 112.4 | L193 R194 E195 R200 K201 | L193-E197 WeakPolarHBondContact O-CB 2.93Å; L193-E197 PolarHBondContact O-N 3.28Å; R194-E197 PolarHBondContact O-N 3.38Å; E195-E197 PolarHBondContact O-N 3.36Å; E197-R200 IonicContact OE1-CZ 3.71Å; E197-R200 IonicContact OE1-NE 3.79Å; E197-R200 IonicContact OE1-NH2 2.75Å; E197-R200 PolarHBondContact OE1-NH2 3.23Å; E197-R200 IonicContact OE2-CZ 3.65Å; E197-R200 IonicContact OE2-NE 3.7Å; E197-R200 PolarHBondContact OE2-NE 3.35Å; E197-R200 IonicContact OE2-NH2 2.76Å; E197-R200 PolarHBondContact OE2-NH2 2.99Å; E197-K201 WeakPolarHBondContact O-CG 3.4Å; E197-K201 WeakPolarHBondContact OE1-CE 3.32Å; E197-K201 IonicContact OE1-NZ 2.7Å; E197-K201 PolarHBondContact OE1-NZ 3.15Å |
| 198 | L | 77.4 | Confident | 78.7 | Confident | 27 Ų | 27 | 51.8 Ų | 51.8 | 14% | 0.141 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -67.9 | -52.6 | 173 | -73.1 | 169.3 | 0 | 0 | 0 | 110.9 | L11 R194 E195 V196 R200 K201 L202 Y268 | L11-L198 HydrophobicContact CD1-CD1 4.27Å; L11-L198 HydrophobicContact CD2-CD1 3.52Å; R194-L198 HydrophobicContact CG-CD1 4.17Å; R194-L198 WeakPolarHBondContact O-CB 3.35Å; R194-L198 VanDerWaalsContact O-CG 3.23Å; R194-L198 WeakPolarHBondContact O-CG 3.36Å; R194-L198 PolarHBondContact O-N 2.79Å; E195-L198 PolarHBondContact O-N 3.05Å; V196-L198 VanDerWaalsContact C-N 3.33Å; V196-L198 PolarHBondContact O-N 3.08Å; L198-R200 PolarHBondContact O-N 2.8Å; L198-K201 PolarHBondContact O-N 2.75Å; L198-L202 PolarHBondContact O-N 3.36Å; L198-Y268 HydrophobicContact CD2-CD1 3.65Å; L198-Y268 HydrophobicContact CD2-CE1 3.1Å; L198-Y268 HydrophobicContact CD2-CE2 4.4Å; L198-Y268 HydrophobicContact CD2-CG 4.49Å |
| 199 | M | 78.5 | Confident | 79.2 | Confident | 14 Ų | 14 | 54.9 Ų | 54.9 | 7% | 0.069 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -56.9 | -36.9 | 178.7 | -73.6 | -171 | -65.8 | 0 | 0 | 112.3 | F15 E195 V196 K201 L202 F210 A222 T224 | F15-M199 HydrophobicContact CD1-CG 3.72Å; F15-M199 HydrophobicContact CD1-SD 4.31Å; F15-M199 HydrophobicContact CE1-CG 3.49Å; F15-M199 VanDerWaalsContact CE1-CG 3.49Å; F15-M199 HydrophobicContact CE1-SD 3.93Å; E195-M199 HydrophobicContact CG-CE 3.92Å; E195-M199 HydrophobicContact CG-SD 4.46Å; E195-M199 WeakPolarHBondContact O-CB 3.15Å; E195-M199 VanDerWaalsContact O-CG 3.32Å; E195-M199 WeakPolarHBondContact O-CG 3.23Å; E195-M199 PolarHBondContact O-N 3.36Å; V196-M199 HydrophobicContact CG2-CE 4.06Å; V196-M199 PolarHBondContact O-N 3.37Å; M199-K201 VanDerWaalsContact C-N 3.28Å; M199-K201 PolarHBondContact O-N 2.84Å; M199-L202 PolarHBondContact O-N 3.44Å; M199-F210 HydrophobicContact CB-CB 3.94Å; M199-F210 HydrophobicContact CB-CD2 3.9Å; M199-F210 HydrophobicContact CB-CG 3.98Å; M199-F210 HydrophobicContact CE-CD2 3.93Å; M199-F210 HydrophobicContact CE-CE2 3.91Å; M199-F210 HydrophobicContact SD-CD2 4.22Å; M199-A222 HydrophobicContact CE-CB 3.61Å; M199-T224 HydrophobicContact SD-CG2 4.3Å |
| 200 | R | 82.6 | Confident | 79.9 | Confident | 87 Ų | 87 | 52.2 Ų | 52.2 | 33% | 0.328 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -61.3 | -34.2 | 176.3 | -174 | -174.8 | 74.1 | 79.1 | 0.9 | 113.2 | A143 L145 V196 E197 L198 F210 | A143-R200 WeakPolarHBondContact O-CD 3.3Å; L145-R200 HydrophobicContact CD2-CG 4.32Å; L145-R200 HydrophobicContact CG-CG 4.29Å; V196-R200 VanDerWaalsContact O-CB 3.3Å; V196-R200 WeakPolarHBondContact O-CB 3.46Å; V196-R200 PolarHBondContact O-N 3.07Å; E197-R200 IonicContact OE1-CZ 3.71Å; E197-R200 IonicContact OE1-NE 3.79Å; E197-R200 IonicContact OE1-NH2 2.75Å; E197-R200 PolarHBondContact OE1-NH2 3.23Å; E197-R200 IonicContact OE2-CZ 3.65Å; E197-R200 IonicContact OE2-NE 3.7Å; E197-R200 PolarHBondContact OE2-NE 3.35Å; E197-R200 IonicContact OE2-NH2 2.76Å; E197-R200 PolarHBondContact OE2-NH2 2.99Å; L198-R200 PolarHBondContact O-N 2.8Å; R200-F210 HydrophobicContact CB-CD1 4.16Å; R200-F210 HydrophobicContact CB-CE1 4.48Å |
| 201 | K | 82.3 | Confident | 80.6 | Confident | 100 Ų | 100 | 52.5 Ų | 52.5 | 44% | 0.435 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -80.4 | -24.6 | -177.5 | -69.8 | 173.2 | -172.4 | 172.8 | 0 | 112.7 | E197 L198 M199 Y268 | E197-K201 WeakPolarHBondContact O-CG 3.4Å; E197-K201 WeakPolarHBondContact OE1-CE 3.32Å; E197-K201 IonicContact OE1-NZ 2.7Å; E197-K201 PolarHBondContact OE1-NZ 3.15Å; L198-K201 PolarHBondContact O-N 2.75Å; M199-K201 VanDerWaalsContact C-N 3.28Å; M199-K201 PolarHBondContact O-N 2.84Å; K201-Y268 WeakPolarHBondContact CD-OH 3.46Å |
| 202 | L | 81.4 | Confident | 81.3 | Confident | 16 Ų | 16 | 49 Ų | 49 | 8% | 0.084 | 21% | 0.213 | C | C | . | . | trans | -84.2 | 121.6 | -177.1 | -61.1 | 176.8 | 0 | 0 | 0 | 110.4 | L198 M199 V207 Y262 C266 Y268 | L198-L202 PolarHBondContact O-N 3.36Å; M199-L202 PolarHBondContact O-N 3.44Å; L202-V207 HydrophobicContact CB-CG1 3.97Å; L202-V207 HydrophobicContact CD1-CG1 4.23Å; L202-Y262 HydrophobicContact CB-CE1 4.25Å; L202-Y262 HydrophobicContact CD2-CE1 3.89Å; L202-C266 HydrophobicContact CD2-CB 4.34Å; L202-Y268 HydrophobicContact CD2-CD2 3.91Å; L202-Y268 HydrophobicContact CD2-CE2 4.14Å | ||
| 203 | R | 86.4 | Confident | 82 | Confident | 190 Ų | 190 | 48.4 Ų | 48.4 | 72% | 0.717 | 21% | 0.209 | S | C | * | . | trans | -143.2 | 99.4 | 176.6 | -175.4 | 178.4 | 176.2 | -179.1 | -3.6 | 110 | Y262 | R203-Y262 PolarHBondContact N-OH 3.28Å; R203-Y262 PolarHBondContact O-OH 3.31Å | ||
| 204 | H | 83.7 | Confident | 82.4 | Confident | 50 Ų | 50 | 46.6 Ų | 46.6 | 23% | 0.231 | 20% | 0.199 | C | C | . | . | trans | -150.8 | 146.3 | 178.3 | -176.1 | -95.2 | 0 | 0 | 0 | 108.7 | N206 V207 Y262 | H204-N206 PolarHBondContact CE1-OD1 2.87Å; H204-N206 WeakPolarHBondContact ND1-CB 3.44Å; H204-N206 PolarHBondContact ND1-N 3.35Å; H204-N206 PolarHBondContact O-N 3.25Å; H204-V207 HydrophobicContact CB-CB 4.06Å; H204-V207 HydrophobicContact CB-CG2 3.86Å; H204-V207 PolarHBondContact O-N 2.85Å; H204-V207 VanDerWaalsContact O-N 3.14Å; H204-V207 VanDerWaalsContact O-O 3.11Å; H204-Y262 HydrophobicContact CB-CD1 3.38Å; H204-Y262 HydrophobicContact CB-CD2 4.01Å; H204-Y262 HydrophobicContact CB-CE1 3.63Å; H204-Y262 HydrophobicContact CB-CE2 4.24Å; H204-Y262 HydrophobicContact CB-CG 3.57Å; H204-Y262 AromaticContact CD2-CD2 3.76Å; H204-Y262 AromaticContact CD2-CG 3.63Å; H204-Y262 AromaticContact CG-CD1 3.91Å; H204-Y262 AromaticContact CG-CG 3.63Å | ||
| 205 | P | 84 | Confident | 82.8 | Confident | 62 Ų | 62 | 43.6 Ų | 43.6 | 40% | 0.403 | 19% | 0.194 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -51.8 | -46.1 | 176.4 | 18.3 | -31.8 | 0 | 0 | 0 | 111.3 | C19 T21 V207 | C19-P205 VanDerWaalsContact CB-C 3.44Å; C19-P205 HydrophobicContact CB-CB 4.08Å; C19-P205 WeakPolarHBondContact CB-O 3.2Å; C19-P205 PolarHBondContact SG-O 3.45Å; T21-P205 HydrophobicContact CG2-CB 3.87Å; T21-P205 HydrophobicContact CG2-CG 3.82Å; P205-V207 PolarHBondContact O-N 3.46Å |
| 206 | N | 81.6 | Confident | 83.2 | Confident | 1 Ų | 1 | 44.7 Ų | 44.7 | 1% | 0.005 | 20% | 0.201 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -84.9 | 26.4 | -179 | -51.6 | 92.6 | 0 | 0 | 0 | 115.4 | C17 C19 H204 D255 G259 | C17-N206 PolarHBondContact N-O 2.87Å; C17-N206 CarbonylContact O-C 3.57Å; C17-N206 WeakPolarHBondContact O-CA 3.42Å; C19-N206 PolarHBondContact N-ND2 3.21Å; C19-N206 PolarHBondContact O-ND2 3.05Å; H204-N206 PolarHBondContact CE1-OD1 2.87Å; H204-N206 WeakPolarHBondContact ND1-CB 3.44Å; H204-N206 PolarHBondContact ND1-N 3.35Å; H204-N206 PolarHBondContact O-N 3.25Å; N206-D255 WeakPolarHBondContact CB-O 3.36Å; N206-D255 WeakPolarHBondContact ND2-CA 3.35Å; N206-D255 WeakPolarHBondContact ND2-CB 3.33Å; N206-D255 PolarHBondContact ND2-O 2.92Å; N206-G259 WeakPolarHBondContact O-CA 3.34Å |
| 207 | V | 80.6 | Confident | 83.3 | Confident | 3 Ų | 3 | 51.1 Ų | 51.1 | 2% | 0.018 | 24% | 0.235 | C | C | . | . | B | Isolated β-bridge | trans | -137.1 | 133.4 | 177.6 | 177.2 | 0 | 0 | 0 | 0 | 108.3 | F15 L202 H204 P205 R209 Y262 I263 | F15-V207 VanDerWaalsContact O-CG1 3.3Å; F15-V207 WeakPolarHBondContact O-CG1 3.25Å; L202-V207 HydrophobicContact CB-CG1 3.97Å; L202-V207 HydrophobicContact CD1-CG1 4.23Å; H204-V207 HydrophobicContact CB-CB 4.06Å; H204-V207 HydrophobicContact CB-CG2 3.86Å; H204-V207 PolarHBondContact O-N 2.85Å; H204-V207 VanDerWaalsContact O-N 3.14Å; H204-V207 VanDerWaalsContact O-O 3.11Å; P205-V207 PolarHBondContact O-N 3.46Å; V207-R209 PolarHBondContact O-N 2.82Å; V207-R209 VanDerWaalsContact O-N 3.15Å; V207-Y262 HydrophobicContact CG2-CD1 3.9Å; V207-I263 HydrophobicContact CG2-CD1 4.1Å; V207-I263 HydrophobicContact CG2-CG1 4.05Å |
| 208 | L | 82.4 | Confident | 83.2 | Confident | 34 Ų | 34 | 49.8 Ų | 49.8 | 18% | 0.178 | 24% | 0.236 | C | C | . | . | P | Polyproline II helix | trans | -58.7 | 119.6 | -173.9 | -174.6 | 68.3 | 0 | 0 | 0 | 110.4 | F15 C17 F210 T224 E225 C227 | F15-L208 PolarHBondContact O-N 3.24Å; C17-L208 HydrophobicContact CB-CB 4.06Å; C17-L208 HydrophobicContact CB-CD1 4.39Å; L208-F210 PolarHBondContact O-N 3.46Å; L208-T224 HydrophobicContact CD2-CG2 3.92Å; L208-T224 HydrophobicContact CG-CG2 4.28Å; L208-E225 HydrophobicContact CD1-CG 3.73Å; L208-C227 VanDerWaalsContact CD1-SG 3.57Å |
| 209 | R | 84.4 | Confident | 83.3 | Confident | 106 Ų | 106 | 50.6 Ų | 50.6 | 40% | 0.4 | 24% | 0.239 | S | C | . | . | P | Polyproline II helix | trans | -76.6 | 122.7 | -173.9 | -172.9 | 170.2 | 177 | 175.3 | 1.1 | 111.8 | V207 T224 E225 | V207-R209 PolarHBondContact O-N 2.82Å; V207-R209 VanDerWaalsContact O-N 3.15Å; R209-T224 WeakPolarHBondContact O-CA 3.47Å; R209-E225 VanDerWaalsContact CB-CD 3.43Å; R209-E225 HydrophobicContact CB-CG 4.19Å; R209-E225 WeakPolarHBondContact CB-OE1 3.35Å; R209-E225 PolarHBondContact N-OE1 3.23Å; R209-E225 PolarHBondContact O-N 3.19Å |
| 210 | F | 87.3 | Confident | 83.5 | Confident | 4 Ų | 4 | 50.3 Ų | 50.3 | 2% | 0.018 | 24% | 0.238 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -65.7 | 131.5 | 165.5 | -168.2 | -117.6 | 0 | 0 | 0 | 111.2 | V144 L145 V196 M199 R200 L208 G212 A213 A222 L223 | V144-F210 HydrophobicContact CG1-CZ 4.47Å; L145-F210 HydrophobicContact CD1-CD1 4Å; L145-F210 WeakPolarHBondContact CD1-O 3.42Å; L145-F210 HydrophobicContact CG-CD1 4.24Å; V196-F210 HydrophobicContact CB-CZ 4.39Å; V196-F210 HydrophobicContact CG1-CE1 4.08Å; V196-F210 HydrophobicContact CG1-CE2 4.36Å; V196-F210 HydrophobicContact CG1-CZ 3.61Å; V196-F210 HydrophobicContact CG2-CE2 4.32Å; V196-F210 HydrophobicContact CG2-CZ 4.28Å; M199-F210 HydrophobicContact CB-CB 3.94Å; M199-F210 HydrophobicContact CB-CD2 3.9Å; M199-F210 HydrophobicContact CB-CG 3.98Å; M199-F210 HydrophobicContact CE-CD2 3.93Å; M199-F210 HydrophobicContact CE-CE2 3.91Å; M199-F210 HydrophobicContact SD-CD2 4.22Å; R200-F210 HydrophobicContact CB-CD1 4.16Å; R200-F210 HydrophobicContact CB-CE1 4.48Å; L208-F210 PolarHBondContact O-N 3.46Å; F210-G212 WeakPolarHBondContact CE2-O 3.46Å; F210-G212 WeakPolarHBondContact CZ-O 3.36Å; F210-A213 HydrophobicContact CZ-CB 4.42Å; F210-A222 HydrophobicContact CE2-CB 4.11Å; F210-L223 WeakPolarHBondContact CD2-O 3.45Å |
| 211 | R | 88.9 | Confident | 83.7 | Confident | 78 Ų | 78 | 46.4 Ų | 46.4 | 29% | 0.294 | 22% | 0.224 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -111.1 | -25.8 | -177.4 | -64.6 | -68.9 | -178.3 | 154.2 | 2.2 | 112.7 | L178 L223 E225 | L178-R211 HydrophobicContact CD2-CB 3.98Å; L178-R211 HydrophobicContact CD2-CG 3.76Å; R211-L223 PolarHBondContact N-O 3.15Å; R211-E225 HydrophobicContact CG-CB 4.33Å; R211-E225 IonicContact CZ-OE2 3.53Å; R211-E225 IonicContact NE-OE2 2.84Å; R211-E225 IonicContact NH2-OE2 3.36Å; R211-E225 PolarHBondContact NH2-OE2 3.14Å |
| 212 | G | 89.4 | Confident | 83.9 | Confident | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 21% | 0.206 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | 158.7 | -161.7 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.2 | R146 F210 L223 | R146-G212 CarbonylContact O-C 3.47Å; R146-G212 VanDerWaalsContact O-CA 3.23Å; R146-G212 WeakPolarHBondContact O-CA 3.49Å; F210-G212 WeakPolarHBondContact CE2-O 3.46Å; F210-G212 WeakPolarHBondContact CZ-O 3.36Å; G212-L223 PolarHBondContact N-O 3.28Å; G212-L223 WeakPolarHBondContact O-CA 3.44Å; G212-L223 WeakPolarHBondContact O-CB 3.45Å; G212-L223 PolarHBondContact O-N 3.05Å |
| 213 | A | 88.4 | Confident | 84.3 | Confident | 0 Ų | 0 | 41.2 Ų | 41.2 | 0% | 0 | 20% | 0.202 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -135.2 | 151.3 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | V144 R146 L147 Y148 F210 L220 H221 | V144-A213 HydrophobicContact CB-CB 4.28Å; V144-A213 HydrophobicContact CG1-CB 3.72Å; R146-A213 PolarHBondContact O-N 2.91Å; L147-A213 WeakPolarHBondContact CA-O 3.49Å; Y148-A213 PolarHBondContact N-O 3.39Å; F210-A213 HydrophobicContact CZ-CB 4.42Å; A213-L220 HydrophobicContact CB-CD1 3.42Å; A213-L220 VanDerWaalsContact CB-CD1 3.42Å; A213-L220 HydrophobicContact CB-CD2 4.4Å; A213-L220 HydrophobicContact CB-CG 3.86Å; A213-H221 CarbonylContact C-O 3.41Å; A213-H221 WeakPolarHBondContact CA-O 3.37Å; A213-H221 WeakPolarHBondContact CB-O 3.44Å |
| 214 | C | 86.3 | Confident | 84.4 | Confident | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 17% | 0.173 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -99.3 | 137.9 | 168 | -177.2 | 0 | 0 | 0 | 0 | 108.9 | Y148 R149 M150 L180 H221 L223 | Y148-C214 WeakPolarHBondContact O-CA 3.11Å; R149-C214 VanDerWaalsContact C-SG 3.59Å; M150-C214 WeakPolarHBondContact CA-SG 3.44Å; M150-C214 PolarHBondContact N-SG 2.96Å; L180-C214 HydrophobicContact CD1-CB 3.86Å; C214-H221 HydrophobicContact CB-CB 4.25Å; C214-H221 PolarHBondContact N-O 3.25Å; C214-H221 PolarHBondContact O-N 3.46Å; C214-L223 HydrophobicContact CB-CD1 4.23Å |
| 215 | V | 82.1 | Confident | 84.4 | Confident | 55 Ų | 55 | 32 Ų | 32 | 33% | 0.333 | 17% | 0.168 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -109 | 122 | 171.6 | 179.2 | 0 | 0 | 0 | 0 | 108.4 | L147 Y148 Q219 L220 | L147-V215 HydrophobicContact CD2-CG2 3.76Å; Y148-V215 PolarHBondContact O-N 3.39Å; Y148-V215 VanDerWaalsContact O-N 3.12Å; V215-Q219 WeakPolarHBondContact CA-O 3.36Å; V215-L220 HydrophobicContact CG2-CD1 3.72Å |
| 216 | D | 83.1 | Confident | 84.4 | Confident | 53 Ų | 53 | 32 Ų | 32 | 28% | 0.283 | 16% | 0.161 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -140.6 | 136.2 | 176.3 | -173.2 | 49.5 | 0 | 0 | 0 | 110 | M150 G218 Q219 | M150-D216 HydrophobicContact CB-CB 4.11Å; D216-G218 PolarHBondContact O-N 2.84Å; D216-Q219 PolarHBondContact N-O 3.42Å; D216-Q219 VanDerWaalsContact N-O 3.11Å; D216-Q219 WeakPolarHBondContact O-CA 2.92Å; D216-Q219 WeakPolarHBondContact O-CB 2.98Å; D216-Q219 PolarHBondContact O-N 2.76Å |
| 217 | N | 80.3 | Confident | 84.3 | Confident | 138 Ų | 138 | 32.5 Ų | 32.5 | 74% | 0.738 | 16% | 0.164 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 46.1 | 40.9 | 179.7 | -64.5 | -54.2 | 0 | 0 | 0 | 114.4 | Q219 | N217-Q219 PolarHBondContact O-N 3.36Š|
| 218 | G | 75.6 | Confident | 83.9 | Confident | 28 Ų | 28 | 37.8 Ų | 37.8 | 29% | 0.289 | 19% | 0.188 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 73.8 | -1.9 | -178.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | R189 D216 | R189-G218 PolarHBondContact NH1-O 3.47Å; D216-G218 PolarHBondContact O-N 2.84Å |
| 219 | Q | 79.2 | Confident | 83.1 | Confident | 43 Ų | 43 | 37.8 Ų | 37.8 | 20% | 0.201 | 19% | 0.193 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -96.7 | 154.3 | 178.1 | -56.5 | -165.7 | 22.9 | 0 | 0 | 111.8 | N183 V215 D216 N217 | N183-Q219 PolarHBondContact O-OE1 2.87Å; N183-Q219 VanDerWaalsContact O-OE1 3.1Å; V215-Q219 WeakPolarHBondContact CA-O 3.36Å; D216-Q219 PolarHBondContact N-O 3.42Å; D216-Q219 VanDerWaalsContact N-O 3.11Å; D216-Q219 WeakPolarHBondContact O-CA 2.92Å; D216-Q219 WeakPolarHBondContact O-CB 2.98Å; D216-Q219 PolarHBondContact O-N 2.76Å; N217-Q219 PolarHBondContact O-N 3.36Å |
| 220 | L | 82.4 | Confident | 82.4 | Confident | 9 Ų | 9 | 33.7 Ų | 33.7 | 5% | 0.047 | 18% | 0.184 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -103.8 | 134.9 | 175.5 | -166.4 | 70.9 | 0 | 0 | 0 | 108.8 | L140 V144 L147 V192 L193 V196 A213 V215 | L140-L220 HydrophobicContact CD2-CD1 4.29Å; V144-L220 HydrophobicContact CG1-CD2 4.47Å; L147-L220 HydrophobicContact CD2-CD1 4.48Å; V192-L220 HydrophobicContact CG1-CB 4.36Å; V192-L220 WeakPolarHBondContact CG1-O 3.39Å; L193-L220 HydrophobicContact CD2-CD2 3.72Å; V196-L220 HydrophobicContact CB-CD2 4.31Å; V196-L220 HydrophobicContact CG1-CD2 4.2Å; V196-L220 HydrophobicContact CG2-CD2 3.95Å; A213-L220 HydrophobicContact CB-CD1 3.42Å; A213-L220 VanDerWaalsContact CB-CD1 3.42Å; A213-L220 HydrophobicContact CB-CD2 4.4Å; A213-L220 HydrophobicContact CB-CG 3.86Å; V215-L220 HydrophobicContact CG2-CD1 3.72Å |
| 221 | H | 87.1 | Confident | 81.5 | Confident | 5 Ų | 5 | 33.9 Ų | 33.9 | 2% | 0.023 | 19% | 0.187 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -126.9 | 132.9 | 179.4 | -55.1 | -46.9 | 0 | 0 | 0 | 109.2 | L180 K181 N183 A213 C214 | L180-H221 HydrophobicContact CD1-CB 3.62Å; K181-H221 WeakPolarHBondContact O-CA 3.45Å; K181-H221 WeakPolarHBondContact O-CB 3.23Å; N183-H221 PolarHBondContact N-ND1 3.34Å; N183-H221 VanDerWaalsContact N-ND1 3.15Å; A213-H221 CarbonylContact C-O 3.41Å; A213-H221 WeakPolarHBondContact CA-O 3.37Å; A213-H221 WeakPolarHBondContact CB-O 3.44Å; C214-H221 HydrophobicContact CB-CB 4.25Å; C214-H221 PolarHBondContact N-O 3.25Å; C214-H221 PolarHBondContact O-N 3.46Å |
| 222 | A | 87.5 | Confident | 80.7 | Confident | 7 Ų | 7 | 31.3 Ų | 31.3 | 6% | 0.058 | 18% | 0.179 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -81.5 | 137.1 | -173.4 | 0 | 0 | 0 | 0 | 0 | 111.3 | L180 K181 V196 M199 F210 | L180-A222 WeakPolarHBondContact CA-O 3.34Å; K181-A222 HydrophobicContact CB-CB 4.47Å; K181-A222 PolarHBondContact N-O 3.44Å; K181-A222 PolarHBondContact O-N 2.91Å; V196-A222 HydrophobicContact CG2-CB 4.28Å; M199-A222 HydrophobicContact CE-CB 3.61Å; F210-A222 HydrophobicContact CE2-CB 4.11Å |
| 223 | L | 89.7 | Confident | 79.7 | Confident | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 19% | 0.193 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -111.6 | 125.2 | 170.6 | -71.4 | 160.3 | 0 | 0 | 0 | 109.8 | Y148 F153 V169 L178 V179 L180 F210 R211 G212 C214 | Y148-L223 HydrophobicContact CD2-CD1 3.46Å; Y148-L223 VanDerWaalsContact CD2-CD1 3.46Å; Y148-L223 HydrophobicContact CE2-CD1 4.08Å; Y148-L223 HydrophobicContact CG-CD1 4.11Å; F153-L223 HydrophobicContact CE2-CD1 3.9Å; F153-L223 HydrophobicContact CE2-CD2 4.45Å; F153-L223 HydrophobicContact CZ-CD1 3.61Å; F153-L223 HydrophobicContact CZ-CD2 4.14Å; V169-L223 HydrophobicContact CG2-CD2 3.78Å; L178-L223 HydrophobicContact CB-CD2 4.26Å; L178-L223 HydrophobicContact CD1-CD2 4.24Å; V179-L223 WeakPolarHBondContact O-CA 3.38Å; L180-L223 HydrophobicContact CB-CD2 3.87Å; L180-L223 HydrophobicContact CD1-CD2 3.8Å; L180-L223 HydrophobicContact CD1-CG 4.06Å; L180-L223 HydrophobicContact CG-CD2 4.44Å; F210-L223 WeakPolarHBondContact CD2-O 3.45Å; R211-L223 PolarHBondContact N-O 3.15Å; G212-L223 PolarHBondContact N-O 3.28Å; G212-L223 WeakPolarHBondContact O-CA 3.44Å; G212-L223 WeakPolarHBondContact O-CB 3.45Å; G212-L223 PolarHBondContact O-N 3.05Å; C214-L223 HydrophobicContact CB-CD1 4.23Å |
| 224 | T | 87.3 | Confident | 78.9 | Confident | 17 Ų | 17 | 40.9 Ų | 40.9 | 10% | 0.104 | 22% | 0.223 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -121.3 | 169.6 | 176 | 57.2 | 0 | 0 | 0 | 0 | 110.3 | L178 V179 M199 L208 R209 | L178-T224 WeakPolarHBondContact CA-O 3.39Å; L178-T224 WeakPolarHBondContact CB-O 3.1Å; V179-T224 PolarHBondContact N-O 2.77Å; V179-T224 PolarHBondContact O-N 2.7Å; M199-T224 HydrophobicContact SD-CG2 4.3Å; L208-T224 HydrophobicContact CD2-CG2 3.92Å; L208-T224 HydrophobicContact CG-CG2 4.28Å; R209-T224 WeakPolarHBondContact O-CA 3.47Å |
| 225 | E | 84.8 | Confident | 78.2 | Confident | 30 Ų | 30 | 41.5 Ų | 41.5 | 14% | 0.14 | 23% | 0.227 | C | C | . | . | E | Extended strand (participates in β ladder) | trans | -65 | 150.3 | 170.6 | 68.3 | -165.3 | 152 | 0 | 0 | 112.1 | L208 R209 R211 | L208-E225 HydrophobicContact CD1-CG 3.73Å; R209-E225 VanDerWaalsContact CB-CD 3.43Å; R209-E225 HydrophobicContact CB-CG 4.19Å; R209-E225 WeakPolarHBondContact CB-OE1 3.35Å; R209-E225 PolarHBondContact N-OE1 3.23Å; R209-E225 PolarHBondContact O-N 3.19Å; R211-E225 HydrophobicContact CG-CB 4.33Å; R211-E225 IonicContact CZ-OE2 3.53Å; R211-E225 IonicContact NE-OE2 2.84Å; R211-E225 IonicContact NH2-OE2 3.36Å; R211-E225 PolarHBondContact NH2-OE2 3.14Å |
| 226 | Y | 84.1 | Confident | 77.9 | Confident | 62 Ų | 62 | 41.8 Ų | 41.8 | 24% | 0.243 | 23% | 0.225 | C | C | . | . | trans | -85.6 | 133.4 | 173.2 | -179.9 | -101.3 | 0 | 0 | 0 | 110.3 | L158 R168 I177 V179 Q228 | L158-Y226 HydrophobicContact CD1-CE2 4.23Å; R168-Y226 HydrophobicContact CB-CE2 4.38Å; R168-Y226 HydrophobicContact CG-CD2 4.17Å; R168-Y226 HydrophobicContact CG-CE2 4.04Å; I177-Y226 HydrophobicContact CG2-CD1 3.86Å; I177-Y226 HydrophobicContact CG2-CD2 4.28Å; I177-Y226 HydrophobicContact CG2-CG 3.72Å; V179-Y226 HydrophobicContact CG2-CD2 3.65Å; V179-Y226 HydrophobicContact CG2-CG 4.42Å; Y226-Q228 HydrophobicContact CE1-CB 4.05Å; Y226-Q228 HydrophobicContact CE1-CG 4.41Å | ||
| 227 | C | 79.4 | Confident | 77.7 | Confident | 10 Ų | 10 | 43.4 Ų | 43.4 | 7% | 0.068 | 25% | 0.246 | C | C | . | . | trans | -108.1 | 104.1 | 177.4 | -60.6 | 0 | 0 | 0 | 0 | 108.7 | C17 L208 A229 G230 I279 | C17-C227 PolarHBondContact SG-SG 2.71Å; L208-C227 VanDerWaalsContact CD1-SG 3.57Å; C227-A229 VanDerWaalsContact C-N 3.31Å; C227-A229 PolarHBondContact O-N 3.09Å; C227-G230 PolarHBondContact O-N 3.46Å; C227-G230 VanDerWaalsContact O-N 3.15Å; C227-I279 WeakPolarHBondContact CB-O 3.45Å | ||
| 228 | Q | 71.7 | Confident | 77.6 | Confident | 115 Ų | 115 | 38.5 Ų | 38.5 | 54% | 0.537 | 22% | 0.223 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -63.7 | -33.9 | -171.3 | -171.2 | 177.8 | -10.5 | 0 | 0 | 113.2 | Y226 G230 D281 | Y226-Q228 HydrophobicContact CE1-CB 4.05Å; Y226-Q228 HydrophobicContact CE1-CG 4.41Å; Q228-G230 PolarHBondContact O-N 3.18Å; Q228-D281 WeakPolarHBondContact CA-OD1 3.43Å; Q228-D281 HydrophobicContact CB-CB 4.34Å; Q228-D281 WeakPolarHBondContact CB-OD1 3.48Å; Q228-D281 PolarHBondContact N-OD1 3.17Å |
| 229 | A | 66.9 | Low | 77.7 | Confident | 33 Ų | 33 | 43.3 Ų | 43.3 | 27% | 0.273 | 24% | 0.242 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -75.9 | -3.3 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | C227 I279 | C227-A229 VanDerWaalsContact C-N 3.31Å; C227-A229 PolarHBondContact O-N 3.09Å; A229-I279 HydrophobicContact CB-CB 3.83Å; A229-I279 HydrophobicContact CB-CG2 3.76Å |
| 230 | G | 69 | Low | 77.6 | Confident | 20 Ų | 20 | 46 Ų | 46 | 21% | 0.206 | 25% | 0.254 | C | S | . | . | trans | 71.3 | -154.8 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | C227 Q228 S278 I279 | C227-G230 PolarHBondContact O-N 3.46Å; C227-G230 VanDerWaalsContact O-N 3.15Å; Q228-G230 PolarHBondContact O-N 3.18Å; G230-S278 CarbonylContact O-C 3.44Å; G230-S278 WeakPolarHBondContact O-CA 3.5Å; G230-I279 PolarHBondContact O-N 3.03Å | ||
| 231 | G | 69 | Low | 77.4 | Confident | 9 Ų | 9 | 48 Ų | 48 | 9% | 0.093 | 26% | 0.261 | C | S | . | . | B | Isolated β-bridge | trans | -84.5 | 152.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113 | D233 K234 L235 V277 | G231-D233 WeakPolarHBondContact CA-OD1 3.46Å; G231-D233 PolarHBondContact O-N 2.84Å; G231-K234 WeakPolarHBondContact O-CB 3.33Å; G231-K234 PolarHBondContact O-N 3.43Å; G231-L235 PolarHBondContact O-N 2.89Å; G231-V277 CarbonylContact C-O 3.49Å; G231-V277 WeakPolarHBondContact CA-O 3.47Å |
| 232 | L | 70.9 | Confident | 76.8 | Confident | 23 Ų | 23 | 53.7 Ų | 53.7 | 12% | 0.12 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -62.7 | -25.2 | 175.5 | 177.6 | 64.5 | 0 | 0 | 0 | 111.9 | K234 L235 I236 W241 L252 S275 V277 I279 | L232-K234 VanDerWaalsContact C-N 3.35Å; L232-L235 HydrophobicContact CD1-CB 4.43Å; L232-L235 HydrophobicContact CD1-CD2 4.03Å; L232-L235 PolarHBondContact O-N 3.27Å; L232-I236 HydrophobicContact CD1-CD1 4.13Å; L232-I236 HydrophobicContact CD1-CG1 4.07Å; L232-I236 HydrophobicContact CD2-CD1 4.2Å; L232-I236 HydrophobicContact CG-CD1 3.68Å; L232-I236 HydrophobicContact CG-CG1 4.12Å; L232-I236 WeakPolarHBondContact O-CB 3.26Å; L232-I236 WeakPolarHBondContact O-CG1 3.14Å; L232-I236 PolarHBondContact O-N 2.96Å; L232-W241 HydrophobicContact CD1-CZ3 4.31Å; L232-L252 HydrophobicContact CD1-CD1 3.94Å; L232-S275 CarbonylContact C-O 3.55Å; L232-S275 WeakPolarHBondContact CB-O 3.43Å; L232-S275 PolarHBondContact N-O 3.25Å; L232-V277 PolarHBondContact N-O 2.89Å; L232-I279 HydrophobicContact CB-CD1 3.97Å; L232-I279 HydrophobicContact CB-CG1 4.03Å; L232-I279 HydrophobicContact CD1-CD1 3.9Å; L232-I279 HydrophobicContact CD1-CG1 4.44Å |
| 233 | D | 68.1 | Low | 76.4 | Confident | 56 Ų | 56 | 61.1 Ų | 61.1 | 30% | 0.299 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -58.4 | -43.6 | 169.8 | 63.5 | -41 | 0 | 0 | 0 | 112.2 | G231 I236 A237 S275 | G231-D233 WeakPolarHBondContact CA-OD1 3.46Å; G231-D233 PolarHBondContact O-N 2.84Å; D233-I236 PolarHBondContact O-N 2.9Å; D233-A237 VanDerWaalsContact O-CB 3.23Å; D233-A237 WeakPolarHBondContact O-CB 3.05Å; D233-A237 PolarHBondContact O-N 3.01Å; D233-S275 PolarHBondContact N-O 3.19Å |
| 234 | K | 71.5 | Confident | 76 | Confident | 145 Ų | 145 | 61.5 Ų | 61.5 | 63% | 0.63 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -67.4 | -39.6 | 177 | -63.8 | -174.3 | -180 | -178.9 | 0 | 111.7 | G231 L232 S238 | G231-K234 WeakPolarHBondContact O-CB 3.33Å; G231-K234 PolarHBondContact O-N 3.43Å; L232-K234 VanDerWaalsContact C-N 3.35Å; K234-S238 PolarHBondContact O-N 2.98Å |
| 235 | L | 72.2 | Confident | 75.9 | Confident | 14 Ų | 14 | 63.3 Ų | 63.3 | 7% | 0.073 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -65 | -51.1 | 175.7 | -179.1 | 64.8 | 0 | 0 | 0 | 110.3 | G231 L232 A237 S238 W241 L244 L252 I279 F283 | G231-L235 PolarHBondContact O-N 2.89Å; L232-L235 HydrophobicContact CD1-CB 4.43Å; L232-L235 HydrophobicContact CD1-CD2 4.03Å; L232-L235 PolarHBondContact O-N 3.27Å; L235-A237 PolarHBondContact O-N 3.15Å; L235-S238 PolarHBondContact O-N 3.4Å; L235-S238 PolarHBondContact O-OG 2.75Å; L235-W241 HydrophobicContact CD2-CE3 4.26Å; L235-W241 HydrophobicContact CD2-CZ3 4.46Å; L235-W241 HydrophobicContact CG-CE3 4.16Å; L235-W241 WeakPolarHBondContact O-CB 3.49Å; L235-L244 HydrophobicContact CD1-CD1 4.13Å; L235-L244 HydrophobicContact CD2-CD1 3.92Å; L235-L244 HydrophobicContact CG-CD1 4.18Å; L235-L252 HydrophobicContact CD2-CD1 3.95Å; L235-I279 HydrophobicContact CB-CD1 3.77Å; L235-I279 HydrophobicContact CD2-CD1 3.6Å; L235-I279 HydrophobicContact CG-CD1 4.33Å; L235-F283 HydrophobicContact CD1-CE1 4.11Å; L235-F283 HydrophobicContact CD2-CD1 4.06Å; L235-F283 HydrophobicContact CD2-CE1 3.38Å; L235-F283 HydrophobicContact CD2-CZ 3.68Å; L235-F283 HydrophobicContact CG-CE1 4.4Å |
| 236 | I | 76.9 | Confident | 76 | Confident | 60 Ų | 60 | 70.4 Ų | 70.4 | 31% | 0.308 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -59.4 | -35.7 | -179.6 | -70.5 | 168.6 | 0 | 0 | 0 | 111.7 | L232 D233 S238 W241 | L232-I236 HydrophobicContact CD1-CD1 4.13Å; L232-I236 HydrophobicContact CD1-CG1 4.07Å; L232-I236 HydrophobicContact CD2-CD1 4.2Å; L232-I236 HydrophobicContact CG-CD1 3.68Å; L232-I236 HydrophobicContact CG-CG1 4.12Å; L232-I236 WeakPolarHBondContact O-CB 3.26Å; L232-I236 WeakPolarHBondContact O-CG1 3.14Å; L232-I236 PolarHBondContact O-N 2.96Å; D233-I236 PolarHBondContact O-N 2.9Å; I236-S238 VanDerWaalsContact C-N 3.31Å; I236-W241 HydrophobicContact CG1-CD2 4.06Å; I236-W241 HydrophobicContact CG1-CE3 3.98Å; I236-W241 HydrophobicContact CG1-CH2 4.25Å; I236-W241 HydrophobicContact CG1-CZ2 4.3Å; I236-W241 HydrophobicContact CG1-CZ3 4.09Å |
| 237 | A | 78.4 | Confident | 76 | Confident | 87 Ų | 87 | 71.3 Ų | 71.3 | 72% | 0.719 | 38% | 0.384 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.3 | -11.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114.1 | D233 L235 | D233-A237 VanDerWaalsContact O-CB 3.23Å; D233-A237 WeakPolarHBondContact O-CB 3.05Å; D233-A237 PolarHBondContact O-N 3.01Å; L235-A237 PolarHBondContact O-N 3.15Å |
| 238 | S | 77.3 | Confident | 76.2 | Confident | 36 Ų | 36 | 72 Ų | 72 | 25% | 0.252 | 39% | 0.387 | S | S | . | . | S | Bend | trans | -88.2 | 155.7 | -179.4 | 80.2 | 0 | 0 | 0 | 0 | 112 | K234 L235 I236 E240 W241 | K234-S238 PolarHBondContact O-N 2.98Å; L235-S238 PolarHBondContact O-N 3.4Å; L235-S238 PolarHBondContact O-OG 2.75Å; I236-S238 VanDerWaalsContact C-N 3.31Å; S238-E240 PolarHBondContact O-N 2.78Å; S238-E240 WeakPolarHBondContact OG-CB 3.17Å; S238-E240 PolarHBondContact OG-N 2.83Å; S238-W241 WeakPolarHBondContact O-CB 3.16Å; S238-W241 PolarHBondContact O-N 3.25Å; S238-W241 VanDerWaalsContact O-N 3.08Å |
| 239 | D | 79.3 | Confident | 76.8 | Confident | 128 Ų | 128 | 69 Ų | 69 | 68% | 0.684 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -61.1 | -23.7 | 172 | -68.7 | -35.2 | 0 | 0 | 0 | 112 | W241 I242 Q243 | D239-W241 PolarHBondContact O-N 2.84Å; D239-I242 PolarHBondContact O-N 3Å; D239-Q243 PolarHBondContact O-N 2.88Å |
| 240 | E | 76.8 | Confident | 77.7 | Confident | 99 Ų | 99 | 71 Ų | 71 | 46% | 0.463 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -61.4 | -34.3 | 175.7 | -54.1 | 178.9 | 166.4 | 0 | 0 | 111 | S238 I242 Q243 L244 | S238-E240 PolarHBondContact O-N 2.78Å; S238-E240 WeakPolarHBondContact OG-CB 3.17Å; S238-E240 PolarHBondContact OG-N 2.83Å; E240-I242 VanDerWaalsContact C-N 3.29Å; E240-I242 PolarHBondContact O-N 2.94Å; E240-Q243 CarbonylContact O-C 3.55Å; E240-Q243 PolarHBondContact O-N 3.28Å; E240-L244 WeakPolarHBondContact O-CG 3.47Å; E240-L244 PolarHBondContact O-N 2.65Å |
| 241 | W | 76.9 | Confident | 78.4 | Confident | 52 Ų | 52 | 71.3 Ų | 71.3 | 20% | 0.197 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -59.2 | -42.1 | 177 | 176 | -104.7 | 0 | 0 | 0 | 112.4 | L232 L235 I236 S238 D239 Q243 L244 R249 L252 | L232-W241 HydrophobicContact CD1-CZ3 4.31Å; L235-W241 HydrophobicContact CD2-CE3 4.26Å; L235-W241 HydrophobicContact CD2-CZ3 4.46Å; L235-W241 HydrophobicContact CG-CE3 4.16Å; L235-W241 WeakPolarHBondContact O-CB 3.49Å; I236-W241 HydrophobicContact CG1-CD2 4.06Å; I236-W241 HydrophobicContact CG1-CE3 3.98Å; I236-W241 HydrophobicContact CG1-CH2 4.25Å; I236-W241 HydrophobicContact CG1-CZ2 4.3Å; I236-W241 HydrophobicContact CG1-CZ3 4.09Å; S238-W241 WeakPolarHBondContact O-CB 3.16Å; S238-W241 PolarHBondContact O-N 3.25Å; S238-W241 VanDerWaalsContact O-N 3.08Å; D239-W241 PolarHBondContact O-N 2.84Å; W241-Q243 PolarHBondContact O-N 3.27Å; W241-L244 HydrophobicContact CD2-CD1 4.46Å; W241-L244 HydrophobicContact CE3-CD1 3.62Å; W241-L244 HydrophobicContact CZ3-CD1 4.12Å; W241-L244 WeakPolarHBondContact O-CB 3.35Å; W241-L244 PolarHBondContact O-N 3.27Å; W241-R249 HydrophobicContact CE3-CG 4.42Å; W241-R249 HydrophobicContact CH2-CB 3.88Å; W241-R249 HydrophobicContact CH2-CG 3.6Å; W241-R249 HydrophobicContact CZ2-CB 4.35Å; W241-R249 HydrophobicContact CZ2-CG 3.88Å; W241-R249 HydrophobicContact CZ3-CB 4.46Å; W241-R249 HydrophobicContact CZ3-CG 3.89Å; W241-R249 PolarHBondContact O-NE 2.99Å; W241-R249 PolarHBondContact O-NH2 2.86Å; W241-L252 HydrophobicContact CZ3-CD1 3.8Å |
| 242 | I | 75.7 | Confident | 78.9 | Confident | 125 Ų | 125 | 71.2 Ų | 71.2 | 64% | 0.641 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -62.2 | -35.9 | 178.7 | -62.2 | 173.8 | 0 | 0 | 0 | 110.2 | D239 E240 R249 | D239-I242 PolarHBondContact O-N 3Å; E240-I242 VanDerWaalsContact C-N 3.29Å; E240-I242 PolarHBondContact O-N 2.94Å; I242-R249 PolarHBondContact O-NH2 2.81Å; I242-R249 VanDerWaalsContact O-NH2 3.1Å |
| 243 | Q | 78.7 | Confident | 79.5 | Confident | 162 Ų | 162 | 72.8 Ų | 72.8 | 76% | 0.757 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -80.4 | -18.8 | -179.7 | -60.7 | 179.8 | 10 | 0 | 0 | 113.5 | D239 E240 W241 A245 | D239-Q243 PolarHBondContact O-N 2.88Å; E240-Q243 CarbonylContact O-C 3.55Å; E240-Q243 PolarHBondContact O-N 3.28Å; W241-Q243 PolarHBondContact O-N 3.27Å; Q243-A245 PolarHBondContact O-N 2.87Å |
| 244 | L | 81 | Confident | 80.4 | Confident | 8 Ų | 8 | 73.9 Ų | 73.9 | 4% | 0.042 | 40% | 0.397 | C | S | . | . | S | Bend | trans | -61.4 | 126.7 | 177.4 | -78 | 174 | 0 | 0 | 0 | 112.1 | L235 E240 W241 I248 R249 F283 L287 | L235-L244 HydrophobicContact CD1-CD1 4.13Å; L235-L244 HydrophobicContact CD2-CD1 3.92Å; L235-L244 HydrophobicContact CG-CD1 4.18Å; E240-L244 WeakPolarHBondContact O-CG 3.47Å; E240-L244 PolarHBondContact O-N 2.65Å; W241-L244 HydrophobicContact CD2-CD1 4.46Å; W241-L244 HydrophobicContact CE3-CD1 3.62Å; W241-L244 HydrophobicContact CZ3-CD1 4.12Å; W241-L244 WeakPolarHBondContact O-CB 3.35Å; W241-L244 PolarHBondContact O-N 3.27Å; L244-I248 HydrophobicContact CD2-CB 4.27Å; L244-I248 HydrophobicContact CD2-CG2 3.89Å; L244-R249 HydrophobicContact CB-CG 4.26Å; L244-R249 PolarHBondContact O-NE 3.27Å; L244-R249 PolarHBondContact O-NH2 3.49Å; L244-F283 HydrophobicContact CD1-CE1 3.88Å; L244-F283 HydrophobicContact CD1-CZ 3.75Å; L244-F283 HydrophobicContact CD2-CE1 3.91Å; L244-F283 HydrophobicContact CD2-CZ 3.92Å; L244-L287 HydrophobicContact CD2-CD2 3.38Å; L244-L287 HydrophobicContact CD2-CG 4.25Å; L244-L287 HydrophobicContact CG-CD2 4.3Å |
| 245 | A | 85 | Confident | 80.8 | Confident | 55 Ų | 55 | 67.3 Ų | 67.3 | 46% | 0.455 | 37% | 0.369 | S | S | . | . | trans | -56 | 141.9 | 171.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | Q243 S247 I248 R249 | Q243-A245 PolarHBondContact O-N 2.87Å; A245-S247 PolarHBondContact O-N 3.22Å; A245-S247 VanDerWaalsContact O-N 3.13Å; A245-I248 HydrophobicContact CB-CG1 4.33Å; A245-I248 WeakPolarHBondContact O-CB 3.49Å; A245-I248 PolarHBondContact O-N 3.29Å; A245-R249 PolarHBondContact O-N 3.13Å | ||
| 246 | W | 86.7 | Confident | 81.3 | Confident | 179 Ų | 179 | 67.7 Ų | 67.7 | 68% | 0.678 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -55.4 | -35.2 | -179.2 | -172.4 | -108.8 | 0 | 0 | 0 | 112.8 | I248 R249 V250 | W246-I248 VanDerWaalsContact C-N 3.26Å; W246-I248 PolarHBondContact O-N 3.07Å; W246-R249 PolarHBondContact O-N 3.35Å; W246-R249 VanDerWaalsContact O-N 3.17Å; W246-V250 HydrophobicContact CD2-CG2 4.48Å; W246-V250 HydrophobicContact CG-CG2 4.4Å; W246-V250 HydrophobicContact CZ2-CG2 4.5Å; W246-V250 WeakPolarHBondContact O-CG2 3.28Å; W246-V250 PolarHBondContact O-N 3.06Å |
| 247 | S | 85.8 | Confident | 81.8 | Confident | 82 Ų | 82 | 67.8 Ų | 67.8 | 57% | 0.573 | 38% | 0.378 | S | S | * | . | H | α-helix | trans | -56 | -38.7 | 174.3 | 51.9 | 0 | 0 | 0 | 0 | 112.9 | A245 S251 | A245-S247 PolarHBondContact O-N 3.22Å; A245-S247 VanDerWaalsContact O-N 3.13Å; S247-S251 WeakPolarHBondContact O-CB 3.18Å; S247-S251 PolarHBondContact O-N 2.79Å |
| 248 | I | 83 | Confident | 82.2 | Confident | 23 Ų | 23 | 67.2 Ų | 67.2 | 12% | 0.118 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -71.3 | -42.2 | 177.7 | -56.4 | -59.9 | 0 | 0 | 0 | 110.8 | L244 A245 W246 V250 S251 L252 F283 R286 | L244-I248 HydrophobicContact CD2-CB 4.27Å; L244-I248 HydrophobicContact CD2-CG2 3.89Å; A245-I248 HydrophobicContact CB-CG1 4.33Å; A245-I248 WeakPolarHBondContact O-CB 3.49Å; A245-I248 PolarHBondContact O-N 3.29Å; W246-I248 VanDerWaalsContact C-N 3.26Å; W246-I248 PolarHBondContact O-N 3.07Å; I248-V250 VanDerWaalsContact C-N 3.34Å; I248-V250 PolarHBondContact O-N 3.15Å; I248-S251 WeakPolarHBondContact O-CB 3.44Å; I248-S251 PolarHBondContact O-N 3.19Å; I248-S251 VanDerWaalsContact O-N 3.16Å; I248-L252 PolarHBondContact O-N 2.81Å; I248-F283 HydrophobicContact CG2-CD2 4.49Å; I248-F283 HydrophobicContact CG2-CE1 4.36Å; I248-F283 HydrophobicContact CG2-CE2 3.32Å; I248-F283 HydrophobicContact CG2-CZ 3.26Å; I248-R286 HydrophobicContact CD1-CB 4Å |
| 249 | R | 83 | Confident | 82.4 | Confident | 54 Ų | 54 | 65.5 Ų | 65.5 | 20% | 0.204 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -61.6 | -42.7 | 176.5 | -58.5 | -176 | -175 | 161.6 | 7.7 | 111.8 | W241 I242 L244 A245 W246 L252 A253 | W241-R249 HydrophobicContact CE3-CG 4.42Å; W241-R249 HydrophobicContact CH2-CB 3.88Å; W241-R249 HydrophobicContact CH2-CG 3.6Å; W241-R249 HydrophobicContact CZ2-CB 4.35Å; W241-R249 HydrophobicContact CZ2-CG 3.88Å; W241-R249 HydrophobicContact CZ3-CB 4.46Å; W241-R249 HydrophobicContact CZ3-CG 3.89Å; W241-R249 PolarHBondContact O-NE 2.99Å; W241-R249 PolarHBondContact O-NH2 2.86Å; I242-R249 PolarHBondContact O-NH2 2.81Å; I242-R249 VanDerWaalsContact O-NH2 3.1Å; L244-R249 HydrophobicContact CB-CG 4.26Å; L244-R249 PolarHBondContact O-NE 3.27Å; L244-R249 PolarHBondContact O-NH2 3.49Å; A245-R249 PolarHBondContact O-N 3.13Å; W246-R249 PolarHBondContact O-N 3.35Å; W246-R249 VanDerWaalsContact O-N 3.17Å; R249-L252 WeakPolarHBondContact O-CB 3.36Å; R249-L252 PolarHBondContact O-N 2.98Å; R249-A253 PolarHBondContact O-N 3.16Å; R249-A253 VanDerWaalsContact O-N 3.09Å |
| 250 | V | 85.9 | Confident | 82.6 | Confident | 75 Ų | 75 | 60.2 Ų | 60.2 | 46% | 0.455 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -64.4 | -40.5 | 174 | 173.9 | 0 | 0 | 0 | 0 | 111 | W246 I248 L252 A253 L254 | W246-V250 HydrophobicContact CD2-CG2 4.48Å; W246-V250 HydrophobicContact CG-CG2 4.4Å; W246-V250 HydrophobicContact CZ2-CG2 4.5Å; W246-V250 WeakPolarHBondContact O-CG2 3.28Å; W246-V250 PolarHBondContact O-N 3.06Å; I248-V250 VanDerWaalsContact C-N 3.34Å; I248-V250 PolarHBondContact O-N 3.15Å; V250-L252 VanDerWaalsContact C-N 3.35Å; V250-L252 PolarHBondContact O-N 2.85Å; V250-A253 PolarHBondContact O-N 2.81Å; V250-L254 WeakPolarHBondContact O-CB 3.25Å; V250-L254 PolarHBondContact O-N 2.81Å |
| 251 | S | 84.3 | Confident | 83.1 | Confident | 26 Ų | 26 | 62.2 Ų | 62.2 | 18% | 0.182 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -60.1 | -43.1 | 174.9 | -170.7 | 0 | 0 | 0 | 0 | 111.8 | S247 I248 L254 D255 R286 | S247-S251 WeakPolarHBondContact O-CB 3.18Å; S247-S251 PolarHBondContact O-N 2.79Å; I248-S251 WeakPolarHBondContact O-CB 3.44Å; I248-S251 PolarHBondContact O-N 3.19Å; I248-S251 VanDerWaalsContact O-N 3.16Å; S251-L254 PolarHBondContact O-N 2.88Å; S251-D255 WeakPolarHBondContact O-CB 3.4Å; S251-D255 VanDerWaalsContact O-CG 3.31Å; S251-D255 PolarHBondContact O-N 3.44Å; S251-R286 PolarHBondContact OG-NH1 3.22Å |
| 252 | L | 80.1 | Confident | 83.5 | Confident | 6 Ų | 6 | 62.1 Ų | 62.1 | 3% | 0.031 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -60.4 | -46.3 | 175.4 | -74.5 | 170.5 | 0 | 0 | 0 | 111.7 | V18 L232 L235 W241 I248 R249 V250 L254 D255 V256 F283 | V18-L252 HydrophobicContact CB-CD2 4.18Å; V18-L252 HydrophobicContact CG1-CB 4.4Å; V18-L252 HydrophobicContact CG1-CD2 3.55Å; L232-L252 HydrophobicContact CD1-CD1 3.94Å; L235-L252 HydrophobicContact CD2-CD1 3.95Å; W241-L252 HydrophobicContact CZ3-CD1 3.8Å; I248-L252 PolarHBondContact O-N 2.81Å; R249-L252 WeakPolarHBondContact O-CB 3.36Å; R249-L252 PolarHBondContact O-N 2.98Å; V250-L252 VanDerWaalsContact C-N 3.35Å; V250-L252 PolarHBondContact O-N 2.85Å; L252-L254 VanDerWaalsContact C-N 3.33Å; L252-L254 PolarHBondContact O-N 2.84Å; L252-D255 PolarHBondContact O-N 2.77Å; L252-V256 WeakPolarHBondContact O-CG2 3.33Å; L252-V256 PolarHBondContact O-N 3.25Å; L252-F283 HydrophobicContact CD1-CE2 3.55Å; L252-F283 HydrophobicContact CD1-CZ 3.55Å; L252-F283 HydrophobicContact CD2-CD2 3.62Å; L252-F283 HydrophobicContact CD2-CE2 3.29Å; L252-F283 HydrophobicContact CD2-CZ 4.1Å; L252-F283 HydrophobicContact CG-CD2 4.26Å; L252-F283 HydrophobicContact CG-CE2 3.42Å; L252-F283 VanDerWaalsContact CG-CE2 3.42Å; L252-F283 HydrophobicContact CG-CZ 3.99Å |
| 253 | A | 82.5 | Confident | 83.8 | Confident | 56 Ų | 56 | 56.3 Ų | 56.3 | 46% | 0.463 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -63.5 | -39 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | R249 V250 V256 S257 | R249-A253 PolarHBondContact O-N 3.16Å; R249-A253 VanDerWaalsContact O-N 3.09Å; V250-A253 PolarHBondContact O-N 2.81Å; A253-V256 PolarHBondContact O-N 3.38Å; A253-S257 WeakPolarHBondContact O-CB 3.36Å; A253-S257 PolarHBondContact O-N 2.91Å; A253-S257 PolarHBondContact O-OG 2.89Å |
| 254 | L | 86.5 | Confident | 84 | Confident | 80 Ų | 80 | 53 Ų | 53 | 42% | 0.419 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -63.8 | -43.8 | 175 | 178.8 | 61 | 0 | 0 | 0 | 111.5 | V250 S251 L252 S257 R258 | V250-L254 WeakPolarHBondContact O-CB 3.25Å; V250-L254 PolarHBondContact O-N 2.81Å; S251-L254 PolarHBondContact O-N 2.88Å; L252-L254 VanDerWaalsContact C-N 3.33Å; L252-L254 PolarHBondContact O-N 2.84Å; L254-S257 WeakPolarHBondContact O-CB 3.44Å; L254-S257 PolarHBondContact O-N 3.21Å; L254-R258 HydrophobicContact CD1-CG 4.46Å; L254-R258 WeakPolarHBondContact O-CG 3.14Å; L254-R258 PolarHBondContact O-N 2.82Å |
| 255 | D | 81.5 | Confident | 84.2 | Confident | 6 Ų | 6 | 57 Ų | 57 | 3% | 0.032 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -62.7 | -43.4 | 178 | -79.1 | -15.1 | 0 | 0 | 0 | 111.5 | V18 C19 S20 N206 S251 L252 S257 R258 G259 | V18-D255 HydrophobicContact CG1-CB 3.28Å; C19-D255 VanDerWaalsContact O-CG 3.29Å; S20-D255 WeakPolarHBondContact CA-OD2 3.41Å; N206-D255 WeakPolarHBondContact CB-O 3.36Å; N206-D255 WeakPolarHBondContact ND2-CA 3.35Å; N206-D255 WeakPolarHBondContact ND2-CB 3.33Å; N206-D255 PolarHBondContact ND2-O 2.92Å; S251-D255 WeakPolarHBondContact O-CB 3.4Å; S251-D255 VanDerWaalsContact O-CG 3.31Å; S251-D255 PolarHBondContact O-N 3.44Å; L252-D255 PolarHBondContact O-N 2.77Å; D255-S257 VanDerWaalsContact C-N 3.32Å; D255-S257 PolarHBondContact O-N 2.93Å; D255-R258 PolarHBondContact O-N 2.84Å; D255-R258 IonicContact OD1-NH1 2.7Å; D255-G259 PolarHBondContact O-N 3.02Å; D255-G259 VanDerWaalsContact O-N 3.09Å |
| 256 | V | 81.8 | Confident | 84 | Confident | 23 Ų | 23 | 56.6 Ų | 56.6 | 14% | 0.139 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -59.6 | -44.2 | 171.6 | 172.9 | 0 | 0 | 0 | 0 | 111.1 | V16 V18 L252 A253 R258 G259 M260 L273 V277 | V16-V256 HydrophobicContact CG1-CG1 4.36Å; V18-V256 HydrophobicContact CG1-CG2 4.41Å; V18-V256 HydrophobicContact CG2-CG2 3.63Å; L252-V256 WeakPolarHBondContact O-CG2 3.33Å; L252-V256 PolarHBondContact O-N 3.25Å; A253-V256 PolarHBondContact O-N 3.38Å; V256-R258 PolarHBondContact O-N 2.68Å; V256-G259 PolarHBondContact O-N 3.35Å; V256-M260 PolarHBondContact O-N 2.91Å; V256-L273 HydrophobicContact CG1-CD1 4.33Å; V256-L273 HydrophobicContact CG1-CD2 4.03Å; V256-V277 HydrophobicContact CG2-CG1 4.38Å |
| 257 | S | 86.7 | Confident | 83.6 | Confident | 61 Ų | 61 | 51.2 Ų | 51.2 | 43% | 0.427 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -63.2 | -41.1 | -179.2 | -57.7 | 0 | 0 | 0 | 0 | 112 | A253 L254 D255 M260 E261 | A253-S257 WeakPolarHBondContact O-CB 3.36Å; A253-S257 PolarHBondContact O-N 2.91Å; A253-S257 PolarHBondContact O-OG 2.89Å; L254-S257 WeakPolarHBondContact O-CB 3.44Å; L254-S257 PolarHBondContact O-N 3.21Å; D255-S257 VanDerWaalsContact C-N 3.32Å; D255-S257 PolarHBondContact O-N 2.93Å; S257-M260 PolarHBondContact O-N 2.88Å; S257-E261 WeakPolarHBondContact O-CB 3.48Å; S257-E261 PolarHBondContact O-N 3.39Å |
| 258 | R | 87.4 | Confident | 83.2 | Confident | 76 Ų | 76 | 50.3 Ų | 50.3 | 29% | 0.287 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -62.4 | -41.3 | 173.9 | -72.9 | 169.2 | 170.1 | 170.8 | -6.1 | 112.1 | L254 D255 V256 Y262 | L254-R258 HydrophobicContact CD1-CG 4.46Å; L254-R258 WeakPolarHBondContact O-CG 3.14Å; L254-R258 PolarHBondContact O-N 2.82Å; D255-R258 PolarHBondContact O-N 2.84Å; D255-R258 IonicContact OD1-NH1 2.7Å; V256-R258 PolarHBondContact O-N 2.68Å; R258-Y262 PolarHBondContact O-N 3.22Å |
| 259 | G | 82.9 | Confident | 82.6 | Confident | 0 Ų | 0 | 55 Ų | 55 | 0% | 0 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -61 | -44.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | N206 D255 V256 Y262 I263 | N206-G259 WeakPolarHBondContact O-CA 3.34Å; D255-G259 PolarHBondContact O-N 3.02Å; D255-G259 VanDerWaalsContact O-N 3.09Å; V256-G259 PolarHBondContact O-N 3.35Å; G259-Y262 PolarHBondContact O-N 3.34Å; G259-I263 VanDerWaalsContact O-CG1 3.32Å; G259-I263 WeakPolarHBondContact O-CG1 3.49Å; G259-I263 PolarHBondContact O-N 2.94Å |
| 260 | M | 83 | Confident | 81.8 | Confident | 17 Ų | 17 | 52.7 Ų | 52.7 | 8% | 0.084 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -68.6 | -41.5 | 177.6 | -74.8 | -56.9 | -52.6 | 0 | 0 | 113.2 | V16 V256 S257 Y262 I263 H264 H270 L273 | V16-M260 HydrophobicContact CG2-CG 4.43Å; V16-M260 HydrophobicContact CG2-SD 3.67Å; V256-M260 PolarHBondContact O-N 2.91Å; S257-M260 PolarHBondContact O-N 2.88Å; M260-Y262 VanDerWaalsContact C-N 3.29Å; M260-Y262 PolarHBondContact O-N 3.01Å; M260-I263 PolarHBondContact O-N 2.77Å; M260-I263 HydrophobicContact SD-CD1 4.3Å; M260-H264 WeakPolarHBondContact CE-NE2 3.12Å; M260-H264 WeakPolarHBondContact O-CB 3.4Å; M260-H264 VanDerWaalsContact O-CG 3.23Å; M260-H264 PolarHBondContact O-N 2.65Å; M260-H270 HydrophobicContact CE-CB 3.77Å; M260-H270 HydrophobicContact SD-CB 3.91Å; M260-L273 HydrophobicContact CG-CD1 4.37Å; M260-L273 HydrophobicContact CG-CD2 3.8Å; M260-L273 HydrophobicContact SD-CD1 3.97Å; M260-L273 HydrophobicContact SD-CD2 4.04Å; M260-L273 HydrophobicContact SD-CG 4.46Å |
| 261 | E | 87.2 | Confident | 80.5 | Confident | 141 Ų | 141 | 56.5 Ų | 56.5 | 66% | 0.659 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -55.4 | -47.1 | 172.6 | 179.1 | -178.4 | -132.8 | 0 | 0 | 110.5 | S257 H264 S265 | S257-E261 WeakPolarHBondContact O-CB 3.48Å; S257-E261 PolarHBondContact O-N 3.39Å; E261-H264 PolarHBondContact O-N 2.85Å; E261-S265 WeakPolarHBondContact O-CB 3.38Å; E261-S265 PolarHBondContact O-N 2.97Å |
| 262 | Y | 85 | Confident | 79.5 | Confident | 49 Ų | 49 | 57.6 Ų | 57.6 | 19% | 0.192 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -60.3 | -48.5 | 176.2 | 172.3 | -99.3 | 0 | 0 | 0 | 112.4 | L202 R203 H204 V207 R258 G259 M260 H264 S265 C266 | L202-Y262 HydrophobicContact CB-CE1 4.25Å; L202-Y262 HydrophobicContact CD2-CE1 3.89Å; R203-Y262 PolarHBondContact N-OH 3.28Å; R203-Y262 PolarHBondContact O-OH 3.31Å; H204-Y262 HydrophobicContact CB-CD1 3.38Å; H204-Y262 HydrophobicContact CB-CD2 4.01Å; H204-Y262 HydrophobicContact CB-CE1 3.63Å; H204-Y262 HydrophobicContact CB-CE2 4.24Å; H204-Y262 HydrophobicContact CB-CG 3.57Å; H204-Y262 AromaticContact CD2-CD2 3.76Å; H204-Y262 AromaticContact CD2-CG 3.63Å; H204-Y262 AromaticContact CG-CD1 3.91Å; H204-Y262 AromaticContact CG-CG 3.63Å; V207-Y262 HydrophobicContact CG2-CD1 3.9Å; R258-Y262 PolarHBondContact O-N 3.22Å; G259-Y262 PolarHBondContact O-N 3.34Å; M260-Y262 VanDerWaalsContact C-N 3.29Å; M260-Y262 PolarHBondContact O-N 3.01Å; Y262-H264 VanDerWaalsContact C-N 3.3Å; Y262-H264 PolarHBondContact O-N 3.1Å; Y262-S265 PolarHBondContact O-N 2.83Å; Y262-S265 PolarHBondContact O-OG 2.73Å; Y262-C266 VanDerWaalsContact CZ-SG 3.59Å; Y262-C266 PolarHBondContact O-N 3.05Å; Y262-C266 PolarHBondContact O-SG 2.88Å |
| 263 | I | 81.5 | Confident | 78.6 | Confident | 4 Ų | 4 | 59 Ų | 59 | 2% | 0.021 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -58.6 | -44.4 | 178.6 | -71.5 | 170.6 | 0 | 0 | 0 | 110.8 | V16 V207 G259 M260 C266 Y268 | V16-I263 HydrophobicContact CG2-CD1 3.57Å; V207-I263 HydrophobicContact CG2-CD1 4.1Å; V207-I263 HydrophobicContact CG2-CG1 4.05Å; G259-I263 VanDerWaalsContact O-CG1 3.32Å; G259-I263 WeakPolarHBondContact O-CG1 3.49Å; G259-I263 PolarHBondContact O-N 2.94Å; M260-I263 PolarHBondContact O-N 2.77Å; M260-I263 HydrophobicContact SD-CD1 4.3Å; I263-C266 WeakPolarHBondContact O-CB 3.45Å; I263-C266 PolarHBondContact O-N 3.12Å; I263-Y268 PolarHBondContact O-N 3.24Å; I263-Y268 VanDerWaalsContact O-N 3.16Å |
| 264 | H | 83.1 | Confident | 77.5 | Confident | 92 Ų | 92 | 57.9 Ų | 57.9 | 43% | 0.426 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -65.5 | -40.7 | 177.2 | -68.8 | 174.1 | 0 | 0 | 0 | 111.9 | M260 E261 Y262 C266 G267 Y268 | M260-H264 WeakPolarHBondContact CE-NE2 3.12Å; M260-H264 WeakPolarHBondContact O-CB 3.4Å; M260-H264 VanDerWaalsContact O-CG 3.23Å; M260-H264 PolarHBondContact O-N 2.65Å; E261-H264 PolarHBondContact O-N 2.85Å; Y262-H264 VanDerWaalsContact C-N 3.3Å; Y262-H264 PolarHBondContact O-N 3.1Å; H264-C266 PolarHBondContact O-N 3.31Å; H264-G267 WeakPolarHBondContact O-CA 3.26Å; H264-G267 PolarHBondContact O-N 3.11Å; H264-Y268 PolarHBondContact CD2-O 2.81Å |
| 265 | S | 85.8 | Confident | 76 | Confident | 91 Ų | 91 | 57 Ų | 57 | 64% | 0.636 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -62 | -27 | 175.5 | 79.6 | 0 | 0 | 0 | 0 | 112.7 | E261 Y262 G267 | E261-S265 WeakPolarHBondContact O-CB 3.38Å; E261-S265 PolarHBondContact O-N 2.97Å; Y262-S265 PolarHBondContact O-N 2.83Å; Y262-S265 PolarHBondContact O-OG 2.73Å; S265-G267 PolarHBondContact O-N 3.06Å |
| 266 | C | 81 | Confident | 74.8 | Confident | 48 Ų | 48 | 63 Ų | 63 | 32% | 0.324 | 33% | 0.329 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.3 | 0.2 | 173.8 | -65.2 | 0 | 0 | 0 | 0 | 113.5 | L202 Y262 I263 H264 Y268 | L202-C266 HydrophobicContact CD2-CB 4.34Å; Y262-C266 VanDerWaalsContact CZ-SG 3.59Å; Y262-C266 PolarHBondContact O-N 3.05Å; Y262-C266 PolarHBondContact O-SG 2.88Å; I263-C266 WeakPolarHBondContact O-CB 3.45Å; I263-C266 PolarHBondContact O-N 3.12Å; H264-C266 PolarHBondContact O-N 3.31Å; C266-Y268 HydrophobicContact CB-CD2 3.56Å; C266-Y268 HydrophobicContact CB-CE2 3.79Å; C266-Y268 WeakPolarHBondContact O-CE2 3.33Å |
| 267 | G | 78.4 | Confident | 73.6 | Confident | 66 Ų | 66 | 62.1 Ų | 62.1 | 68% | 0.68 | 32% | 0.323 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 80 | 15.1 | -179.9 | 0 | 0 | 0 | 0 | 0 | 114.6 | H264 S265 | H264-G267 WeakPolarHBondContact O-CA 3.26Å; H264-G267 PolarHBondContact O-N 3.11Å; S265-G267 PolarHBondContact O-N 3.06Å |
| 268 | Y | 77.3 | Confident | 72.2 | Confident | 63 Ų | 63 | 60.7 Ų | 60.7 | 25% | 0.247 | 31% | 0.314 | C | S | . | . | trans | -103.1 | 150.4 | 179 | -58.5 | -65.3 | 0 | 0 | 0 | 111.4 | L198 K201 L202 I263 H264 C266 | L198-Y268 HydrophobicContact CD2-CD1 3.65Å; L198-Y268 HydrophobicContact CD2-CE1 3.1Å; L198-Y268 HydrophobicContact CD2-CE2 4.4Å; L198-Y268 HydrophobicContact CD2-CG 4.49Å; K201-Y268 WeakPolarHBondContact CD-OH 3.46Å; L202-Y268 HydrophobicContact CD2-CD2 3.91Å; L202-Y268 HydrophobicContact CD2-CE2 4.14Å; I263-Y268 PolarHBondContact O-N 3.24Å; I263-Y268 VanDerWaalsContact O-N 3.16Å; H264-Y268 PolarHBondContact CD2-O 2.81Å; C266-Y268 HydrophobicContact CB-CD2 3.56Å; C266-Y268 HydrophobicContact CB-CE2 3.79Å; C266-Y268 WeakPolarHBondContact O-CE2 3.33Å | ||
| 269 | M | 70.6 | Confident | 70.5 | Confident | 121 Ų | 121 | 57.2 Ų | 57.2 | 60% | 0.596 | 30% | 0.3 | S | S | * | . | trans | -114.4 | 124.5 | 170.6 | -71.9 | 179.7 | -97.4 | 0 | 0 | 108.2 | R271 | M269-R271 HydrophobicContact CB-CG 4.07Š| ||
| 270 | H | 66.3 | Low | 69.1 | Low | 5 Ų | 5 | 58.5 Ų | 58.5 | 2% | 0.023 | 31% | 0.308 | C | S | . | . | trans | -66.5 | -39.9 | -179.2 | -171 | -77.8 | 0 | 0 | 0 | 112.4 | F15 M260 D272 L273 | F15-H270 AromaticContact CD2-NE2 3.79Å; F15-H270 PolarHBondContact N-NE2 3.2Å; M260-H270 HydrophobicContact CE-CB 3.77Å; M260-H270 HydrophobicContact SD-CB 3.91Å; H270-D272 VanDerWaalsContact CE1-C 3.45Å; H270-D272 PolarHBondContact CE1-O 2.86Å; H270-D272 PolarHBondContact ND1-N 2.86Å; H270-D272 PolarHBondContact ND1-O 3.14Å; H270-D272 PolarHBondContact O-N 3.19Å; H270-L273 PolarHBondContact ND1-N 3.07Å | ||
| 271 | R | 57.2 | Low | 67.6 | Low | 156 Ų | 156 | 60.5 Ų | 60.5 | 59% | 0.589 | 32% | 0.32 | S | S | * | . | trans | 65.4 | -22.4 | 179.2 | -59.5 | 175.8 | 174.2 | 177.8 | -4.9 | 116.9 | V9 M269 | V9-R271 PolarHBondContact O-NH1 3.06Å; M269-R271 HydrophobicContact CB-CG 4.07Å | ||
| 272 | D | 63.3 | Low | 65.7 | Low | 48 Ų | 48 | 58.5 Ų | 58.5 | 26% | 0.257 | 31% | 0.313 | S | S | . | . | trans | -133.6 | 53.7 | -179 | -167.4 | 25.7 | 0 | 0 | 0 | 113.2 | E13 H270 T274 | E13-D272 VanDerWaalsContact CG-OD2 3.31Å; E13-D272 WeakPolarHBondContact CG-OD2 3.39Å; H270-D272 VanDerWaalsContact CE1-C 3.45Å; H270-D272 PolarHBondContact CE1-O 2.86Å; H270-D272 PolarHBondContact ND1-N 2.86Å; H270-D272 PolarHBondContact ND1-O 3.14Å; H270-D272 PolarHBondContact O-N 3.19Å; D272-T274 PolarHBondContact O-N 3.27Å; D272-T274 VanDerWaalsContact OD1-CG2 3.3Å; D272-T274 WeakPolarHBondContact OD1-CG2 3.42Å | ||
| 273 | L | 61.5 | Low | 64 | Low | 36 Ų | 36 | 57.2 Ų | 57.2 | 19% | 0.188 | 31% | 0.309 | C | S | . | . | trans | -77.5 | 102.6 | 178.7 | -172.6 | 71.2 | 0 | 0 | 0 | 109.5 | V16 V256 M260 H270 V277 | V16-L273 HydrophobicContact CB-CD1 3.95Å; V16-L273 HydrophobicContact CG1-CD1 4.34Å; V16-L273 HydrophobicContact CG2-CD1 3.82Å; V256-L273 HydrophobicContact CG1-CD1 4.33Å; V256-L273 HydrophobicContact CG1-CD2 4.03Å; M260-L273 HydrophobicContact CG-CD1 4.37Å; M260-L273 HydrophobicContact CG-CD2 3.8Å; M260-L273 HydrophobicContact SD-CD1 3.97Å; M260-L273 HydrophobicContact SD-CD2 4.04Å; M260-L273 HydrophobicContact SD-CG 4.46Å; H270-L273 PolarHBondContact ND1-N 3.07Å; L273-V277 HydrophobicContact CD1-CG2 3.75Å | ||
| 274 | T | 59.7 | Low | 62.3 | Low | 33 Ų | 33 | 61.6 Ų | 61.6 | 20% | 0.202 | 33% | 0.332 | C | S | . | . | trans | -117.5 | 170.4 | 179.8 | 67.1 | 0 | 0 | 0 | 0 | 111.6 | D272 R276 V277 | D272-T274 PolarHBondContact O-N 3.27Å; D272-T274 VanDerWaalsContact OD1-CG2 3.3Å; D272-T274 WeakPolarHBondContact OD1-CG2 3.42Å; T274-R276 PolarHBondContact O-N 3.03Å; T274-R276 VanDerWaalsContact O-N 3.1Å; T274-R276 PolarHBondContact OG1-N 2.83Å; T274-V277 VanDerWaalsContact O-CG2 3.25Å; T274-V277 WeakPolarHBondContact O-CG2 3.3Å; T274-V277 PolarHBondContact O-N 3.38Å | ||
| 275 | S | 54.5 | Low | 60.3 | Low | 62 Ų | 62 | 60.6 Ų | 60.6 | 43% | 0.434 | 35% | 0.347 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64 | -9.3 | 174.1 | 52 | 0 | 0 | 0 | 0 | 113.6 | L232 D233 V277 | L232-S275 CarbonylContact C-O 3.55Å; L232-S275 WeakPolarHBondContact CB-O 3.43Å; L232-S275 PolarHBondContact N-O 3.25Å; D233-S275 PolarHBondContact N-O 3.19Å; S275-V277 PolarHBondContact O-N 3.43Å; S275-V277 VanDerWaalsContact O-N 3.11Å |
| 276 | R | 55.8 | Low | 58.2 | Low | 132 Ų | 132 | 61.1 Ų | 61.1 | 50% | 0.498 | 33% | 0.334 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.5 | -1.6 | 174.3 | -60.5 | -177 | -179 | 172.1 | 4.9 | 113.9 | E13 P14 T274 S278 | E13-R276 VanDerWaalsContact CD-NH1 3.26Å; E13-R276 IonicContact OE1-NH1 3.08Å; E13-R276 PolarHBondContact OE1-NH1 3.04Å; E13-R276 IonicContact OE2-CZ 3.55Å; E13-R276 IonicContact OE2-NH1 3.62Å; E13-R276 PolarHBondContact OE2-NH1 3.23Å; P14-R276 HydrophobicContact CG-CB 4.32Å; P14-R276 WeakPolarHBondContact CG-O 3.44Å; T274-R276 PolarHBondContact O-N 3.03Å; T274-R276 VanDerWaalsContact O-N 3.1Å; T274-R276 PolarHBondContact OG1-N 2.83Å; R276-S278 PolarHBondContact O-N 3.14Å |
| 277 | V | 58.4 | Low | 56.2 | Low | 3 Ų | 3 | 64.7 Ų | 64.7 | 2% | 0.018 | 35% | 0.35 | C | S | . | . | trans | -49.4 | 129.3 | 169.7 | 159.3 | 0 | 0 | 0 | 0 | 110.6 | P14 V16 V18 G231 L232 V256 L273 T274 S275 | P14-V277 HydrophobicContact CB-CG2 4.02Å; V16-V277 HydrophobicContact CB-CG1 4.44Å; V16-V277 HydrophobicContact CB-CG2 3.95Å; V16-V277 HydrophobicContact CG1-CG1 4.2Å; V16-V277 HydrophobicContact CG1-CG2 4.37Å; V16-V277 WeakPolarHBondContact O-CG1 3.4Å; V18-V277 HydrophobicContact CG2-CG1 3.56Å; G231-V277 CarbonylContact C-O 3.49Å; G231-V277 WeakPolarHBondContact CA-O 3.47Å; L232-V277 PolarHBondContact N-O 2.89Å; V256-V277 HydrophobicContact CG2-CG1 4.38Å; L273-V277 HydrophobicContact CD1-CG2 3.75Å; T274-V277 VanDerWaalsContact O-CG2 3.25Å; T274-V277 WeakPolarHBondContact O-CG2 3.3Å; T274-V277 PolarHBondContact O-N 3.38Å; S275-V277 PolarHBondContact O-N 3.43Å; S275-V277 VanDerWaalsContact O-N 3.11Å | ||
| 278 | S | 55.8 | Low | 55.1 | Low | 32 Ų | 32 | 64.7 Ų | 64.7 | 22% | 0.224 | 33% | 0.333 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.7 | 145.9 | -178.1 | -63.8 | 0 | 0 | 0 | 0 | 112 | C17 V18 G230 R276 | C17-S278 CarbonylContact C-O 3.54Å; C17-S278 VanDerWaalsContact CA-O 3.25Å; C17-S278 WeakPolarHBondContact CA-O 3.3Å; C17-S278 PolarHBondContact SG-O 2.84Å; V18-S278 PolarHBondContact N-O 3.4Å; G230-S278 CarbonylContact O-C 3.44Å; G230-S278 WeakPolarHBondContact O-CA 3.5Å; R276-S278 PolarHBondContact O-N 3.14Å |
| 279 | I | 53.2 | Low | 53.9 | Low | 2 Ų | 2 | 64.7 Ų | 64.7 | 1% | 0.01 | 34% | 0.338 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.5 | 129.3 | 176.1 | -59.6 | 163.8 | 0 | 0 | 0 | 109 | V18 C227 A229 G230 L232 L235 F283 | V18-I279 HydrophobicContact CG2-CG1 4.39Å; C227-I279 WeakPolarHBondContact CB-O 3.45Å; A229-I279 HydrophobicContact CB-CB 3.83Å; A229-I279 HydrophobicContact CB-CG2 3.76Å; G230-I279 PolarHBondContact O-N 3.03Å; L232-I279 HydrophobicContact CB-CD1 3.97Å; L232-I279 HydrophobicContact CB-CG1 4.03Å; L232-I279 HydrophobicContact CD1-CD1 3.9Å; L232-I279 HydrophobicContact CD1-CG1 4.44Å; L235-I279 HydrophobicContact CB-CD1 3.77Å; L235-I279 HydrophobicContact CD2-CD1 3.6Å; L235-I279 HydrophobicContact CG-CD1 4.33Å; I279-F283 HydrophobicContact CG2-CB 3.63Å; I279-F283 HydrophobicContact CG2-CD2 4.25Å; I279-F283 HydrophobicContact CG2-CG 3.93Å |
| 280 | V | 53.4 | Low | 53 | Low | 28 Ų | 28 | 61.6 Ų | 61.6 | 17% | 0.17 | 32% | 0.324 | C | S | . | . | trans | -85.1 | 148.9 | 176.8 | -171.3 | 0 | 0 | 0 | 0 | 112 | C17 V18 C19 N282 F283 | C17-V280 HydrophobicContact CB-CG2 4.41Å; C17-V280 WeakPolarHBondContact SG-CG2 3.3Å; V18-V280 PolarHBondContact O-N 2.83Å; C19-V280 VanDerWaalsContact SG-CB 3.58Å; C19-V280 WeakPolarHBondContact SG-CG2 3.37Å; V280-N282 PolarHBondContact O-N 3.17Å; V280-F283 PolarHBondContact O-N 3.24Å | ||
| 281 | D | 50.9 | Low | 52.2 | Low | 59 Ų | 59 | 64.9 Ų | 64.9 | 32% | 0.316 | 34% | 0.341 | S | S | . | . | G | 310 helix | trans | -42.7 | -22.5 | -168.7 | -56.7 | 4.4 | 0 | 0 | 0 | 117.3 | Q228 F283 L284 | Q228-D281 WeakPolarHBondContact CA-OD1 3.43Å; Q228-D281 HydrophobicContact CB-CB 4.34Å; Q228-D281 WeakPolarHBondContact CB-OD1 3.48Å; Q228-D281 PolarHBondContact N-OD1 3.17Å; D281-F283 PolarHBondContact O-N 3.45Å; D281-F283 VanDerWaalsContact O-N 3.11Å; D281-L284 PolarHBondContact O-N 3.2Å |
| 282 | N | 47.5 | Very low | 51.9 | Low | 99 Ų | 99 | 59.3 Ų | 59.3 | 53% | 0.529 | 33% | 0.326 | S | S | . | . | G | 310 helix | trans | -74 | 2.1 | 179.1 | -83.2 | -9.7 | 0 | 0 | 0 | 114.5 | V280 | V280-N282 PolarHBondContact O-N 3.17Š|
| 283 | F | 48.9 | Very low | 51.1 | Low | 21 Ų | 21 | 60 Ų | 60 | 9% | 0.092 | 33% | 0.33 | C | S | . | . | G | 310 helix | trans | -72.1 | -35.2 | 173.1 | -155.8 | -101.3 | 0 | 0 | 0 | 112.9 | L235 L244 I248 L252 I279 V280 D281 G285 R286 | L235-F283 HydrophobicContact CD1-CE1 4.11Å; L235-F283 HydrophobicContact CD2-CD1 4.06Å; L235-F283 HydrophobicContact CD2-CE1 3.38Å; L235-F283 HydrophobicContact CD2-CZ 3.68Å; L235-F283 HydrophobicContact CG-CE1 4.4Å; L244-F283 HydrophobicContact CD1-CE1 3.88Å; L244-F283 HydrophobicContact CD1-CZ 3.75Å; L244-F283 HydrophobicContact CD2-CE1 3.91Å; L244-F283 HydrophobicContact CD2-CZ 3.92Å; I248-F283 HydrophobicContact CG2-CD2 4.49Å; I248-F283 HydrophobicContact CG2-CE1 4.36Å; I248-F283 HydrophobicContact CG2-CE2 3.32Å; I248-F283 HydrophobicContact CG2-CZ 3.26Å; L252-F283 HydrophobicContact CD1-CE2 3.55Å; L252-F283 HydrophobicContact CD1-CZ 3.55Å; L252-F283 HydrophobicContact CD2-CD2 3.62Å; L252-F283 HydrophobicContact CD2-CE2 3.29Å; L252-F283 HydrophobicContact CD2-CZ 4.1Å; L252-F283 HydrophobicContact CG-CD2 4.26Å; L252-F283 HydrophobicContact CG-CE2 3.42Å; L252-F283 VanDerWaalsContact CG-CE2 3.42Å; L252-F283 HydrophobicContact CG-CZ 3.99Å; I279-F283 HydrophobicContact CG2-CB 3.63Å; I279-F283 HydrophobicContact CG2-CD2 4.25Å; I279-F283 HydrophobicContact CG2-CG 3.93Å; V280-F283 PolarHBondContact O-N 3.24Å; D281-F283 PolarHBondContact O-N 3.45Å; D281-F283 VanDerWaalsContact O-N 3.11Å; F283-G285 PolarHBondContact O-N 3.5Å; F283-R286 PolarHBondContact O-N 3.19Å; F283-R286 VanDerWaalsContact O-N 3.16Å |
| 284 | L | 44.8 | Very low | 50.4 | Low | 96 Ų | 96 | 61.7 Ų | 61.7 | 50% | 0.503 | 34% | 0.341 | S | S | . | . | G | 310 helix | trans | -67.2 | -24.4 | 179.1 | -70.9 | 170.4 | 0 | 0 | 0 | 112.9 | D281 R286 L287 | D281-L284 PolarHBondContact O-N 3.2Å; L284-R286 PolarHBondContact O-N 3.39Å; L284-L287 HydrophobicContact CD2-CD1 4.26Å |
| 285 | G | 42 | Very low | 49.7 | Very low | 72 Ų | 72 | 63.9 Ų | 63.9 | 74% | 0.742 | 35% | 0.351 | S | S | * | . | G | 310 helix | trans | -74.3 | -2.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | F283 | F283-G285 PolarHBondContact O-N 3.5Š|
| 286 | R | 41.1 | Very low | 49.2 | Very low | 101 Ų | 101 | 64.1 Ų | 64.1 | 38% | 0.381 | 34% | 0.344 | S | S | . | . | G | 310 helix | trans | -117.7 | -0.5 | 179.5 | -65.8 | -174.2 | 175.7 | -173.4 | -0 | 113.7 | S20 I248 S251 F283 L284 | S20-R286 PolarHBondContact OG-NH2 3.45Å; I248-R286 HydrophobicContact CD1-CB 4Å; S251-R286 PolarHBondContact OG-NH1 3.22Å; F283-R286 PolarHBondContact O-N 3.19Å; F283-R286 VanDerWaalsContact O-N 3.16Å; L284-R286 PolarHBondContact O-N 3.39Å |
| 287 | L | 39.2 | Very low | 48.7 | Very low | 124 Ų | 124 | 57.9 Ų | 57.9 | 65% | 0.649 | 33% | 0.33 | S | S | * | . | trans | -89.7 | 0 | 165.9 | -76 | 170.2 | 0 | 0 | 0 | 109 | L244 L284 | L244-L287 HydrophobicContact CD2-CD2 3.38Å; L244-L287 HydrophobicContact CD2-CG 4.25Å; L244-L287 HydrophobicContact CG-CD2 4.3Å; L284-L287 HydrophobicContact CD2-CD1 4.26Å |
Retrieved 287 of 287 residues in 60 ms
(Link to these results)