| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 39.5 | Very low | 49.1 | Very low | 236 Ų | 236 | 163.1 Ų | 163.1 | 100% | 1.163 | 83% | 0.834 | S | S | * | * | 0 | 121.3 | 0 | -150.4 | 71 | -179.3 | 0 | 0 | 107 | |||||
| 2 | F | 41.1 | Very low | 49.3 | Very low | 208 Ų | 208 | 160.7 Ų | 160.7 | 91% | 0.912 | 84% | 0.84 | S | S | * | * | trans | -50.4 | 123.4 | -162.4 | -73.7 | -87.7 | 0 | 0 | 0 | 113.8 | S4 | F2-S4 PolarHBondContact O-N 3.08Š| ||
| 3 | P | 46.9 | Very low | 49.6 | Very low | 118 Ų | 118 | 161.3 Ų | 161.3 | 77% | 0.766 | 84% | 0.836 | S | S | * | * | trans | -68.1 | 128.4 | 179.4 | 25.1 | -30.6 | 0 | 0 | 0 | 110.8 | Q5 | P3-Q5 PolarHBondContact O-N 3.3Š| ||
| 4 | S | 54.8 | Low | 50.1 | Low | 115 Ų | 115 | 164.6 Ų | 164.6 | 80% | 0.804 | 84% | 0.841 | S | S | * | * | trans | -28 | 110.2 | 172.6 | -167.1 | 0 | 0 | 0 | 0 | 112.9 | F2 K6 | F2-S4 PolarHBondContact O-N 3.08Å; S4-K6 PolarHBondContact O-N 3.27Å | ||
| 5 | Q | 55.6 | Low | 50.5 | Low | 187 Ų | 187 | 158.1 Ų | 158.1 | 87% | 0.874 | 83% | 0.831 | S | S | * | * | trans | -59.5 | 109 | 174.3 | -64.2 | -173.7 | 12.1 | 0 | 0 | 107.6 | P3 A7 | P3-Q5 PolarHBondContact O-N 3.3Å; Q5-A7 PolarHBondContact O-N 3.1Å | ||
| 6 | K | 51.8 | Low | 51.3 | Low | 187 Ų | 187 | 158.2 Ų | 158.2 | 81% | 0.813 | 83% | 0.825 | S | S | * | * | trans | -42.3 | 115.8 | 170.9 | -80.1 | 166.5 | 173.6 | -91.4 | 0 | 108.1 | S4 L8 | S4-K6 PolarHBondContact O-N 3.27Å; K6-L8 VanDerWaalsContact C-N 3.29Å; K6-L8 PolarHBondContact O-N 3.33Å | ||
| 7 | A | 53.3 | Low | 52.5 | Low | 98 Ų | 98 | 154.1 Ų | 154.1 | 81% | 0.81 | 81% | 0.808 | S | S | * | * | trans | -52.8 | 100.4 | 162.8 | 0 | 0 | 0 | 0 | 0 | 106.9 | Q5 A9 | Q5-A7 PolarHBondContact O-N 3.1Å; A7-A9 PolarHBondContact O-N 3.45Å | ||
| 8 | L | 51.7 | Low | 53.8 | Low | 138 Ų | 138 | 147.6 Ų | 147.6 | 72% | 0.723 | 78% | 0.778 | S | S | * | * | trans | -63.1 | 100.6 | 165.9 | -97 | 88.3 | 0 | 0 | 0 | 104.9 | K6 Y10 | K6-L8 VanDerWaalsContact C-N 3.29Å; K6-L8 PolarHBondContact O-N 3.33Å; L8-Y10 VanDerWaalsContact C-N 3.27Å; L8-Y10 WeakPolarHBondContact O-CD2 3.36Å; L8-Y10 PolarHBondContact O-N 3.01Å | ||
| 9 | A | 50.1 | Low | 55.6 | Low | 82 Ų | 82 | 145.1 Ų | 145.1 | 68% | 0.678 | 77% | 0.771 | S | S | * | * | trans | -53.1 | 102.8 | 158.1 | 0 | 0 | 0 | 0 | 0 | 105.8 | A7 R11 | A7-A9 PolarHBondContact O-N 3.45Å; A9-R11 PolarHBondContact O-N 3.43Å | ||
| 10 | Y | 49.8 | Very low | 57.2 | Low | 217 Ų | 217 | 138.1 Ų | 138.1 | 85% | 0.851 | 73% | 0.734 | S | S | * | * | trans | -65.5 | 77.3 | 165.8 | -78.7 | -91.1 | 0 | 0 | 0 | 106.4 | L8 C12 | L8-Y10 VanDerWaalsContact C-N 3.27Å; L8-Y10 WeakPolarHBondContact O-CD2 3.36Å; L8-Y10 PolarHBondContact O-N 3.01Å; Y10-C12 PolarHBondContact O-N 3.42Å | ||
| 11 | R | 45.3 | Very low | 58.7 | Low | 208 Ų | 208 | 137 Ų | 137 | 79% | 0.785 | 73% | 0.733 | S | S | * | * | trans | -55.8 | 126.3 | 161.8 | -76.7 | 179.3 | 176.1 | 178.4 | -1.9 | 104.9 | A9 Q13 | A9-R11 PolarHBondContact O-N 3.43Å; R11-Q13 HydrophobicContact CB-CG 4.35Å; R11-Q13 PolarHBondContact O-N 3.15Å | ||
| 12 | C | 51.3 | Low | 60.9 | Low | 134 Ų | 134 | 134 Ų | 134 | 91% | 0.905 | 71% | 0.709 | S | S | * | * | trans | -60.4 | 78.1 | 161.7 | -61.3 | 0 | 0 | 0 | 0 | 107.2 | Y10 K14 | Y10-C12 PolarHBondContact O-N 3.42Å; C12-K14 PolarHBondContact O-N 2.85Å | ||
| 13 | Q | 53.9 | Low | 62.9 | Low | 169 Ų | 169 | 127 Ų | 127 | 79% | 0.79 | 68% | 0.679 | S | S | * | * | trans | -61.2 | 123 | 167.9 | -66.2 | 179.6 | 31.8 | 0 | 0 | 104.2 | R11 G15 | R11-Q13 HydrophobicContact CB-CG 4.35Å; R11-Q13 PolarHBondContact O-N 3.15Å; Q13-G15 PolarHBondContact O-N 3.06Å | ||
| 14 | K | 56.3 | Low | 64.5 | Low | 208 Ų | 208 | 125.9 Ų | 125.9 | 90% | 0.904 | 67% | 0.673 | S | S | * | * | trans | -42.9 | 114.7 | 174.9 | -71.2 | -170.8 | 174.8 | -175.8 | 0 | 107.2 | C12 H16 | C12-K14 PolarHBondContact O-N 2.85Å; K14-H16 PolarHBondContact O-N 3.42Å | ||
| 15 | G | 55.9 | Low | 65.9 | Low | 67 Ų | 67 | 124.7 Ų | 124.7 | 69% | 0.691 | 66% | 0.655 | S | S | * | * | trans | -51.2 | 117.2 | -164.4 | 0 | 0 | 0 | 0 | 0 | 110.1 | Q13 V17 | Q13-G15 PolarHBondContact O-N 3.06Å; G15-V17 PolarHBondContact O-N 3.46Å; G15-V17 VanDerWaalsContact O-N 3.12Å | ||
| 16 | H | 63.2 | Low | 67.3 | Low | 159 Ų | 159 | 116.3 Ų | 116.3 | 74% | 0.736 | 62% | 0.617 | S | S | * | * | trans | -68.4 | 110.4 | 168.1 | -174.3 | -85.7 | 0 | 0 | 0 | 105.9 | K14 S18 | K14-H16 PolarHBondContact O-N 3.42Å; H16-S18 VanDerWaalsContact C-N 3.32Å; H16-S18 PolarHBondContact O-N 2.03Å | ||
| 17 | V | 71.3 | Confident | 68.7 | Low | 88 Ų | 88 | 114 Ų | 114 | 53% | 0.533 | 61% | 0.612 | S | S | . | * | trans | -65.3 | 98.7 | 175.1 | -178.4 | 0 | 0 | 0 | 0 | 106.7 | G15 N36 | G15-V17 PolarHBondContact O-N 3.46Å; G15-V17 VanDerWaalsContact O-N 3.12Å; V17-N36 HydrophobicContact CG1-CB 3.59Å; V17-N36 WeakPolarHBondContact CG1-OD1 3.29Å | ||
| 18 | S | 77.5 | Confident | 70.1 | Confident | 37 Ų | 37 | 113 Ų | 113 | 26% | 0.259 | 61% | 0.611 | S | S | . | * | trans | -85.6 | 133.5 | 177 | 51.9 | 0 | 0 | 0 | 0 | 109.1 | H16 C37 | H16-S18 VanDerWaalsContact C-N 3.32Å; H16-S18 PolarHBondContact O-N 2.03Å; S18-C37 PolarHBondContact O-N 2.87Å; S18-C37 WeakPolarHBondContact OG-CB 3.5Å; S18-C37 PolarHBondContact OG-SG 2.97Å | ||
| 19 | P | 88 | Confident | 71.5 | Confident | 100 Ų | 100 | 112 Ų | 112 | 65% | 0.649 | 60% | 0.603 | S | S | * | * | B | Isolated β-bridge | trans | -64.2 | 147.8 | 170.8 | 29.3 | -34 | 0 | 0 | 0 | 109.3 | N35 | P19-N35 CarbonylContact C-O 3.59Å; P19-N35 WeakPolarHBondContact CA-O 3.38Å |
| 20 | C | 87.2 | Confident | 73.2 | Confident | 6 Ų | 6 | 110.6 Ų | 110.6 | 4% | 0.041 | 58% | 0.582 | C | S | . | * | trans | -147.4 | 153.9 | 179.4 | 58 | 0 | 0 | 0 | 0 | 110.3 | E25 C32 N35 N36 C37 | C20-E25 WeakPolarHBondContact CA-OE2 3.42Å; C20-E25 HydrophobicContact CB-CB 4.09Å; C20-C32 HydrophobicContact CB-CB 3.8Å; C20-C32 WeakPolarHBondContact CB-SG 3.42Å; C20-C32 PolarHBondContact O-SG 3.15Å; C20-C32 WeakPolarHBondContact SG-CA 3.41Å; C20-C32 WeakPolarHBondContact SG-CB 3.12Å; C20-C32 CovalentContact SG-SG 2.03Å; C20-C32 PolarHBondContact SG-SG 3.27Å; C20-N35 PolarHBondContact N-O 3.43Å; C20-N35 CarbonylContact O-C 3.45Å; C20-N35 VanDerWaalsContact O-CA 3.28Å; C20-N35 WeakPolarHBondContact O-CA 3.42Å; C20-N36 PolarHBondContact SG-N 3.1Å; C20-C37 VanDerWaalsContact CB-SG 3.59Å; C20-C37 PolarHBondContact SG-N 3.24Å; C20-C37 VanDerWaalsContact SG-N 3.43Å | ||
| 21 | T | 88 | Confident | 74.9 | Confident | 116 Ų | 116 | 100.4 Ų | 100.4 | 71% | 0.712 | 54% | 0.543 | S | S | * | . | S | Bend | trans | -111 | -28.8 | 170.5 | -26.7 | 0 | 0 | 0 | 0 | 110.9 | E25 | T21-E25 WeakPolarHBondContact CA-OE1 3.45Å; T21-E25 WeakPolarHBondContact CB-OE1 3.41Å; T21-E25 PolarHBondContact N-OE1 2.94Å; T21-E25 PolarHBondContact N-OE2 2.74Å; T21-E25 PolarHBondContact OG1-OE1 2.04Å |
| 22 | R | 85.5 | Confident | 76.9 | Confident | 173 Ų | 173 | 91.2 Ų | 91.2 | 65% | 0.653 | 51% | 0.51 | S | S | * | . | S | Bend | trans | -130.8 | 153.1 | -178.4 | -60.5 | 179.4 | 63.5 | -165.1 | -2.5 | 111.2 | S24 E25 | R22-S24 PolarHBondContact O-N 2.86Å; R22-E25 HydrophobicContact CB-CG 4.49Å; R22-E25 PolarHBondContact N-OE1 3.18Å; R22-E25 WeakPolarHBondContact O-CB 2.99Å; R22-E25 PolarHBondContact O-N 3.15Å |
| 23 | H | 83.3 | Confident | 78.5 | Confident | 61 Ų | 61 | 89.1 Ų | 89.1 | 28% | 0.282 | 48% | 0.484 | S | S | . | . | G | 310 helix | trans | -63.9 | -28.9 | -177.6 | -61.9 | 19.8 | 0 | 0 | 0 | 112.5 | E25 C26 M31 C32 A60 I62 | H23-E25 PolarHBondContact O-N 3.34Å; H23-C26 PolarHBondContact O-N 3.06Å; H23-C26 VanDerWaalsContact O-N 3.15Å; H23-M31 WeakPolarHBondContact NE2-CE 3.24Å; H23-C32 PolarHBondContact CE1-O 3.22Å; H23-A60 VanDerWaalsContact CD2-CB 3.42Å; H23-A60 WeakPolarHBondContact CD2-CB 3.44Å; H23-A60 WeakPolarHBondContact NE2-CB 3.46Å; H23-I62 HydrophobicContact CB-CD1 4.17Å; H23-I62 HydrophobicContact CB-CG1 4.44Å; H23-I62 VanDerWaalsContact CD2-CD1 3.5Å; H23-I62 WeakPolarHBondContact CD2-CD1 2.92Å |
| 24 | S | 81.1 | Confident | 79.9 | Confident | 93 Ų | 93 | 84.4 Ų | 84.4 | 65% | 0.65 | 47% | 0.474 | S | S | * | . | G | 310 helix | trans | -66.9 | -15.1 | 175.3 | 55 | 0 | 0 | 0 | 0 | 114.7 | R22 C26 | R22-S24 PolarHBondContact O-N 2.86Å; S24-C26 VanDerWaalsContact C-N 3.29Å |
| 25 | E | 84.8 | Confident | 81.3 | Confident | 90 Ų | 90 | 79.9 Ų | 79.9 | 42% | 0.421 | 46% | 0.46 | S | S | . | . | G | 310 helix | trans | -78.7 | -19 | 174.7 | -64.6 | 171.1 | -126.9 | 0 | 0 | 111.7 | C20 T21 R22 H23 | C20-E25 WeakPolarHBondContact CA-OE2 3.42Å; C20-E25 HydrophobicContact CB-CB 4.09Å; T21-E25 WeakPolarHBondContact CA-OE1 3.45Å; T21-E25 WeakPolarHBondContact CB-OE1 3.41Å; T21-E25 PolarHBondContact N-OE1 2.94Å; T21-E25 PolarHBondContact N-OE2 2.74Å; T21-E25 PolarHBondContact OG1-OE1 2.04Å; R22-E25 HydrophobicContact CB-CG 4.49Å; R22-E25 PolarHBondContact N-OE1 3.18Å; R22-E25 WeakPolarHBondContact O-CB 2.99Å; R22-E25 PolarHBondContact O-N 3.15Å; H23-E25 PolarHBondContact O-N 3.34Å |
| 26 | C | 85 | Confident | 82.8 | Confident | 12 Ų | 12 | 79.8 Ų | 79.8 | 8% | 0.081 | 44% | 0.443 | C | S | . | . | S | Bend | trans | -87.7 | 128.3 | 178.9 | -56.8 | 0 | 0 | 0 | 0 | 110.4 | H23 S24 Q30 C37 | H23-C26 PolarHBondContact O-N 3.06Å; H23-C26 VanDerWaalsContact O-N 3.15Å; S24-C26 VanDerWaalsContact C-N 3.29Å; C26-Q30 HydrophobicContact CB-CB 3.71Å; C26-C37 WeakPolarHBondContact CA-SG 3.03Å; C26-C37 HydrophobicContact CB-CB 3.79Å; C26-C37 WeakPolarHBondContact CB-SG 3.46Å; C26-C37 WeakPolarHBondContact SG-CA 3.49Å; C26-C37 WeakPolarHBondContact SG-CB 2.91Å; C26-C37 CovalentContact SG-SG 2.04Å; C26-C37 PolarHBondContact SG-SG 3.37Å |
| 27 | I | 80.9 | Confident | 84 | Confident | 138 Ų | 138 | 72.4 Ų | 72.4 | 71% | 0.708 | 41% | 0.41 | S | S | * | . | trans | -89.1 | 140.8 | -178.9 | 58.4 | 166.9 | 0 | 0 | 0 | 111.6 | Q30 | I27-Q30 PolarHBondContact O-NE2 3.19Š| ||
| 28 | G | 81.5 | Confident | 84.6 | Confident | 76 Ų | 76 | 69.3 Ų | 69.3 | 78% | 0.784 | 39% | 0.391 | S | S | * | . | S | Bend | trans | 76.2 | -142.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q30 | G28-Q30 PolarHBondContact O-N 2.03Å; G28-Q30 VanDerWaalsContact O-N 3.13Å |
| 29 | Q | 82.2 | Confident | 85 | Confident | 119 Ų | 119 | 71.6 Ų | 71.6 | 56% | 0.556 | 40% | 0.404 | S | S | * | . | S | Bend | trans | -89.1 | 58 | -179.4 | -161.9 | 176.4 | 38.7 | 0 | 0 | 110.9 | A40 | Q29-A40 WeakPolarHBondContact CG-O 3.24Å; Q29-A40 PolarHBondContact O-N 2.92Å |
| 30 | Q | 85.7 | Confident | 84.8 | Confident | 51 Ų | 51 | 67.1 Ų | 67.1 | 24% | 0.238 | 38% | 0.376 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.7 | 151.7 | -179.5 | -70 | -178.3 | 77.1 | 0 | 0 | 109.9 | C26 I27 G28 V38 | C26-Q30 HydrophobicContact CB-CB 3.71Å; I27-Q30 PolarHBondContact O-NE2 3.19Å; G28-Q30 PolarHBondContact O-N 2.03Å; G28-Q30 VanDerWaalsContact O-N 3.13Å; Q30-V38 CarbonylContact C-O 3.5Å; Q30-V38 VanDerWaalsContact CA-O 3.24Å; Q30-V38 WeakPolarHBondContact CA-O 3.28Å; Q30-V38 WeakPolarHBondContact CB-O 3.38Å |
| 31 | M | 85.2 | Confident | 84.6 | Confident | 4 Ų | 4 | 71.6 Ų | 71.6 | 2% | 0.02 | 40% | 0.397 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.7 | 156.5 | 173.2 | 75 | 177.8 | -66.5 | 0 | 0 | 110.9 | H23 Y33 C37 V38 A40 A60 I62 P69 | H23-M31 WeakPolarHBondContact NE2-CE 3.24Å; M31-Y33 PolarHBondContact O-N 3.06Å; M31-C37 WeakPolarHBondContact O-CA 3.5Å; M31-V38 HydrophobicContact CG-CG2 4.25Å; M31-V38 PolarHBondContact N-O 3.05Å; M31-V38 PolarHBondContact O-N 3.24Å; M31-A40 HydrophobicContact CB-CB 3.93Å; M31-A40 HydrophobicContact CG-CB 3.87Å; M31-A40 HydrophobicContact SD-CB 4.25Å; M31-A60 HydrophobicContact CE-CB 3.86Å; M31-I62 HydrophobicContact CB-CD1 3.42Å; M31-I62 VanDerWaalsContact CB-CD1 3.42Å; M31-P69 HydrophobicContact SD-CB 4.21Å; M31-P69 WeakPolarHBondContact SD-CD 3.02Å; M31-P69 HydrophobicContact SD-CG 4.41Å |
| 32 | C | 86.9 | Confident | 84.5 | Confident | 14 Ų | 14 | 69.5 Ų | 69.5 | 10% | 0.095 | 39% | 0.386 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.8 | 109.9 | 177 | -169.4 | 0 | 0 | 0 | 0 | 110 | C20 H23 | C20-C32 HydrophobicContact CB-CB 3.8Å; C20-C32 WeakPolarHBondContact CB-SG 3.42Å; C20-C32 PolarHBondContact O-SG 3.15Å; C20-C32 WeakPolarHBondContact SG-CA 3.41Å; C20-C32 WeakPolarHBondContact SG-CB 3.12Å; C20-C32 CovalentContact SG-SG 2.03Å; C20-C32 PolarHBondContact SG-SG 3.27Å; H23-C32 PolarHBondContact CE1-O 3.22Å |
| 33 | Y | 85 | Confident | 84.3 | Confident | 90 Ų | 90 | 63.8 Ų | 63.8 | 35% | 0.353 | 38% | 0.376 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.3 | 128.5 | 179.5 | -172 | -100.3 | 0 | 0 | 0 | 109.8 | M31 N35 N36 P69 | M31-Y33 PolarHBondContact O-N 3.06Å; Y33-N35 VanDerWaalsContact C-N 3.27Å; Y33-N35 PolarHBondContact O-N 3.47Å; Y33-N36 PolarHBondContact N-O 2.85Å; Y33-N36 PolarHBondContact O-N 3.34Å; Y33-P69 HydrophobicContact CD1-CB 4.41Å; Y33-P69 HydrophobicContact CD2-CB 4.31Å; Y33-P69 HydrophobicContact CD2-CG 3.93Å; Y33-P69 HydrophobicContact CE2-CG 4.05Å; Y33-P69 HydrophobicContact CG-CB 4.11Å; Y33-P69 HydrophobicContact CG-CG 4.22Å |
| 34 | A | 82.9 | Confident | 84.1 | Confident | 71 Ų | 71 | 63 Ų | 63 | 59% | 0.587 | 38% | 0.384 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.3 | 45 | -176 | 0 | 0 | 0 | 0 | 0 | 113.5 | N36 | A34-N36 PolarHBondContact O-N 2.83Å; A34-N36 PolarHBondContact O-ND2 2.93Å |
| 35 | N | 85.4 | Confident | 84.2 | Confident | 113 Ų | 113 | 60.9 Ų | 60.9 | 60% | 0.604 | 38% | 0.377 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61.1 | 18.1 | -176.4 | -54.6 | -65.1 | 0 | 0 | 0 | 115.4 | P19 C20 Y33 | P19-N35 CarbonylContact C-O 3.59Å; P19-N35 WeakPolarHBondContact CA-O 3.38Å; C20-N35 PolarHBondContact N-O 3.43Å; C20-N35 CarbonylContact O-C 3.45Å; C20-N35 VanDerWaalsContact O-CA 3.28Å; C20-N35 WeakPolarHBondContact O-CA 3.42Å; Y33-N35 VanDerWaalsContact C-N 3.27Å; Y33-N35 PolarHBondContact O-N 3.47Å |
| 36 | N | 87.8 | Confident | 84.2 | Confident | 64 Ų | 64 | 64.8 Ų | 64.8 | 34% | 0.342 | 40% | 0.398 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.1 | 138.5 | -179.8 | -71 | -66.5 | 0 | 0 | 0 | 110.4 | V17 C20 Y33 A34 V38 | V17-N36 HydrophobicContact CG1-CB 3.59Å; V17-N36 WeakPolarHBondContact CG1-OD1 3.29Å; C20-N36 PolarHBondContact SG-N 3.1Å; Y33-N36 PolarHBondContact N-O 2.85Å; Y33-N36 PolarHBondContact O-N 3.34Å; A34-N36 PolarHBondContact O-N 2.83Å; A34-N36 PolarHBondContact O-ND2 2.93Å; N36-V38 HydrophobicContact CB-CG1 4.47Å; N36-V38 PolarHBondContact O-N 3.09Å |
| 37 | C | 88 | Confident | 84.4 | Confident | 5 Ų | 5 | 64.7 Ų | 64.7 | 3% | 0.034 | 40% | 0.397 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.9 | 114.9 | 170.7 | -67.6 | 0 | 0 | 0 | 0 | 108.7 | S18 C20 C26 M31 | S18-C37 PolarHBondContact O-N 2.87Å; S18-C37 WeakPolarHBondContact OG-CB 3.5Å; S18-C37 PolarHBondContact OG-SG 2.97Å; C20-C37 VanDerWaalsContact CB-SG 3.59Å; C20-C37 PolarHBondContact SG-N 3.24Å; C20-C37 VanDerWaalsContact SG-N 3.43Å; C26-C37 WeakPolarHBondContact CA-SG 3.03Å; C26-C37 HydrophobicContact CB-CB 3.79Å; C26-C37 WeakPolarHBondContact CB-SG 3.46Å; C26-C37 WeakPolarHBondContact SG-CA 3.49Å; C26-C37 WeakPolarHBondContact SG-CB 2.91Å; C26-C37 CovalentContact SG-SG 2.04Å; C26-C37 PolarHBondContact SG-SG 3.37Å; M31-C37 WeakPolarHBondContact O-CA 3.5Å |
| 38 | V | 85.7 | Confident | 84.7 | Confident | 22 Ų | 22 | 65.6 Ų | 65.6 | 13% | 0.133 | 40% | 0.401 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.3 | 152 | 177.8 | -61.3 | 0 | 0 | 0 | 0 | 109.5 | Q30 M31 N36 A40 P69 V71 | Q30-V38 CarbonylContact C-O 3.5Å; Q30-V38 VanDerWaalsContact CA-O 3.24Å; Q30-V38 WeakPolarHBondContact CA-O 3.28Å; Q30-V38 WeakPolarHBondContact CB-O 3.38Å; M31-V38 HydrophobicContact CG-CG2 4.25Å; M31-V38 PolarHBondContact N-O 3.05Å; M31-V38 PolarHBondContact O-N 3.24Å; N36-V38 HydrophobicContact CB-CG1 4.47Å; N36-V38 PolarHBondContact O-N 3.09Å; V38-A40 PolarHBondContact O-N 3.27Å; V38-P69 HydrophobicContact CG2-CB 3.97Å; V38-V71 HydrophobicContact CB-CG2 3.56Å; V38-V71 HydrophobicContact CG1-CG2 3.76Å; V38-V71 HydrophobicContact CG2-CG2 3.63Å |
| 39 | P | 85.3 | Confident | 84.8 | Confident | 85 Ų | 85 | 65.5 Ų | 65.5 | 55% | 0.552 | 39% | 0.386 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -54 | 132.5 | 171.6 | -23.6 | 34.2 | 0 | 0 | 0 | 110.1 | A70 | P39-A70 HydrophobicContact CB-CB 4.31Å; P39-A70 WeakPolarHBondContact O-CB 3.39Å; P39-A70 PolarHBondContact O-N 2.88Å |
| 40 | A | 82.9 | Confident | 84.8 | Confident | 6 Ų | 6 | 63.6 Ų | 63.6 | 5% | 0.05 | 38% | 0.379 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111 | 147.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 109.8 | Q29 M31 V38 M67 V68 | Q29-A40 WeakPolarHBondContact CG-O 3.24Å; Q29-A40 PolarHBondContact O-N 2.92Å; M31-A40 HydrophobicContact CB-CB 3.93Å; M31-A40 HydrophobicContact CG-CB 3.87Å; M31-A40 HydrophobicContact SD-CB 4.25Å; V38-A40 PolarHBondContact O-N 3.27Å; A40-M67 HydrophobicContact CB-CB 4.27Å; A40-M67 HydrophobicContact CB-SD 4.34Å; A40-V68 CarbonylContact C-O 3.54Å; A40-V68 WeakPolarHBondContact CA-O 3.36Å |
| 41 | M | 83.8 | Confident | 84.5 | Confident | 100 Ų | 100 | 66.1 Ų | 66.1 | 49% | 0.493 | 40% | 0.402 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.1 | 146.3 | 172 | 61.4 | -179.1 | -176.3 | 0 | 0 | 110 | A43 M67 V68 A70 | M41-A43 PolarHBondContact O-N 3Å; M41-M67 WeakPolarHBondContact O-CA 3.41Å; M41-V68 HydrophobicContact CE-CG2 3.63Å; M41-V68 HydrophobicContact CG-CG2 3.52Å; M41-V68 PolarHBondContact N-O 2.92Å; M41-V68 WeakPolarHBondContact O-CG2 3.04Å; M41-V68 PolarHBondContact O-N 3.24Å; M41-V68 HydrophobicContact SD-CG2 4.45Å; M41-A70 HydrophobicContact CB-CB 4.26Å; M41-A70 HydrophobicContact CG-CB 4.16Å; M41-A70 HydrophobicContact SD-CB 4.38Å |
| 42 | P | 85.4 | Confident | 84.5 | Confident | 73 Ų | 73 | 70.4 Ų | 70.4 | 47% | 0.474 | 43% | 0.426 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.2 | 115.5 | 173.6 | 28 | -31.2 | 0 | 0 | 0 | 108.6 | G44 I65 | P42-G44 PolarHBondContact O-N 2.98Å; P42-I65 HydrophobicContact CB-CG2 4.29Å |
| 43 | A | 80.9 | Confident | 84.4 | Confident | 52 Ų | 52 | 70.2 Ų | 70.2 | 43% | 0.43 | 42% | 0.424 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -72 | -18.1 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112 | M41 C66 V68 | M41-A43 PolarHBondContact O-N 3Å; A43-C66 PolarHBondContact N-O 2.94Å; A43-V68 HydrophobicContact CB-CB 4.47Å; A43-V68 HydrophobicContact CB-CG1 3.74Å; A43-V68 HydrophobicContact CB-CG2 3.94Å |
| 44 | G | 78.9 | Confident | 84.3 | Confident | 45 Ų | 45 | 70.8 Ų | 70.8 | 46% | 0.464 | 43% | 0.43 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 99 | 153.7 | -173.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | P42 | P42-G44 PolarHBondContact O-N 2.98Å |
| 45 | G | 83.8 | Confident | 84 | Confident | 49 Ų | 49 | 71.6 Ų | 71.6 | 51% | 0.505 | 43% | 0.428 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 95.3 | 141.8 | -175.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | C66 | G45-C66 PolarHBondContact O-N 2.8Å; G45-C66 VanDerWaalsContact O-N 3.09Å |
| 46 | M | 85.3 | Confident | 83.4 | Confident | 172 Ų | 172 | 75.7 Ų | 75.7 | 85% | 0.847 | 44% | 0.44 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -89.2 | 142.6 | 173.5 | -62.5 | -178.9 | -65.9 | 0 | 0 | 109.3 | G64 | M46-G64 WeakPolarHBondContact CA-O 3.38Å |
| 47 | C | 88.4 | Confident | 82.5 | Confident | 9 Ų | 9 | 76.3 Ų | 76.3 | 6% | 0.061 | 44% | 0.444 | C | S | . | . | trans | -137.2 | 155 | -179.9 | 60.5 | 0 | 0 | 0 | 0 | 110.4 | N52 C53 C61 G64 I65 | C47-N52 HydrophobicContact CB-CB 3.64Å; C47-C53 WeakPolarHBondContact CB-SG 3.44Å; C47-C53 VanDerWaalsContact SG-SG 3.63Å; C47-C61 HydrophobicContact CB-CB 3.69Å; C47-C61 WeakPolarHBondContact CB-SG 3.3Å; C47-C61 PolarHBondContact O-SG 3.36Å; C47-C61 VanDerWaalsContact O-SG 3.34Å; C47-C61 WeakPolarHBondContact SG-CA 3.48Å; C47-C61 WeakPolarHBondContact SG-CB 3.47Å; C47-C61 CovalentContact SG-SG 2.03Å; C47-C61 PolarHBondContact SG-SG 2.9Å; C47-G64 PolarHBondContact N-O 3.21Å; C47-G64 CarbonylContact O-C 3.38Å; C47-G64 VanDerWaalsContact O-CA 3.29Å; C47-G64 WeakPolarHBondContact O-CA 3.34Å; C47-G64 VanDerWaalsContact SG-C 3.51Å; C47-I65 PolarHBondContact SG-N 3Å; C47-I65 VanDerWaalsContact SG-N 3.42Å; C47-I65 PolarHBondContact SG-O 2.98Å | ||
| 48 | I | 87.3 | Confident | 82 | Confident | 157 Ų | 157 | 77.3 Ų | 77.3 | 81% | 0.805 | 45% | 0.454 | S | S | * | . | S | Bend | trans | -110.5 | -37.8 | 169.5 | -57.6 | 174.6 | 0 | 0 | 0 | 108.8 | N52 | I48-N52 PolarHBondContact N-OD1 3.46Š|
| 49 | T | 84.3 | Confident | 81.9 | Confident | 74 Ų | 74 | 77.5 Ų | 77.5 | 45% | 0.454 | 45% | 0.454 | S | S | . | . | S | Bend | trans | -129.4 | 164.7 | 174.7 | 65.1 | 0 | 0 | 0 | 0 | 110.6 | S51 N52 C61 | T49-S51 PolarHBondContact O-N 3.43Å; T49-S51 VanDerWaalsContact O-N 3.08Å; T49-N52 PolarHBondContact N-OD1 2.97Å; T49-N52 VanDerWaalsContact N-OD1 3.1Å; T49-N52 WeakPolarHBondContact O-CB 3.5Å; T49-N52 PolarHBondContact O-N 2.88Å; T49-N52 PolarHBondContact O-OD1 3.13Å; T49-N52 PolarHBondContact OG1-OD1 2.04Å; T49-C61 VanDerWaalsContact C-CB 3.47Å; T49-C61 WeakPolarHBondContact O-CB 3.21Å |
| 50 | D | 81.7 | Confident | 81.8 | Confident | 79 Ų | 79 | 73.7 Ų | 73.7 | 42% | 0.422 | 43% | 0.43 | S | S | . | . | G | 310 helix | trans | -57.9 | -24 | 178.8 | -59.3 | -37.8 | 0 | 0 | 0 | 113.1 | N52 C53 T55 C61 | D50-N52 VanDerWaalsContact C-N 3.28Å; D50-N52 PolarHBondContact O-N 3.22Å; D50-C53 WeakPolarHBondContact O-CB 3.27Å; D50-C53 PolarHBondContact O-N 3.31Å; D50-C53 VanDerWaalsContact O-O 3.13Å; D50-T55 PolarHBondContact O-OG1 3.23Å; D50-C61 WeakPolarHBondContact OD1-CB 3.45Å; D50-C61 PolarHBondContact OD1-N 3.07Å |
| 51 | S | 80.6 | Confident | 82.1 | Confident | 104 Ų | 104 | 74.6 Ų | 74.6 | 73% | 0.727 | 44% | 0.435 | S | S | * | . | G | 310 helix | trans | -69.7 | -21.4 | 177.1 | -47.9 | 0 | 0 | 0 | 0 | 113.8 | T49 | T49-S51 PolarHBondContact O-N 3.43Å; T49-S51 VanDerWaalsContact O-N 3.08Å |
| 52 | N | 85.3 | Confident | 82.2 | Confident | 95 Ų | 95 | 71 Ų | 71 | 51% | 0.508 | 42% | 0.418 | S | S | . | . | G | 310 helix | trans | -74.3 | -16.7 | 170.9 | -65.1 | 102.4 | 0 | 0 | 0 | 112 | C47 I48 T49 D50 | C47-N52 HydrophobicContact CB-CB 3.64Å; I48-N52 PolarHBondContact N-OD1 3.46Å; T49-N52 PolarHBondContact N-OD1 2.97Å; T49-N52 VanDerWaalsContact N-OD1 3.1Å; T49-N52 WeakPolarHBondContact O-CB 3.5Å; T49-N52 PolarHBondContact O-N 2.88Å; T49-N52 PolarHBondContact O-OD1 3.13Å; T49-N52 PolarHBondContact OG1-OD1 2.04Å; D50-N52 VanDerWaalsContact C-N 3.28Å; D50-N52 PolarHBondContact O-N 3.22Å |
| 53 | C | 84.4 | Confident | 82.1 | Confident | 9 Ų | 9 | 73.1 Ų | 73.1 | 6% | 0.061 | 43% | 0.434 | C | S | . | . | S | Bend | trans | -100 | 161.2 | 177.5 | -54.8 | 0 | 0 | 0 | 0 | 110.4 | C47 D50 T55 Q59 C66 | C47-C53 WeakPolarHBondContact CB-SG 3.44Å; C47-C53 VanDerWaalsContact SG-SG 3.63Å; D50-C53 WeakPolarHBondContact O-CB 3.27Å; D50-C53 PolarHBondContact O-N 3.31Å; D50-C53 VanDerWaalsContact O-O 3.13Å; C53-T55 PolarHBondContact O-N 2.92Å; C53-T55 PolarHBondContact O-OG1 2.81Å; C53-Q59 HydrophobicContact CB-CB 3.77Å; C53-C66 WeakPolarHBondContact CA-SG 3.15Å; C53-C66 HydrophobicContact CB-CB 3.81Å; C53-C66 WeakPolarHBondContact CB-SG 3.22Å; C53-C66 WeakPolarHBondContact SG-CA 3.04Å; C53-C66 WeakPolarHBondContact SG-CB 3.36Å; C53-C66 CovalentContact SG-SG 2.04Å; C53-C66 PolarHBondContact SG-SG 2.87Å |
| 54 | E | 82.2 | Confident | 82.3 | Confident | 103 Ų | 103 | 72.2 Ų | 72.2 | 48% | 0.481 | 43% | 0.43 | S | S | . | . | trans | -76.7 | 76.7 | 177.5 | -160 | 171.3 | -166.5 | 0 | 0 | 110.6 | K56 N57 Q59 | E54-K56 PolarHBondContact O-N 3.19Å; E54-N57 HydrophobicContact CB-CB 4.47Å; E54-N57 HydrophobicContact CG-CB 4.36Å; E54-N57 PolarHBondContact O-N 2.85Å; E54-N57 PolarHBondContact OE2-ND2 3.21Å; E54-Q59 HydrophobicContact CB-CG 3.99Å; E54-Q59 VanDerWaalsContact CB-OE1 3.28Å; E54-Q59 VanDerWaalsContact O-CG 3.24Å; E54-Q59 WeakPolarHBondContact O-CG 3.4Å; E54-Q59 PolarHBondContact O-N 3.41Å | ||
| 55 | T | 76.4 | Confident | 82.7 | Confident | 87 Ų | 87 | 73.7 Ų | 73.7 | 53% | 0.534 | 43% | 0.427 | S | S | . | . | G | 310 helix | trans | -55.8 | -25 | -175.5 | -31.3 | 0 | 0 | 0 | 0 | 112.8 | D50 C53 N57 G58 | D50-T55 PolarHBondContact O-OG1 3.23Å; C53-T55 PolarHBondContact O-N 2.92Å; C53-T55 PolarHBondContact O-OG1 2.81Å; T55-N57 PolarHBondContact O-N 2.99Å; T55-G58 PolarHBondContact O-N 3.32Å; T55-G58 VanDerWaalsContact O-N 3.1Å |
| 56 | K | 73.3 | Confident | 82.9 | Confident | 200 Ų | 200 | 71.6 Ų | 71.6 | 87% | 0.87 | 40% | 0.404 | S | S | * | . | G | 310 helix | trans | -60.6 | -31 | 173.9 | -63.3 | -173.2 | -179.8 | -176.1 | 0 | 113.5 | E54 G58 | E54-K56 PolarHBondContact O-N 3.19Å; K56-G58 VanDerWaalsContact C-N 3.29Å |
| 57 | N | 69.7 | Low | 83 | Confident | 77 Ų | 77 | 64.4 Ų | 64.4 | 41% | 0.412 | 37% | 0.369 | S | S | . | . | G | 310 helix | trans | -93.1 | 13.5 | 178.4 | -68.3 | -1.9 | 0 | 0 | 0 | 112.1 | E54 T55 Q59 | E54-N57 HydrophobicContact CB-CB 4.47Å; E54-N57 HydrophobicContact CG-CB 4.36Å; E54-N57 PolarHBondContact O-N 2.85Å; E54-N57 PolarHBondContact OE2-ND2 3.21Å; T55-N57 PolarHBondContact O-N 2.99Å; N57-Q59 HydrophobicContact CB-CG 4.04Å; N57-Q59 PolarHBondContact O-N 2.86Å |
| 58 | G | 75.8 | Confident | 83 | Confident | 25 Ų | 25 | 64.7 Ų | 64.7 | 26% | 0.258 | 37% | 0.37 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 71.3 | 20.3 | -175.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | T55 K56 P69 | T55-G58 PolarHBondContact O-N 3.32Å; T55-G58 VanDerWaalsContact O-N 3.1Å; K56-G58 VanDerWaalsContact C-N 3.29Å; G58-P69 WeakPolarHBondContact O-CD 3.04Å |
| 59 | Q | 84 | Confident | 82.7 | Confident | 27 Ų | 27 | 57.9 Ų | 57.9 | 13% | 0.126 | 34% | 0.336 | C | S | . | . | trans | -77.6 | 140.6 | 174.5 | -41.2 | -158.2 | -154 | 0 | 0 | 110.7 | C53 E54 N57 M67 V68 | C53-Q59 HydrophobicContact CB-CB 3.77Å; E54-Q59 HydrophobicContact CB-CG 3.99Å; E54-Q59 VanDerWaalsContact CB-OE1 3.28Å; E54-Q59 VanDerWaalsContact O-CG 3.24Å; E54-Q59 WeakPolarHBondContact O-CG 3.4Å; E54-Q59 PolarHBondContact O-N 3.41Å; N57-Q59 HydrophobicContact CB-CG 4.04Å; N57-Q59 PolarHBondContact O-N 2.86Å; Q59-M67 CarbonylContact C-O 3.56Å; Q59-M67 VanDerWaalsContact CA-O 3.3Å; Q59-M67 WeakPolarHBondContact CA-O 3.24Å; Q59-V68 HydrophobicContact CB-CG1 3.73Å; Q59-V68 HydrophobicContact CG-CG1 3.25Å | ||
| 60 | A | 84.6 | Confident | 82.1 | Confident | 5 Ų | 5 | 56.3 Ų | 56.3 | 4% | 0.041 | 33% | 0.331 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.5 | 152.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | H23 M31 I62 M67 | H23-A60 VanDerWaalsContact CD2-CB 3.42Å; H23-A60 WeakPolarHBondContact CD2-CB 3.44Å; H23-A60 WeakPolarHBondContact NE2-CB 3.46Å; M31-A60 HydrophobicContact CE-CB 3.86Å; A60-I62 HydrophobicContact CB-CG1 4.36Å; A60-I62 PolarHBondContact O-N 3.12Å; A60-M67 PolarHBondContact N-O 2.67Å; A60-M67 PolarHBondContact O-N 2.72Å |
| 61 | C | 88.1 | Confident | 81.2 | Confident | 25 Ų | 25 | 55.2 Ų | 55.2 | 17% | 0.169 | 33% | 0.326 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.2 | 107.7 | 177.6 | -170 | 0 | 0 | 0 | 0 | 110.3 | C47 T49 D50 | C47-C61 HydrophobicContact CB-CB 3.69Å; C47-C61 WeakPolarHBondContact CB-SG 3.3Å; C47-C61 PolarHBondContact O-SG 3.36Å; C47-C61 VanDerWaalsContact O-SG 3.34Å; C47-C61 WeakPolarHBondContact SG-CA 3.48Å; C47-C61 WeakPolarHBondContact SG-CB 3.47Å; C47-C61 CovalentContact SG-SG 2.03Å; C47-C61 PolarHBondContact SG-SG 2.9Å; T49-C61 VanDerWaalsContact C-CB 3.47Å; T49-C61 WeakPolarHBondContact O-CB 3.21Å; D50-C61 WeakPolarHBondContact OD1-CB 3.45Å; D50-C61 PolarHBondContact OD1-N 3.07Å |
| 62 | I | 85.1 | Confident | 79.7 | Confident | 24 Ų | 24 | 56.8 Ų | 56.8 | 12% | 0.123 | 33% | 0.332 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.5 | 120.4 | -178.6 | -50.2 | -179.6 | 0 | 0 | 0 | 107.6 | H23 M31 A60 G64 I65 M67 | H23-I62 HydrophobicContact CB-CD1 4.17Å; H23-I62 HydrophobicContact CB-CG1 4.44Å; H23-I62 VanDerWaalsContact CD2-CD1 3.5Å; H23-I62 WeakPolarHBondContact CD2-CD1 2.92Å; M31-I62 HydrophobicContact CB-CD1 3.42Å; M31-I62 VanDerWaalsContact CB-CD1 3.42Å; A60-I62 HydrophobicContact CB-CG1 4.36Å; A60-I62 PolarHBondContact O-N 3.12Å; I62-G64 PolarHBondContact O-N 3.38Å; I62-I65 PolarHBondContact N-O 3.21Å; I62-I65 PolarHBondContact O-N 2.61Å; I62-M67 HydrophobicContact CB-CB 4.33Å; I62-M67 HydrophobicContact CB-CE 4.18Å; I62-M67 HydrophobicContact CB-CG 3.96Å; I62-M67 HydrophobicContact CB-SD 3.69Å; I62-M67 HydrophobicContact CD1-CB 3.88Å; I62-M67 HydrophobicContact CD1-CG 4.32Å; I62-M67 HydrophobicContact CD1-SD 4.02Å; I62-M67 HydrophobicContact CG1-CB 4.19Å; I62-M67 HydrophobicContact CG1-CG 4.38Å; I62-M67 HydrophobicContact CG1-SD 4.34Å; I62-M67 HydrophobicContact CG2-CE 4.26Å; I62-M67 HydrophobicContact CG2-SD 3.94Å |
| 63 | S | 83.1 | Confident | 77.9 | Confident | 117 Ų | 117 | 55.9 Ų | 55.9 | 82% | 0.818 | 33% | 0.33 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 55.9 | 33.2 | 178.8 | -54.7 | 0 | 0 | 0 | 0 | 114 | ||
| 64 | G | 86.3 | Confident | 75.9 | Confident | 33 Ų | 33 | 61.3 Ų | 61.3 | 34% | 0.34 | 37% | 0.365 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 84.9 | 3.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | M46 C47 I62 | M46-G64 WeakPolarHBondContact CA-O 3.38Å; C47-G64 PolarHBondContact N-O 3.21Å; C47-G64 CarbonylContact O-C 3.38Å; C47-G64 VanDerWaalsContact O-CA 3.29Å; C47-G64 WeakPolarHBondContact O-CA 3.34Å; C47-G64 VanDerWaalsContact SG-C 3.51Å; I62-G64 PolarHBondContact O-N 3.38Å |
| 65 | I | 87.2 | Confident | 74.1 | Confident | 77 Ų | 77 | 60.2 Ų | 60.2 | 40% | 0.395 | 37% | 0.373 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129 | 142.6 | -179.7 | -57.8 | 170.8 | 0 | 0 | 0 | 109 | P42 C47 I62 M67 | P42-I65 HydrophobicContact CB-CG2 4.29Å; C47-I65 PolarHBondContact SG-N 3Å; C47-I65 VanDerWaalsContact SG-N 3.42Å; C47-I65 PolarHBondContact SG-O 2.98Å; I62-I65 PolarHBondContact N-O 3.21Å; I62-I65 PolarHBondContact O-N 2.61Å; I65-M67 PolarHBondContact O-N 3.2Å |
| 66 | C | 88.4 | Confident | 72.8 | Confident | 4 Ų | 4 | 60.7 Ų | 60.7 | 3% | 0.027 | 38% | 0.378 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.1 | 115.1 | 175.8 | -65.4 | 0 | 0 | 0 | 0 | 110.8 | A43 G45 C53 | A43-C66 PolarHBondContact N-O 2.94Å; G45-C66 PolarHBondContact O-N 2.8Å; G45-C66 VanDerWaalsContact O-N 3.09Å; C53-C66 WeakPolarHBondContact CA-SG 3.15Å; C53-C66 HydrophobicContact CB-CB 3.81Å; C53-C66 WeakPolarHBondContact CB-SG 3.22Å; C53-C66 WeakPolarHBondContact SG-CA 3.04Å; C53-C66 WeakPolarHBondContact SG-CB 3.36Å; C53-C66 CovalentContact SG-SG 2.04Å; C53-C66 PolarHBondContact SG-SG 2.87Å |
| 67 | M | 86.7 | Confident | 71.5 | Confident | 22 Ų | 22 | 55.5 Ų | 55.5 | 11% | 0.108 | 37% | 0.373 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.9 | 149 | 176.9 | -62.8 | -164.1 | -175.9 | 0 | 0 | 110.7 | A40 M41 Q59 A60 I62 I65 | A40-M67 HydrophobicContact CB-CB 4.27Å; A40-M67 HydrophobicContact CB-SD 4.34Å; M41-M67 WeakPolarHBondContact O-CA 3.41Å; Q59-M67 CarbonylContact C-O 3.56Å; Q59-M67 VanDerWaalsContact CA-O 3.3Å; Q59-M67 WeakPolarHBondContact CA-O 3.24Å; A60-M67 PolarHBondContact N-O 2.67Å; A60-M67 PolarHBondContact O-N 2.72Å; I62-M67 HydrophobicContact CB-CB 4.33Å; I62-M67 HydrophobicContact CB-CE 4.18Å; I62-M67 HydrophobicContact CB-CG 3.96Å; I62-M67 HydrophobicContact CB-SD 3.69Å; I62-M67 HydrophobicContact CD1-CB 3.88Å; I62-M67 HydrophobicContact CD1-CG 4.32Å; I62-M67 HydrophobicContact CD1-SD 4.02Å; I62-M67 HydrophobicContact CG1-CB 4.19Å; I62-M67 HydrophobicContact CG1-CG 4.38Å; I62-M67 HydrophobicContact CG1-SD 4.34Å; I62-M67 HydrophobicContact CG2-CE 4.26Å; I62-M67 HydrophobicContact CG2-SD 3.94Å; I65-M67 PolarHBondContact O-N 3.2Å |
| 68 | V | 87.7 | Confident | 70.3 | Confident | 14 Ų | 14 | 57.3 Ų | 57.3 | 9% | 0.085 | 39% | 0.386 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.1 | 153.4 | 176.9 | -69.2 | 0 | 0 | 0 | 0 | 110.6 | A40 M41 A43 Q59 A70 | A40-V68 CarbonylContact C-O 3.54Å; A40-V68 WeakPolarHBondContact CA-O 3.36Å; M41-V68 HydrophobicContact CE-CG2 3.63Å; M41-V68 HydrophobicContact CG-CG2 3.52Å; M41-V68 PolarHBondContact N-O 2.92Å; M41-V68 WeakPolarHBondContact O-CG2 3.04Å; M41-V68 PolarHBondContact O-N 3.24Å; M41-V68 HydrophobicContact SD-CG2 4.45Å; A43-V68 HydrophobicContact CB-CB 4.47Å; A43-V68 HydrophobicContact CB-CG1 3.74Å; A43-V68 HydrophobicContact CB-CG2 3.94Å; Q59-V68 HydrophobicContact CB-CG1 3.73Å; Q59-V68 HydrophobicContact CG-CG1 3.25Å; V68-A70 PolarHBondContact O-N 2.86Å |
| 69 | P | 82.6 | Confident | 68.9 | Low | 15 Ų | 15 | 61.1 Ų | 61.1 | 10% | 0.097 | 41% | 0.407 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -62 | 126.2 | 174.2 | 25.6 | -32.5 | 0 | 0 | 0 | 108.6 | M31 Y33 V38 G58 V71 | M31-P69 HydrophobicContact SD-CB 4.21Å; M31-P69 WeakPolarHBondContact SD-CD 3.02Å; M31-P69 HydrophobicContact SD-CG 4.41Å; Y33-P69 HydrophobicContact CD1-CB 4.41Å; Y33-P69 HydrophobicContact CD2-CB 4.31Å; Y33-P69 HydrophobicContact CD2-CG 3.93Å; Y33-P69 HydrophobicContact CE2-CG 4.05Å; Y33-P69 HydrophobicContact CG-CB 4.11Å; Y33-P69 HydrophobicContact CG-CG 4.22Å; V38-P69 HydrophobicContact CG2-CB 3.97Å; G58-P69 WeakPolarHBondContact O-CD 3.04Å; P69-V71 HydrophobicContact CB-CB 4.31Å; P69-V71 HydrophobicContact CB-CG2 3.97Å; P69-V71 PolarHBondContact O-N 3.22Å |
| 70 | A | 71.9 | Confident | 67.5 | Low | 41 Ų | 41 | 64.8 Ų | 64.8 | 34% | 0.339 | 43% | 0.433 | S | S | . | . | trans | -75.9 | 7.9 | 169.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | P39 M41 V68 T72 | P39-A70 HydrophobicContact CB-CB 4.31Å; P39-A70 WeakPolarHBondContact O-CB 3.39Å; P39-A70 PolarHBondContact O-N 2.88Å; M41-A70 HydrophobicContact CB-CB 4.26Å; M41-A70 HydrophobicContact CG-CB 4.16Å; M41-A70 HydrophobicContact SD-CB 4.38Å; V68-A70 PolarHBondContact O-N 2.86Å; A70-T72 PolarHBondContact O-N 3.02Å | ||
| 71 | V | 62.3 | Low | 66 | Low | 55 Ų | 55 | 69.6 Ų | 69.6 | 33% | 0.333 | 46% | 0.464 | S | S | . | . | trans | -64.1 | 119 | 172.7 | -169 | 0 | 0 | 0 | 0 | 106.6 | V38 P69 T73 | V38-V71 HydrophobicContact CB-CG2 3.56Å; V38-V71 HydrophobicContact CG1-CG2 3.76Å; V38-V71 HydrophobicContact CG2-CG2 3.63Å; P69-V71 HydrophobicContact CB-CB 4.31Å; P69-V71 HydrophobicContact CB-CG2 3.97Å; P69-V71 PolarHBondContact O-N 3.22Å; V71-T73 HydrophobicContact CG1-CG2 4.3Å; V71-T73 PolarHBondContact O-N 2.82Å | ||
| 72 | T | 49.1 | Very low | 64.5 | Low | 138 Ų | 138 | 74.8 Ų | 74.8 | 85% | 0.847 | 50% | 0.495 | S | S | * | . | trans | -68.1 | 56.1 | 172.6 | 55 | 0 | 0 | 0 | 0 | 110.2 | A70 | A70-T72 PolarHBondContact O-N 3.02Š| ||
| 73 | T | 46.3 | Very low | 63.1 | Low | 76 Ų | 76 | 79 Ų | 79 | 47% | 0.466 | 52% | 0.516 | S | S | . | . | trans | -66.3 | 122.2 | 151.1 | 49.8 | 0 | 0 | 0 | 0 | 104.5 | V71 A75 | V71-T73 HydrophobicContact CG1-CG2 4.3Å; V71-T73 PolarHBondContact O-N 2.82Å; T73-A75 PolarHBondContact O-N 2.99Å | ||
| 74 | P | 43.1 | Very low | 61.5 | Low | 122 Ų | 122 | 77.6 Ų | 77.6 | 79% | 0.792 | 50% | 0.504 | S | S | * | . | trans | -48.2 | 120.7 | -179.6 | 19.2 | -29.9 | 0 | 0 | 0 | 106.4 | ||||
| 75 | A | 44 | Very low | 60 | Low | 80 Ų | 80 | 82.1 Ų | 82.1 | 66% | 0.661 | 53% | 0.527 | S | S | * | . | trans | -40.9 | 136.4 | 179.6 | 0 | 0 | 0 | 0 | 0 | 107.6 | T73 A77 | T73-A75 PolarHBondContact O-N 2.99Å; A75-A77 PolarHBondContact O-N 2.61Å | ||
| 76 | P | 48.6 | Very low | 58.4 | Low | 97 Ų | 97 | 85.2 Ų | 85.2 | 63% | 0.63 | 54% | 0.538 | S | S | * | . | trans | -46.8 | 115.6 | 178.1 | 19.8 | -30.8 | 0 | 0 | 0 | 105.3 | T78 | P76-T78 PolarHBondContact O-N 2.92Š| ||
| 77 | A | 46.8 | Very low | 56.6 | Low | 92 Ų | 92 | 89 Ų | 89 | 76% | 0.76 | 56% | 0.563 | S | S | * | * | trans | -59.8 | 91.7 | -177.3 | 0 | 0 | 0 | 0 | 0 | 104.8 | A75 P79 | A75-A77 PolarHBondContact O-N 2.61Å; A77-P79 WeakPolarHBondContact O-CD 3.39Å | ||
| 78 | T | 44 | Very low | 54.9 | Low | 114 Ų | 114 | 95.8 Ų | 95.8 | 70% | 0.699 | 60% | 0.598 | S | S | * | * | trans | -49.7 | 117.7 | 158.6 | 45.7 | 0 | 0 | 0 | 0 | 101.8 | P76 P80 | P76-T78 PolarHBondContact O-N 2.92Å; T78-P80 VanDerWaalsContact O-N 3.08Å | ||
| 79 | P | 47.3 | Very low | 53.3 | Low | 106 Ų | 106 | 102.5 Ų | 102.5 | 69% | 0.688 | 63% | 0.626 | S | S | * | * | trans | -46.9 | 131.3 | 176.1 | 18.9 | -30 | 0 | 0 | 0 | 105.2 | A77 | A77-P79 WeakPolarHBondContact O-CD 3.39Š| ||
| 80 | P | 53.4 | Low | 51.6 | Low | 103 Ų | 103 | 106.6 Ų | 106.6 | 67% | 0.669 | 65% | 0.653 | S | S | * | * | trans | -44 | 136.1 | -176 | 19 | -32 | 0 | 0 | 0 | 106.8 | T78 V82 | T78-P80 VanDerWaalsContact O-N 3.08Å; P80-V82 PolarHBondContact O-N 3.25Å | ||
| 81 | P | 54.9 | Low | 50.4 | Low | 106 Ų | 106 | 110.1 Ų | 110.1 | 69% | 0.688 | 67% | 0.672 | S | S | * | * | trans | -44.1 | 123.4 | -179.4 | 20.7 | -32.6 | 0 | 0 | 0 | 105.6 | I83 | P81-I83 WeakPolarHBondContact O-CG1 3.2Å; P81-I83 PolarHBondContact O-N 2.72Å | ||
| 82 | V | 54.7 | Low | 50 | Low | 135 Ų | 135 | 113 Ų | 113 | 82% | 0.818 | 68% | 0.684 | S | S | * | * | trans | -59.4 | 97 | 178.4 | 175.9 | 0 | 0 | 0 | 0 | 103.4 | P80 P84 | P80-V82 PolarHBondContact O-N 3.25Å; V82-P84 WeakPolarHBondContact O-CD 3.38Å | ||
| 83 | I | 55.8 | Low | 50 | Low | 113 Ų | 113 | 112.6 Ų | 112.6 | 58% | 0.579 | 68% | 0.684 | S | S | * | * | trans | -58.6 | 111.6 | 177.1 | -65.4 | 179.8 | 0 | 0 | 0 | 100.6 | P81 F86 | P81-I83 WeakPolarHBondContact O-CG1 3.2Å; P81-I83 PolarHBondContact O-N 2.72Å; I83-F86 HydrophobicContact CG2-CD2 3.42Å; I83-F86 VanDerWaalsContact CG2-CD2 3.42Å; I83-F86 HydrophobicContact CG2-CE2 3.81Å | ||
| 84 | P | 50.8 | Low | 50.2 | Low | 86 Ų | 86 | 112.4 Ų | 112.4 | 56% | 0.558 | 70% | 0.698 | S | S | * | * | trans | -50.1 | 136.4 | 172.4 | 23.7 | -32.4 | 0 | 0 | 0 | 104.8 | V82 F86 | V82-P84 WeakPolarHBondContact O-CD 3.38Å; P84-F86 HydrophobicContact CG-CE2 4.35Å; P84-F86 WeakPolarHBondContact O-CD2 3.42Å; P84-F86 PolarHBondContact O-N 2.58Å | ||
| 85 | P | 54.7 | Low | 50.6 | Low | 128 Ų | 128 | 112.4 Ų | 112.4 | 83% | 0.831 | 69% | 0.69 | S | S | * | * | trans | -53.5 | 96.9 | -175.7 | 21.7 | -32.4 | 0 | 0 | 0 | 107.3 | ||||
| 86 | F | 52.9 | Low | 51.1 | Low | 142 Ų | 142 | 116.2 Ų | 116.2 | 62% | 0.623 | 69% | 0.694 | S | S | * | * | trans | -60.7 | 134.1 | 169.9 | -87 | -87.6 | 0 | 0 | 0 | 102.5 | I83 P84 I88 | I83-F86 HydrophobicContact CG2-CD2 3.42Å; I83-F86 VanDerWaalsContact CG2-CD2 3.42Å; I83-F86 HydrophobicContact CG2-CE2 3.81Å; P84-F86 HydrophobicContact CG-CE2 4.35Å; P84-F86 WeakPolarHBondContact O-CD2 3.42Å; P84-F86 PolarHBondContact O-N 2.58Å; F86-I88 PolarHBondContact O-N 2.62Å | ||
| 87 | P | 51.7 | Low | 51.8 | Low | 83 Ų | 83 | 117.5 Ų | 117.5 | 54% | 0.539 | 70% | 0.695 | S | S | . | * | trans | -47 | 125.8 | 174.1 | 20.2 | -30.8 | 0 | 0 | 0 | 106 | F89 | P87-F89 HydrophobicContact CB-CE2 4.39Å; P87-F89 HydrophobicContact CB-CZ 4.48Å; P87-F89 HydrophobicContact CG-CD2 4.14Å; P87-F89 HydrophobicContact CG-CE2 3.52Å; P87-F89 HydrophobicContact CG-CZ 3.74Å; P87-F89 VanDerWaalsContact O-CD2 3.24Å; P87-F89 WeakPolarHBondContact O-CD2 3.24Å; P87-F89 PolarHBondContact O-N 2.98Å | ||
| 88 | I | 50.9 | Low | 53 | Low | 166 Ų | 166 | 116.9 Ų | 116.9 | 85% | 0.851 | 68% | 0.677 | S | S | * | * | trans | -63.5 | 82.2 | -179.4 | -54.7 | 162.3 | 0 | 0 | 0 | 104.5 | F86 | F86-I88 PolarHBondContact O-N 2.62Š| ||
| 89 | F | 53.8 | Low | 54.6 | Low | 155 Ų | 155 | 118.8 Ų | 118.8 | 68% | 0.68 | 67% | 0.672 | S | S | * | * | trans | -62 | 130.6 | 169.6 | -72.4 | -70.6 | 0 | 0 | 0 | 104.1 | P87 | P87-F89 HydrophobicContact CB-CE2 4.39Å; P87-F89 HydrophobicContact CB-CZ 4.48Å; P87-F89 HydrophobicContact CG-CD2 4.14Å; P87-F89 HydrophobicContact CG-CE2 3.52Å; P87-F89 HydrophobicContact CG-CZ 3.74Å; P87-F89 VanDerWaalsContact O-CD2 3.24Å; P87-F89 WeakPolarHBondContact O-CD2 3.24Å; P87-F89 PolarHBondContact O-N 2.98Å | ||
| 90 | P | 45.8 | Very low | 56.2 | Low | 100 Ų | 100 | 113.8 Ų | 113.8 | 65% | 0.649 | 64% | 0.64 | S | S | * | * | trans | -48.5 | 134.8 | -177.3 | 20.6 | -32.6 | 0 | 0 | 0 | 108.2 | I92 | P90-I92 PolarHBondContact O-N 3.3Š| ||
| 91 | P | 47.6 | Very low | 57.5 | Low | 116 Ų | 116 | 114.5 Ų | 114.5 | 75% | 0.753 | 64% | 0.638 | S | S | * | * | trans | -53.1 | 110.6 | -178.6 | 22.1 | -32.7 | 0 | 0 | 0 | 107.3 | P93 | P91-P93 WeakPolarHBondContact O-CD 3.25Å; P91-P93 VanDerWaalsContact O-N 3.07Å | ||
| 92 | I | 53.8 | Low | 58.7 | Low | 114 Ų | 114 | 116.5 Ų | 116.5 | 59% | 0.585 | 64% | 0.642 | S | S | * | * | trans | -65.9 | 113 | 178.5 | -38.5 | 163.2 | 0 | 0 | 0 | 104.2 | P90 G94 L95 | P90-I92 PolarHBondContact O-N 3.3Å; I92-G94 PolarHBondContact O-N 3.11Å; I92-L95 HydrophobicContact CB-CB 4.45Å; I92-L95 HydrophobicContact CD1-CD1 3.67Å; I92-L95 PolarHBondContact O-N 3.44Å | ||
| 93 | P | 48.1 | Very low | 59.8 | Low | 130 Ų | 130 | 113.4 Ų | 113.4 | 84% | 0.844 | 62% | 0.621 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.3 | 115.5 | -177.1 | -21.6 | 33.4 | 0 | 0 | 0 | 108.6 | P91 | P91-P93 WeakPolarHBondContact O-CD 3.25Å; P91-P93 VanDerWaalsContact O-N 3.07Å |
| 94 | G | 52 | Low | 61.1 | Low | 73 Ų | 73 | 111.5 Ų | 111.5 | 75% | 0.753 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 110 | -5.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 116.9 | I92 Q96 | I92-G94 PolarHBondContact O-N 3.11Å; G94-Q96 VanDerWaalsContact C-N 3.25Å; G94-Q96 PolarHBondContact O-N 2.84Å; G94-Q96 VanDerWaalsContact O-N 3.08Å |
| 95 | L | 50.3 | Low | 62.7 | Low | 122 Ų | 122 | 109.6 Ų | 109.6 | 64% | 0.639 | 60% | 0.596 | S | S | * | * | trans | -88.6 | 61.8 | 176.1 | -133.5 | 156.4 | 0 | 0 | 0 | 111 | I92 L97 | I92-L95 HydrophobicContact CB-CB 4.45Å; I92-L95 HydrophobicContact CD1-CD1 3.67Å; I92-L95 PolarHBondContact O-N 3.44Å; L95-L97 PolarHBondContact O-N 2.86Å | ||
| 96 | Q | 55.7 | Low | 63.9 | Low | 159 Ų | 159 | 108.8 Ų | 108.8 | 74% | 0.743 | 59% | 0.585 | S | S | * | * | trans | -82.3 | 107.2 | 170.6 | -57.4 | -73.7 | -94.1 | 0 | 0 | 107.4 | G94 Q98 | G94-Q96 VanDerWaalsContact C-N 3.25Å; G94-Q96 PolarHBondContact O-N 2.84Å; G94-Q96 VanDerWaalsContact O-N 3.08Å; Q96-Q98 PolarHBondContact O-N 3.48Å | ||
| 97 | L | 62.1 | Low | 65.3 | Low | 125 Ų | 125 | 104.4 Ų | 104.4 | 65% | 0.654 | 57% | 0.571 | S | S | * | * | trans | -70.4 | 86.6 | 173.3 | -168.6 | 72 | 0 | 0 | 0 | 108.4 | L95 L118 | L95-L97 PolarHBondContact O-N 2.86Å; L97-L118 HydrophobicContact CD1-CD2 4.08Å; L97-L118 HydrophobicContact CD2-CD2 4.28Å; L97-L118 HydrophobicContact CG-CD2 3.99Å | ||
| 98 | Q | 72.5 | Confident | 66.7 | Low | 78 Ų | 78 | 100.6 Ų | 100.6 | 36% | 0.364 | 55% | 0.547 | S | S | . | . | trans | -87.5 | 136.3 | -176 | -177.7 | 67.3 | -48.3 | 0 | 0 | 110.5 | Q96 C119 | Q96-Q98 PolarHBondContact O-N 3.48Å; Q98-C119 HydrophobicContact CB-CB 4.13Å; Q98-C119 HydrophobicContact CG-CB 4.49Å; Q98-C119 VanDerWaalsContact O-CB 3.25Å; Q98-C119 WeakPolarHBondContact O-CB 3.2Å; Q98-C119 PolarHBondContact O-N 3.38Å; Q98-C119 PolarHBondContact O-SG 3Å | ||
| 99 | Y | 78.7 | Confident | 68.2 | Low | 154 Ų | 154 | 96.3 Ų | 96.3 | 60% | 0.604 | 53% | 0.529 | S | S | * | . | B | Isolated β-bridge | trans | -102.9 | 151.4 | 175.7 | 19.6 | -94.1 | 0 | 0 | 0 | 110.9 | F117 | Y99-F117 CarbonylContact C-O 3.47Å; Y99-F117 WeakPolarHBondContact CA-O 3.12Å; Y99-F117 WeakPolarHBondContact CB-O 3.45Å |
| 100 | C | 80.9 | Confident | 69.6 | Low | 2 Ų | 2 | 91 Ų | 91 | 1% | 0.014 | 52% | 0.519 | C | S | . | . | trans | -117.2 | 128.7 | -178.8 | 36.2 | 0 | 0 | 0 | 0 | 109.3 | C114 F117 L118 | C100-C114 HydrophobicContact CB-CB 3.5Å; C100-C114 WeakPolarHBondContact CB-SG 3Å; C100-C114 WeakPolarHBondContact SG-CA 2.99Å; C100-C114 WeakPolarHBondContact SG-CB 2.87Å; C100-C114 CovalentContact SG-SG 1.98Å; C100-C114 PolarHBondContact SG-SG 3.36Å; C100-F117 PolarHBondContact N-O 2.94Å; C100-F117 PolarHBondContact SG-O 3.36Å; C100-F117 VanDerWaalsContact SG-O 3.4Å; C100-L118 PolarHBondContact SG-N 2.03Å | ||
| 101 | L | 79.8 | Confident | 71.5 | Confident | 118 Ų | 118 | 92.2 Ų | 92.2 | 62% | 0.618 | 52% | 0.516 | S | S | * | . | G | 310 helix | trans | -79.7 | 145 | 179.1 | -75.6 | 78.1 | 0 | 0 | 0 | 109.9 | N103 N104 | L101-N103 PolarHBondContact O-N 3.45Å; L101-N104 WeakPolarHBondContact O-CB 3.3Å; L101-N104 PolarHBondContact O-N 3.49Å |
| 102 | D | 79.2 | Confident | 73.2 | Confident | 147 Ų | 147 | 89.2 Ų | 89.2 | 79% | 0.786 | 49% | 0.492 | S | S | * | . | G | 310 helix | trans | 54.7 | 27.8 | 174.5 | -56.8 | -61.8 | 0 | 0 | 0 | 115 | N104 | D102-N104 PolarHBondContact O-N 3.4Š|
| 103 | N | 79.1 | Confident | 74.8 | Confident | 71 Ų | 71 | 83.9 Ų | 83.9 | 38% | 0.38 | 46% | 0.464 | S | S | . | . | G | 310 helix | trans | 55.1 | 25.5 | -171.5 | -72.2 | -80.7 | 0 | 0 | 0 | 114.4 | L101 H105 C114 | L101-N103 PolarHBondContact O-N 3.45Å; N103-H105 PolarHBondContact O-N 2.83Å; N103-C114 VanDerWaalsContact CA-SG 3.53Å |
| 104 | N | 82.3 | Confident | 76.6 | Confident | 73 Ų | 73 | 77.9 Ų | 77.9 | 39% | 0.39 | 43% | 0.426 | S | S | . | . | trans | -79.1 | 114 | -177.5 | -170.4 | -23.9 | 0 | 0 | 0 | 111.3 | L101 D102 N106 S107 | L101-N104 WeakPolarHBondContact O-CB 3.3Å; L101-N104 PolarHBondContact O-N 3.49Å; D102-N104 PolarHBondContact O-N 3.4Å; N104-N106 VanDerWaalsContact C-N 3.27Å; N104-N106 PolarHBondContact O-N 2.98Å; N104-N106 WeakPolarHBondContact OD1-CB 3.22Å; N104-N106 PolarHBondContact OD1-N 1.98Å; N104-S107 WeakPolarHBondContact O-CB 3.1Å; N104-S107 PolarHBondContact O-N 3.05Å; N104-S107 PolarHBondContact O-OG 3.34Å | ||
| 105 | H | 84.5 | Confident | 77.9 | Confident | 46 Ų | 46 | 76.5 Ų | 76.5 | 21% | 0.213 | 40% | 0.403 | C | S | . | . | G | 310 helix | trans | -70.2 | -21 | -179.3 | -48.4 | -70.9 | 0 | 0 | 0 | 113.5 | N103 S107 C108 I113 C114 A140 K142 | N103-H105 PolarHBondContact O-N 2.83Å; H105-S107 PolarHBondContact O-N 3.07Å; H105-C108 PolarHBondContact O-N 3.17Å; H105-I113 HydrophobicContact CB-CB 4.49Å; H105-C114 PolarHBondContact CE1-O 2.78Å; H105-C114 WeakPolarHBondContact ND1-CB 3.43Å; H105-C114 PolarHBondContact ND1-N 2.98Å; H105-C114 VanDerWaalsContact ND1-N 3.15Å; H105-C114 PolarHBondContact ND1-O 3.08Å; H105-C114 VanDerWaalsContact ND1-O 3.07Å; H105-A140 HydrophobicContact CB-CB 4.18Å; H105-A140 WeakPolarHBondContact CD2-CB 3.46Å; H105-A140 VanDerWaalsContact CG-CB 3.44Å; H105-A140 WeakPolarHBondContact NE2-CB 3.47Å; H105-K142 WeakPolarHBondContact O-CE 3.34Å; H105-K142 PolarHBondContact O-NZ 3.07Å |
| 106 | N | 80.2 | Confident | 79.4 | Confident | 111 Ų | 111 | 79 Ų | 79 | 59% | 0.594 | 41% | 0.409 | S | S | * | . | G | 310 helix | trans | -72.3 | -18.7 | 175.2 | -65.8 | -35.3 | 0 | 0 | 0 | 112.4 | N104 C108 | N104-N106 VanDerWaalsContact C-N 3.27Å; N104-N106 PolarHBondContact O-N 2.98Å; N104-N106 WeakPolarHBondContact OD1-CB 3.22Å; N104-N106 PolarHBondContact OD1-N 1.98Å; N106-C108 VanDerWaalsContact C-N 3.26Å; N106-C108 PolarHBondContact O-N 2.89Å |
| 107 | S | 82.3 | Confident | 80.7 | Confident | 49 Ų | 49 | 77 Ų | 77 | 34% | 0.343 | 40% | 0.397 | S | S | . | . | G | 310 helix | trans | -69.6 | -23.4 | 175.7 | -57.9 | 0 | 0 | 0 | 0 | 113.1 | N104 H105 | N104-S107 WeakPolarHBondContact O-CB 3.1Å; N104-S107 PolarHBondContact O-N 3.05Å; N104-S107 PolarHBondContact O-OG 3.34Å; H105-S107 PolarHBondContact O-N 3.07Å |
| 108 | C | 82.1 | Confident | 81.6 | Confident | 3 Ų | 3 | 73.7 Ų | 73.7 | 2% | 0.02 | 38% | 0.38 | C | S | . | . | S | Bend | trans | -82 | 130.4 | 177.4 | -58.6 | 0 | 0 | 0 | 0 | 110.6 | H105 N106 Q112 C119 K142 | H105-C108 PolarHBondContact O-N 3.17Å; N106-C108 VanDerWaalsContact C-N 3.26Å; N106-C108 PolarHBondContact O-N 2.89Å; C108-Q112 HydrophobicContact CB-CB 3.62Å; C108-C119 WeakPolarHBondContact CA-SG 3.37Å; C108-C119 HydrophobicContact CB-CB 3.65Å; C108-C119 WeakPolarHBondContact CB-SG 3.31Å; C108-C119 WeakPolarHBondContact SG-CA 3.49Å; C108-C119 WeakPolarHBondContact SG-CB 3.35Å; C108-C119 CovalentContact SG-SG 2.03Å; C108-C119 PolarHBondContact SG-SG 2.89Å; C108-K142 PolarHBondContact O-NZ 3.29Å |
| 109 | P | 80.9 | Confident | 82.1 | Confident | 76 Ų | 76 | 70.6 Ų | 70.6 | 49% | 0.494 | 37% | 0.367 | S | S | . | . | trans | -73.1 | 148.1 | 178.5 | 29 | -34.1 | 0 | 0 | 0 | 112 | Q112 | P109-Q112 WeakPolarHBondContact O-CG 2.99Å; P109-Q112 PolarHBondContact O-OE1 3.23Å | ||
| 110 | G | 83.8 | Confident | 82.3 | Confident | 45 Ų | 45 | 67.5 Ų | 67.5 | 46% | 0.464 | 36% | 0.357 | S | S | . | . | S | Bend | trans | 60.5 | -143.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | Q112 K142 F143 | G110-Q112 PolarHBondContact O-N 2.83Å; G110-K142 WeakPolarHBondContact O-CE 3.43Å; G110-K142 PolarHBondContact O-NZ 3.06Å; G110-F143 WeakPolarHBondContact O-CE2 3.12Å |
| 111 | Q | 84.8 | Confident | 82.4 | Confident | 125 Ų | 125 | 70.9 Ų | 70.9 | 58% | 0.584 | 38% | 0.379 | S | S | * | . | S | Bend | trans | -82.9 | 53 | -175.2 | -60.2 | -170.2 | 20 | 0 | 0 | 112.1 | A122 W147 | Q111-A122 PolarHBondContact O-N 3.21Å; Q111-W147 HydrophobicContact CB-CE3 4.4Å; Q111-W147 HydrophobicContact CB-CH2 3.91Å; Q111-W147 HydrophobicContact CB-CZ3 3.52Å; Q111-W147 HydrophobicContact CG-CH2 3.52Å; Q111-W147 HydrophobicContact CG-CZ3 3.67Å |
| 112 | Q | 85.3 | Confident | 82.6 | Confident | 52 Ų | 52 | 65.4 Ų | 65.4 | 24% | 0.243 | 35% | 0.351 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126 | 146.8 | -178.6 | -66.9 | 179.1 | -14.6 | 0 | 0 | 110.8 | C108 P109 G110 C119 F120 K142 | C108-Q112 HydrophobicContact CB-CB 3.62Å; P109-Q112 WeakPolarHBondContact O-CG 2.99Å; P109-Q112 PolarHBondContact O-OE1 3.23Å; G110-Q112 PolarHBondContact O-N 2.83Å; Q112-C119 HydrophobicContact CB-CB 4.34Å; Q112-F120 CarbonylContact C-O 3.56Å; Q112-F120 WeakPolarHBondContact CA-O 3.19Å; Q112-F120 WeakPolarHBondContact CB-O 3.33Å; Q112-K142 PolarHBondContact O-NZ 3.28Å |
| 113 | I | 86.3 | Confident | 82.8 | Confident | 2 Ų | 2 | 63.8 Ų | 63.8 | 1% | 0.01 | 34% | 0.338 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123 | 148.9 | 172.6 | 69.9 | -179.7 | 0 | 0 | 0 | 110.5 | H105 V115 F120 A122 A140 W147 A149 | H105-I113 HydrophobicContact CB-CB 4.49Å; I113-V115 HydrophobicContact CD1-CG2 4.17Å; I113-V115 HydrophobicContact CG1-CG2 3.84Å; I113-V115 PolarHBondContact O-N 2.92Å; I113-F120 PolarHBondContact N-O 3.43Å; I113-F120 PolarHBondContact O-N 3.09Å; I113-A122 HydrophobicContact CB-CB 4.19Å; I113-A122 HydrophobicContact CD1-CB 4.08Å; I113-A122 HydrophobicContact CG1-CB 3.86Å; I113-A122 HydrophobicContact CG2-CB 3.61Å; I113-A140 HydrophobicContact CB-CB 4.19Å; I113-A140 HydrophobicContact CD1-CB 4.33Å; I113-A140 HydrophobicContact CG2-CB 3.95Å; I113-W147 HydrophobicContact CG2-CB 3.52Å; I113-W147 HydrophobicContact CG2-CG 4.27Å; I113-A149 HydrophobicContact CD1-CB 3.99Å; I113-A149 VanDerWaalsContact CD1-N 3.33Å; I113-A149 HydrophobicContact CG1-CB 4.39Å |
| 114 | C | 85.2 | Confident | 83.1 | Confident | 4 Ų | 4 | 63.4 Ų | 63.4 | 3% | 0.027 | 34% | 0.34 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -71.7 | 120.6 | 172.7 | -168.1 | 0 | 0 | 0 | 0 | 111.6 | C100 N103 H105 L118 | C100-C114 HydrophobicContact CB-CB 3.5Å; C100-C114 WeakPolarHBondContact CB-SG 3Å; C100-C114 WeakPolarHBondContact SG-CA 2.99Å; C100-C114 WeakPolarHBondContact SG-CB 2.87Å; C100-C114 CovalentContact SG-SG 1.98Å; C100-C114 PolarHBondContact SG-SG 3.36Å; N103-C114 VanDerWaalsContact CA-SG 3.53Å; H105-C114 PolarHBondContact CE1-O 2.78Å; H105-C114 WeakPolarHBondContact ND1-CB 3.43Å; H105-C114 PolarHBondContact ND1-N 2.98Å; H105-C114 VanDerWaalsContact ND1-N 3.15Å; H105-C114 PolarHBondContact ND1-O 3.08Å; H105-C114 VanDerWaalsContact ND1-O 3.07Å; C114-L118 CarbonylContact C-O 3.6Å; C114-L118 WeakPolarHBondContact CA-O 3.44Å |
| 115 | V | 81.2 | Confident | 83 | Confident | 45 Ų | 45 | 62 Ų | 62 | 27% | 0.273 | 34% | 0.339 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.4 | 122 | 170.8 | -165.4 | 0 | 0 | 0 | 0 | 107.4 | I113 F117 L118 F120 A149 | I113-V115 HydrophobicContact CD1-CG2 4.17Å; I113-V115 HydrophobicContact CG1-CG2 3.84Å; I113-V115 PolarHBondContact O-N 2.92Å; V115-F117 VanDerWaalsContact C-N 3.3Å; V115-F117 PolarHBondContact O-N 2.88Å; V115-L118 PolarHBondContact N-O 3.2Å; V115-L118 PolarHBondContact O-N 2.98Å; V115-F120 HydrophobicContact CB-CD2 3.86Å; V115-F120 HydrophobicContact CB-CE2 4.35Å; V115-F120 HydrophobicContact CG2-CD2 4.19Å; V115-A149 HydrophobicContact CG2-CB 4.14Å |
| 116 | F | 81.5 | Confident | 82.8 | Confident | 174 Ų | 174 | 62.9 Ų | 62.9 | 76% | 0.763 | 36% | 0.36 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.6 | 48.6 | -176.1 | -67.8 | -74.9 | 0 | 0 | 0 | 113 | L118 | F116-L118 PolarHBondContact O-N 3.42Å; F116-L118 VanDerWaalsContact O-N 3.11Å |
| 117 | F | 81.7 | Confident | 83.1 | Confident | 116 Ų | 116 | 63.1 Ų | 63.1 | 51% | 0.509 | 36% | 0.356 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 63.7 | 7.8 | -178.3 | -54.7 | -84.4 | 0 | 0 | 0 | 116 | Y99 C100 V115 | Y99-F117 CarbonylContact C-O 3.47Å; Y99-F117 WeakPolarHBondContact CA-O 3.12Å; Y99-F117 WeakPolarHBondContact CB-O 3.45Å; C100-F117 PolarHBondContact N-O 2.94Å; C100-F117 PolarHBondContact SG-O 3.36Å; C100-F117 VanDerWaalsContact SG-O 3.4Å; V115-F117 VanDerWaalsContact C-N 3.3Å; V115-F117 PolarHBondContact O-N 2.88Å |
| 118 | L | 81 | Confident | 83.4 | Confident | 56 Ų | 56 | 64.7 Ų | 64.7 | 29% | 0.293 | 37% | 0.367 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.2 | 139.3 | 178.3 | -71.2 | 161.1 | 0 | 0 | 0 | 110.7 | L97 C100 C114 V115 F116 F120 | L97-L118 HydrophobicContact CD1-CD2 4.08Å; L97-L118 HydrophobicContact CD2-CD2 4.28Å; L97-L118 HydrophobicContact CG-CD2 3.99Å; C100-L118 PolarHBondContact SG-N 2.03Å; C114-L118 CarbonylContact C-O 3.6Å; C114-L118 WeakPolarHBondContact CA-O 3.44Å; V115-L118 PolarHBondContact N-O 3.2Å; V115-L118 PolarHBondContact O-N 2.98Å; F116-L118 PolarHBondContact O-N 3.42Å; F116-L118 VanDerWaalsContact O-N 3.11Å; L118-F120 HydrophobicContact CB-CD2 4.02Å; L118-F120 HydrophobicContact CB-CE2 3.51Å; L118-F120 HydrophobicContact CB-CZ 4.2Å; L118-F120 HydrophobicContact CD1-CE2 4.18Å; L118-F120 HydrophobicContact CD1-CZ 4.26Å; L118-F120 PolarHBondContact O-N 3.15Å |
| 119 | C | 82.7 | Confident | 83.7 | Confident | 14 Ų | 14 | 65 Ų | 65 | 10% | 0.095 | 37% | 0.369 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.4 | 107.4 | 175 | -66.6 | 0 | 0 | 0 | 0 | 110.1 | Q98 C108 Q112 | Q98-C119 HydrophobicContact CB-CB 4.13Å; Q98-C119 HydrophobicContact CG-CB 4.49Å; Q98-C119 VanDerWaalsContact O-CB 3.25Å; Q98-C119 WeakPolarHBondContact O-CB 3.2Å; Q98-C119 PolarHBondContact O-N 3.38Å; Q98-C119 PolarHBondContact O-SG 3Å; C108-C119 WeakPolarHBondContact CA-SG 3.37Å; C108-C119 HydrophobicContact CB-CB 3.65Å; C108-C119 WeakPolarHBondContact CB-SG 3.31Å; C108-C119 WeakPolarHBondContact SG-CA 3.49Å; C108-C119 WeakPolarHBondContact SG-CB 3.35Å; C108-C119 CovalentContact SG-SG 2.03Å; C108-C119 PolarHBondContact SG-SG 2.89Å; Q112-C119 HydrophobicContact CB-CB 4.34Å |
| 120 | F | 83.9 | Confident | 83.9 | Confident | 89 Ų | 89 | 67.6 Ų | 67.6 | 39% | 0.39 | 38% | 0.384 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.2 | 144.9 | 175.2 | -75.6 | -82.9 | 0 | 0 | 0 | 111 | Q112 I113 V115 L118 A122 | Q112-F120 CarbonylContact C-O 3.56Å; Q112-F120 WeakPolarHBondContact CA-O 3.19Å; Q112-F120 WeakPolarHBondContact CB-O 3.33Å; I113-F120 PolarHBondContact N-O 3.43Å; I113-F120 PolarHBondContact O-N 3.09Å; V115-F120 HydrophobicContact CB-CD2 3.86Å; V115-F120 HydrophobicContact CB-CE2 4.35Å; V115-F120 HydrophobicContact CG2-CD2 4.19Å; L118-F120 HydrophobicContact CB-CD2 4.02Å; L118-F120 HydrophobicContact CB-CE2 3.51Å; L118-F120 HydrophobicContact CB-CZ 4.2Å; L118-F120 HydrophobicContact CD1-CE2 4.18Å; L118-F120 HydrophobicContact CD1-CZ 4.26Å; L118-F120 PolarHBondContact O-N 3.15Å; F120-A122 PolarHBondContact O-N 3.4Å |
| 121 | P | 82.7 | Confident | 83.9 | Confident | 72 Ų | 72 | 68.9 Ų | 68.9 | 47% | 0.468 | 38% | 0.38 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -57.7 | 137.1 | 170.2 | 27 | -33.8 | 0 | 0 | 0 | 109.5 | A150 | P121-A150 WeakPolarHBondContact O-CB 3.19Å; P121-A150 PolarHBondContact O-N 3.47Å |
| 122 | A | 84.6 | Confident | 83.6 | Confident | 4 Ų | 4 | 65.4 Ų | 65.4 | 3% | 0.033 | 37% | 0.373 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.5 | 155.4 | -177.4 | 0 | 0 | 0 | 0 | 0 | 109.9 | Q111 I113 F120 W147 R148 | Q111-A122 PolarHBondContact O-N 3.21Å; I113-A122 HydrophobicContact CB-CB 4.19Å; I113-A122 HydrophobicContact CD1-CB 4.08Å; I113-A122 HydrophobicContact CG1-CB 3.86Å; I113-A122 HydrophobicContact CG2-CB 3.61Å; F120-A122 PolarHBondContact O-N 3.4Å; A122-W147 HydrophobicContact CB-CB 4.09Å; A122-W147 HydrophobicContact CB-CE3 3.96Å; A122-W147 WeakPolarHBondContact O-CZ3 3.48Å; A122-R148 CarbonylContact C-O 3.59Å; A122-R148 WeakPolarHBondContact CA-O 3.46Å; A122-R148 VanDerWaalsContact CB-O 3.28Å; A122-R148 WeakPolarHBondContact CB-O 3.42Å |
| 123 | Q | 82.9 | Confident | 83.4 | Confident | 112 Ų | 112 | 68.4 Ų | 68.4 | 52% | 0.523 | 40% | 0.4 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.3 | 144.5 | 175.4 | -69.3 | 174.7 | -82.2 | 0 | 0 | 109.9 | W147 R148 A150 | Q123-W147 WeakPolarHBondContact O-CA 3.39Å; Q123-R148 PolarHBondContact N-O 2.76Å; Q123-R148 PolarHBondContact O-N 3.42Å; Q123-A150 HydrophobicContact CG-CB 4.38Å |
| 124 | P | 86.4 | Confident | 83.3 | Confident | 63 Ų | 63 | 71.7 Ų | 71.7 | 41% | 0.409 | 42% | 0.415 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -68.4 | 134.3 | 175.6 | 29.7 | -32.3 | 0 | 0 | 0 | 109.1 | G126 W147 | P124-G126 VanDerWaalsContact C-N 3.25Å; P124-W147 HydrophobicContact CB-CH2 4.3Å; P124-W147 HydrophobicContact CB-CZ2 4.35Å; P124-W147 HydrophobicContact CB-CZ3 4.39Å; P124-W147 HydrophobicContact CG-CH2 4.3Å; P124-W147 HydrophobicContact CG-CZ3 4.33Å |
| 125 | A | 79.5 | Confident | 83.3 | Confident | 44 Ų | 44 | 72.2 Ų | 72.2 | 36% | 0.364 | 42% | 0.418 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.2 | -3.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | K127 C146 | A125-K127 VanDerWaalsContact C-N 3.32Å; A125-C146 HydrophobicContact CB-CB 4.35Å; A125-C146 WeakPolarHBondContact CB-O 3.5Å; A125-C146 PolarHBondContact N-O 3.35Å |
| 126 | G | 80.7 | Confident | 83.3 | Confident | 65 Ų | 65 | 71.9 Ų | 71.9 | 67% | 0.67 | 42% | 0.424 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | 74.5 | 20.1 | -178.3 | 0 | 0 | 0 | 0 | 0 | 114.2 | P124 | P124-G126 VanDerWaalsContact C-N 3.25Å |
| 127 | K | 84.8 | Confident | 83.1 | Confident | 115 Ų | 115 | 68.8 Ų | 68.8 | 50% | 0.5 | 43% | 0.43 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.3 | 122.9 | 174.8 | -170.1 | -173.4 | -176.1 | -175.5 | 0 | 108.7 | A125 E134 E145 C146 | A125-K127 VanDerWaalsContact C-N 3.32Å; K127-E134 WeakPolarHBondContact CE-O 3.25Å; K127-E134 PolarHBondContact NZ-O 2.98Å; K127-E145 CarbonylContact O-C 3.53Å; K127-E145 WeakPolarHBondContact O-CA 3.38Å; K127-C146 HydrophobicContact CB-CB 4.32Å; K127-C146 PolarHBondContact O-N 2.79Å |
| 128 | S | 89.5 | Confident | 82.7 | Confident | 83 Ų | 83 | 66.7 Ų | 66.7 | 58% | 0.58 | 44% | 0.441 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -74.3 | 147.7 | 174 | -47.3 | 0 | 0 | 0 | 0 | 111.1 | G144 E145 | S128-G144 CarbonylContact C-O 3.51Å; S128-G144 WeakPolarHBondContact CA-O 3.36Å; S128-G144 WeakPolarHBondContact CB-O 3.42Å; S128-E145 WeakPolarHBondContact CA-OE1 3.47Å; S128-E145 PolarHBondContact N-OE1 3.08Å; S128-E145 PolarHBondContact OG-OE1 3Å |
| 129 | C | 87.9 | Confident | 83 | Confident | 9 Ų | 9 | 66.5 Ų | 66.5 | 6% | 0.061 | 44% | 0.439 | C | S | . | . | trans | -150.3 | 155.8 | -177.1 | 60 | 0 | 0 | 0 | 0 | 111.2 | E134 C135 C141 G144 E145 C146 | C129-E134 WeakPolarHBondContact CA-OE2 3.28Å; C129-E134 HydrophobicContact CB-CB 3.98Å; C129-C135 VanDerWaalsContact SG-SG 3.66Å; C129-C141 HydrophobicContact CB-CB 3.91Å; C129-C141 WeakPolarHBondContact CB-SG 3.18Å; C129-C141 PolarHBondContact O-SG 3.47Å; C129-C141 WeakPolarHBondContact SG-CA 3.48Å; C129-C141 WeakPolarHBondContact SG-CB 3.46Å; C129-C141 CovalentContact SG-SG 2.03Å; C129-C141 PolarHBondContact SG-SG 2.88Å; C129-G144 PolarHBondContact N-O 3.3Å; C129-G144 CarbonylContact O-C 3.4Å; C129-G144 WeakPolarHBondContact O-CA 3.5Å; C129-E145 PolarHBondContact SG-O 3.09Å; C129-C146 VanDerWaalsContact CB-SG 3.59Å; C129-C146 PolarHBondContact SG-N 2.75Å | ||
| 130 | T | 86.6 | Confident | 83.1 | Confident | 130 Ų | 130 | 65.8 Ų | 65.8 | 80% | 0.798 | 44% | 0.435 | S | S | * | . | S | Bend | trans | -106.3 | -29.8 | 168.9 | -46.2 | 0 | 0 | 0 | 0 | 111.5 | E134 | T130-E134 WeakPolarHBondContact CA-OE1 3.44Å; T130-E134 WeakPolarHBondContact CB-OE1 3.04Å; T130-E134 PolarHBondContact N-OE1 3.29Å; T130-E134 PolarHBondContact N-OE2 3.32Å |
| 131 | N | 83.8 | Confident | 83.3 | Confident | 73 Ų | 73 | 62.7 Ų | 62.7 | 39% | 0.39 | 42% | 0.423 | S | S | . | . | S | Bend | trans | -135.5 | 163.1 | 178.2 | 61.8 | 71.1 | 0 | 0 | 0 | 112.1 | S133 E134 C141 | N131-S133 PolarHBondContact O-N 3.06Å; N131-S133 WeakPolarHBondContact OD1-CA 3.47Å; N131-S133 WeakPolarHBondContact OD1-CB 3.47Å; N131-S133 PolarHBondContact OD1-N 3.23Å; N131-S133 VanDerWaalsContact OD1-N 3.09Å; N131-S133 PolarHBondContact OD1-OG 2.86Å; N131-E134 PolarHBondContact N-OE1 3.41Å; N131-E134 VanDerWaalsContact N-OE1 3.08Å; N131-E134 PolarHBondContact ND2-OE1 3.39Å; N131-E134 PolarHBondContact O-N 2.94Å; N131-E134 PolarHBondContact OD1-N 2.86Å; N131-C141 VanDerWaalsContact C-CB 3.41Å; N131-C141 WeakPolarHBondContact O-CB 3.05Å |
| 132 | A | 77.5 | Confident | 83.5 | Confident | 52 Ų | 52 | 59.4 Ų | 59.4 | 43% | 0.43 | 40% | 0.402 | S | S | . | . | G | 310 helix | trans | -62.7 | -27.1 | -178.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | E134 C135 | A132-E134 PolarHBondContact O-N 3.45Å; A132-C135 WeakPolarHBondContact O-CB 3.04Å; A132-C135 PolarHBondContact O-N 2.91Å; A132-C135 VanDerWaalsContact O-N 3.07Å |
| 133 | S | 80.6 | Confident | 83.5 | Confident | 115 Ų | 115 | 65.9 Ų | 65.9 | 80% | 0.804 | 43% | 0.429 | S | S | * | . | G | 310 helix | trans | -67.8 | -19.8 | -179.5 | -39.5 | 0 | 0 | 0 | 0 | 113.4 | N131 C135 | N131-S133 PolarHBondContact O-N 3.06Å; N131-S133 WeakPolarHBondContact OD1-CA 3.47Å; N131-S133 WeakPolarHBondContact OD1-CB 3.47Å; N131-S133 PolarHBondContact OD1-N 3.23Å; N131-S133 VanDerWaalsContact OD1-N 3.09Å; N131-S133 PolarHBondContact OD1-OG 2.86Å; S133-C135 VanDerWaalsContact C-N 3.27Å |
| 134 | E | 84.8 | Confident | 83.7 | Confident | 70 Ų | 70 | 62.3 Ų | 62.3 | 33% | 0.327 | 42% | 0.423 | S | S | . | . | G | 310 helix | trans | -77.6 | -15.1 | 174.1 | -67.7 | 171 | -113.7 | 0 | 0 | 112.6 | K127 C129 T130 N131 A132 | K127-E134 WeakPolarHBondContact CE-O 3.25Å; K127-E134 PolarHBondContact NZ-O 2.98Å; C129-E134 WeakPolarHBondContact CA-OE2 3.28Å; C129-E134 HydrophobicContact CB-CB 3.98Å; T130-E134 WeakPolarHBondContact CA-OE1 3.44Å; T130-E134 WeakPolarHBondContact CB-OE1 3.04Å; T130-E134 PolarHBondContact N-OE1 3.29Å; T130-E134 PolarHBondContact N-OE2 3.32Å; N131-E134 PolarHBondContact N-OE1 3.41Å; N131-E134 VanDerWaalsContact N-OE1 3.08Å; N131-E134 PolarHBondContact ND2-OE1 3.39Å; N131-E134 PolarHBondContact O-N 2.94Å; N131-E134 PolarHBondContact OD1-N 2.86Å; A132-E134 PolarHBondContact O-N 3.45Å |
| 135 | C | 84.3 | Confident | 83.8 | Confident | 15 Ų | 15 | 62.2 Ų | 62.2 | 10% | 0.101 | 42% | 0.417 | C | S | . | . | S | Bend | trans | -95 | 160.3 | 179.8 | -52.6 | 0 | 0 | 0 | 0 | 111.6 | C129 A132 S133 Q139 C146 | C129-C135 VanDerWaalsContact SG-SG 3.66Å; A132-C135 WeakPolarHBondContact O-CB 3.04Å; A132-C135 PolarHBondContact O-N 2.91Å; A132-C135 VanDerWaalsContact O-N 3.07Å; S133-C135 VanDerWaalsContact C-N 3.27Å; C135-Q139 HydrophobicContact CB-CB 3.62Å; C135-C146 WeakPolarHBondContact CA-SG 3.48Å; C135-C146 HydrophobicContact CB-CB 3.79Å; C135-C146 WeakPolarHBondContact CB-SG 3.46Å; C135-C146 VanDerWaalsContact SG-CA 3.51Å; C135-C146 WeakPolarHBondContact SG-CB 3.38Å; C135-C146 CovalentContact SG-SG 2.04Å; C135-C146 PolarHBondContact SG-SG 2.7Å |
| 136 | G | 81.1 | Confident | 84.3 | Confident | 38 Ų | 38 | 60.1 Ų | 60.1 | 39% | 0.392 | 40% | 0.4 | S | S | . | . | P | Polyproline II helix | trans | -69.1 | 171.1 | 177 | 0 | 0 | 0 | 0 | 0 | 113 | G138 Q139 | G136-G138 PolarHBondContact O-N 2.61Å; G136-Q139 VanDerWaalsContact O-CB 3.25Å; G136-Q139 WeakPolarHBondContact O-CB 3.31Å; G136-Q139 WeakPolarHBondContact O-CG 3.19Å; G136-Q139 PolarHBondContact O-N 2.79Å |
| 137 | A | 77.4 | Confident | 84.7 | Confident | 109 Ų | 109 | 57.9 Ų | 57.9 | 90% | 0.901 | 37% | 0.371 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.5 | 134.2 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | Q139 | A137-Q139 PolarHBondContact O-N 2.81Š|
| 138 | G | 74.8 | Confident | 84.8 | Confident | 72 Ų | 72 | 59 Ų | 59 | 74% | 0.742 | 37% | 0.372 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 74.7 | 10 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.9 | G136 | G136-G138 PolarHBondContact O-N 2.61Š|
| 139 | Q | 85.8 | Confident | 84.4 | Confident | 52 Ų | 52 | 56.4 Ų | 56.4 | 24% | 0.243 | 36% | 0.356 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.5 | 157.2 | 175.2 | -53.3 | -175.1 | -18.8 | 0 | 0 | 111 | C135 G136 A137 W147 R148 | C135-Q139 HydrophobicContact CB-CB 3.62Å; G136-Q139 VanDerWaalsContact O-CB 3.25Å; G136-Q139 WeakPolarHBondContact O-CB 3.31Å; G136-Q139 WeakPolarHBondContact O-CG 3.19Å; G136-Q139 PolarHBondContact O-N 2.79Å; A137-Q139 PolarHBondContact O-N 2.81Å; Q139-W147 CarbonylContact C-O 3.53Å; Q139-W147 WeakPolarHBondContact CA-O 2.93Å; Q139-W147 WeakPolarHBondContact CB-O 3.48Å; Q139-R148 HydrophobicContact CG-CB 4.02Å |
| 140 | A | 85.6 | Confident | 83.5 | Confident | 0 Ų | 0 | 57.5 Ų | 57.5 | 0% | 0 | 37% | 0.366 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.7 | 135.5 | -177.8 | 0 | 0 | 0 | 0 | 0 | 110.4 | H105 I113 K142 W147 | H105-A140 HydrophobicContact CB-CB 4.18Å; H105-A140 WeakPolarHBondContact CD2-CB 3.46Å; H105-A140 VanDerWaalsContact CG-CB 3.44Å; H105-A140 WeakPolarHBondContact NE2-CB 3.47Å; I113-A140 HydrophobicContact CB-CB 4.19Å; I113-A140 HydrophobicContact CD1-CB 4.33Å; I113-A140 HydrophobicContact CG2-CB 3.95Å; A140-K142 PolarHBondContact O-N 2.78Å; A140-W147 PolarHBondContact N-O 3.28Å; A140-W147 PolarHBondContact O-N 3.46Å |
| 141 | C | 87.3 | Confident | 82.1 | Confident | 23 Ų | 23 | 56.1 Ų | 56.1 | 16% | 0.155 | 36% | 0.357 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -80 | 120.4 | 172.8 | -169.5 | 0 | 0 | 0 | 0 | 110.5 | C129 N131 | C129-C141 HydrophobicContact CB-CB 3.91Å; C129-C141 WeakPolarHBondContact CB-SG 3.18Å; C129-C141 PolarHBondContact O-SG 3.47Å; C129-C141 WeakPolarHBondContact SG-CA 3.48Å; C129-C141 WeakPolarHBondContact SG-CB 3.46Å; C129-C141 CovalentContact SG-SG 2.03Å; C129-C141 PolarHBondContact SG-SG 2.88Å; N131-C141 VanDerWaalsContact C-CB 3.41Å; N131-C141 WeakPolarHBondContact O-CB 3.05Å |
| 142 | K | 86.6 | Confident | 80.6 | Confident | 4 Ų | 4 | 60.4 Ų | 60.4 | 2% | 0.017 | 38% | 0.378 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -150.5 | 140.4 | -179.5 | -176.8 | 177.7 | -179.9 | 161 | 0 | 110.7 | H105 C108 G110 Q112 A140 G144 E145 W147 | H105-K142 WeakPolarHBondContact O-CE 3.34Å; H105-K142 PolarHBondContact O-NZ 3.07Å; C108-K142 PolarHBondContact O-NZ 3.29Å; G110-K142 WeakPolarHBondContact O-CE 3.43Å; G110-K142 PolarHBondContact O-NZ 3.06Å; Q112-K142 PolarHBondContact O-NZ 3.28Å; A140-K142 PolarHBondContact O-N 2.78Å; K142-G144 PolarHBondContact O-N 3.27Å; K142-G144 VanDerWaalsContact O-N 3.1Å; K142-E145 PolarHBondContact N-O 2.04Å; K142-E145 PolarHBondContact O-N 2.74Å; K142-W147 HydrophobicContact CB-CG 4.3Å; K142-W147 VanDerWaalsContact O-CD1 3.25Å; K142-W147 PolarHBondContact O-NE1 3.46Å |
| 143 | F | 86.5 | Confident | 79 | Confident | 139 Ų | 139 | 64.9 Ų | 64.9 | 61% | 0.61 | 39% | 0.388 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.8 | 28 | -173.3 | -52.7 | -59.3 | 0 | 0 | 0 | 114.2 | G110 E145 W147 | G110-F143 WeakPolarHBondContact O-CE2 3.12Å; F143-E145 VanDerWaalsContact C-N 3.27Å; F143-E145 PolarHBondContact O-N 3.26Å; F143-W147 AromaticContact CD2-CZ2 3.96Å; F143-W147 HydrophobicContact CD2-CZ2 3.96Å |
| 144 | G | 86 | Confident | 77.2 | Confident | 38 Ų | 38 | 63.4 Ų | 63.4 | 39% | 0.392 | 39% | 0.391 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 76.7 | 8.7 | -177.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | S128 C129 K142 | S128-G144 CarbonylContact C-O 3.51Å; S128-G144 WeakPolarHBondContact CA-O 3.36Å; S128-G144 WeakPolarHBondContact CB-O 3.42Å; C129-G144 PolarHBondContact N-O 3.3Å; C129-G144 CarbonylContact O-C 3.4Å; C129-G144 WeakPolarHBondContact O-CA 3.5Å; K142-G144 PolarHBondContact O-N 3.27Å; K142-G144 VanDerWaalsContact O-N 3.1Å |
| 145 | E | 89.1 | Confident | 75.4 | Confident | 61 Ų | 61 | 66.5 Ų | 66.5 | 29% | 0.285 | 41% | 0.407 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129 | 150.3 | -178.6 | -65 | -98.8 | 96.5 | 0 | 0 | 109.9 | K127 S128 C129 K142 F143 W147 | K127-E145 CarbonylContact O-C 3.53Å; K127-E145 WeakPolarHBondContact O-CA 3.38Å; S128-E145 WeakPolarHBondContact CA-OE1 3.47Å; S128-E145 PolarHBondContact N-OE1 3.08Å; S128-E145 PolarHBondContact OG-OE1 3Å; C129-E145 PolarHBondContact SG-O 3.09Å; K142-E145 PolarHBondContact N-O 2.04Å; K142-E145 PolarHBondContact O-N 2.74Å; F143-E145 VanDerWaalsContact C-N 3.27Å; F143-E145 PolarHBondContact O-N 3.26Å; E145-W147 PolarHBondContact O-NE1 2.9Å |
| 146 | C | 88.9 | Confident | 73.6 | Confident | 0 Ų | 0 | 69.5 Ų | 69.5 | 0% | 0 | 43% | 0.433 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.6 | 126.1 | 174.5 | -69.8 | 0 | 0 | 0 | 0 | 109.7 | A125 K127 C129 C135 | A125-C146 HydrophobicContact CB-CB 4.35Å; A125-C146 WeakPolarHBondContact CB-O 3.5Å; A125-C146 PolarHBondContact N-O 3.35Å; K127-C146 HydrophobicContact CB-CB 4.32Å; K127-C146 PolarHBondContact O-N 2.79Å; C129-C146 VanDerWaalsContact CB-SG 3.59Å; C129-C146 PolarHBondContact SG-N 2.75Å; C135-C146 WeakPolarHBondContact CA-SG 3.48Å; C135-C146 HydrophobicContact CB-CB 3.79Å; C135-C146 WeakPolarHBondContact CB-SG 3.46Å; C135-C146 VanDerWaalsContact SG-CA 3.51Å; C135-C146 WeakPolarHBondContact SG-CB 3.38Å; C135-C146 CovalentContact SG-SG 2.04Å; C135-C146 PolarHBondContact SG-SG 2.7Å |
| 147 | W | 89.3 | Confident | 72.1 | Confident | 18 Ų | 18 | 76.3 Ų | 76.3 | 7% | 0.068 | 45% | 0.452 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.8 | 137.5 | 178.4 | -67 | 77.1 | 0 | 0 | 0 | 110.1 | Q111 I113 A122 Q123 P124 Q139 A140 K142 F143 E145 | Q111-W147 HydrophobicContact CB-CE3 4.4Å; Q111-W147 HydrophobicContact CB-CH2 3.91Å; Q111-W147 HydrophobicContact CB-CZ3 3.52Å; Q111-W147 HydrophobicContact CG-CH2 3.52Å; Q111-W147 HydrophobicContact CG-CZ3 3.67Å; I113-W147 HydrophobicContact CG2-CB 3.52Å; I113-W147 HydrophobicContact CG2-CG 4.27Å; A122-W147 HydrophobicContact CB-CB 4.09Å; A122-W147 HydrophobicContact CB-CE3 3.96Å; A122-W147 WeakPolarHBondContact O-CZ3 3.48Å; Q123-W147 WeakPolarHBondContact O-CA 3.39Å; P124-W147 HydrophobicContact CB-CH2 4.3Å; P124-W147 HydrophobicContact CB-CZ2 4.35Å; P124-W147 HydrophobicContact CB-CZ3 4.39Å; P124-W147 HydrophobicContact CG-CH2 4.3Å; P124-W147 HydrophobicContact CG-CZ3 4.33Å; Q139-W147 CarbonylContact C-O 3.53Å; Q139-W147 WeakPolarHBondContact CA-O 2.93Å; Q139-W147 WeakPolarHBondContact CB-O 3.48Å; A140-W147 PolarHBondContact N-O 3.28Å; A140-W147 PolarHBondContact O-N 3.46Å; K142-W147 HydrophobicContact CB-CG 4.3Å; K142-W147 VanDerWaalsContact O-CD1 3.25Å; K142-W147 PolarHBondContact O-NE1 3.46Å; F143-W147 AromaticContact CD2-CZ2 3.96Å; F143-W147 HydrophobicContact CD2-CZ2 3.96Å; E145-W147 PolarHBondContact O-NE1 2.9Å |
| 148 | R | 87.5 | Confident | 70.3 | Confident | 138 Ų | 138 | 79.4 Ų | 79.4 | 52% | 0.521 | 45% | 0.448 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117 | 141.1 | 172.3 | 65.3 | -177.4 | 178.9 | 177.3 | -0.4 | 109.7 | A122 Q123 Q139 A150 | A122-R148 CarbonylContact C-O 3.59Å; A122-R148 WeakPolarHBondContact CA-O 3.46Å; A122-R148 VanDerWaalsContact CB-O 3.28Å; A122-R148 WeakPolarHBondContact CB-O 3.42Å; Q123-R148 PolarHBondContact N-O 2.76Å; Q123-R148 PolarHBondContact O-N 3.42Å; Q139-R148 HydrophobicContact CG-CB 4.02Å; R148-A150 PolarHBondContact O-N 2.98Å |
| 149 | A | 80.9 | Confident | 68.5 | Low | 29 Ų | 29 | 80.6 Ų | 80.6 | 24% | 0.24 | 44% | 0.437 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -58.9 | 130.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 109.4 | I113 V115 T151 | I113-A149 HydrophobicContact CD1-CB 3.99Å; I113-A149 VanDerWaalsContact CD1-N 3.33Å; I113-A149 HydrophobicContact CG1-CB 4.39Å; V115-A149 HydrophobicContact CG2-CB 4.14Å; A149-T151 VanDerWaalsContact C-N 3.31Å; A149-T151 PolarHBondContact O-N 3.44Å |
| 150 | A | 68.4 | Low | 66.3 | Low | 32 Ų | 32 | 91 Ų | 91 | 26% | 0.264 | 48% | 0.482 | S | S | . | . | trans | -73.9 | 91.7 | 171.1 | 0 | 0 | 0 | 0 | 0 | 106.9 | P121 Q123 R148 I152 | P121-A150 WeakPolarHBondContact O-CB 3.19Å; P121-A150 PolarHBondContact O-N 3.47Å; Q123-A150 HydrophobicContact CG-CB 4.38Å; R148-A150 PolarHBondContact O-N 2.98Å; A150-I152 PolarHBondContact O-N 3.1Å | ||
| 151 | T | 57.3 | Low | 65.3 | Low | 100 Ų | 100 | 95.6 Ų | 95.6 | 61% | 0.613 | 51% | 0.506 | S | S | * | . | trans | -62.5 | 121.8 | 171.3 | 45.9 | 0 | 0 | 0 | 0 | 107.8 | A149 F153 | A149-T151 VanDerWaalsContact C-N 3.31Å; A149-T151 PolarHBondContact O-N 3.44Å; T151-F153 CarbonylContact O-C 3.48Å; T151-F153 PolarHBondContact O-N 2.88Å; T151-F153 PolarHBondContact OG1-O 2.03Å | ||
| 152 | I | 52.2 | Low | 64.1 | Low | 163 Ų | 163 | 99.4 Ų | 99.4 | 84% | 0.836 | 52% | 0.524 | S | S | * | . | S | Bend | trans | -58.5 | -8.2 | 179.2 | 30.3 | 171.3 | 0 | 0 | 0 | 114.1 | A150 | A150-I152 PolarHBondContact O-N 3.1Š|
| 153 | F | 45.5 | Very low | 62.9 | Low | 147 Ų | 147 | 104.7 Ų | 104.7 | 65% | 0.645 | 55% | 0.552 | S | S | * | * | S | Bend | trans | -113.8 | 105.6 | 164.2 | -72.6 | -88.4 | 0 | 0 | 0 | 107.9 | T151 M155 | T151-F153 CarbonylContact O-C 3.48Å; T151-F153 PolarHBondContact O-N 2.88Å; T151-F153 PolarHBondContact OG1-O 2.03Å; F153-M155 HydrophobicContact CB-CG 3.9Å; F153-M155 HydrophobicContact CB-SD 3.85Å; F153-M155 HydrophobicContact CD1-SD 4.28Å; F153-M155 HydrophobicContact CG-SD 4.49Å; F153-M155 PolarHBondContact O-N 3.46Å |
| 154 | G | 42.6 | Very low | 61.5 | Low | 83 Ų | 83 | 102.6 Ų | 102.6 | 86% | 0.856 | 55% | 0.549 | S | S | * | . | trans | -65.2 | 33.9 | 174 | 0 | 0 | 0 | 0 | 0 | 114.4 | A156 | G154-A156 PolarHBondContact O-N 3.19Š| ||
| 155 | M | 46.6 | Very low | 60 | Low | 136 Ų | 136 | 106.7 Ų | 106.7 | 67% | 0.67 | 56% | 0.559 | S | S | * | * | trans | -79 | 95.6 | 159.2 | 17.7 | -104.2 | -81.3 | 0 | 0 | 107.1 | F153 F157 | F153-M155 HydrophobicContact CB-CG 3.9Å; F153-M155 HydrophobicContact CB-SD 3.85Å; F153-M155 HydrophobicContact CD1-SD 4.28Å; F153-M155 HydrophobicContact CG-SD 4.49Å; F153-M155 PolarHBondContact O-N 3.46Å; M155-F157 PolarHBondContact O-N 2.92Å; M155-F157 VanDerWaalsContact O-N 3.09Å | ||
| 156 | A | 46.9 | Very low | 58 | Low | 78 Ų | 78 | 109.7 Ų | 109.7 | 65% | 0.645 | 58% | 0.577 | S | S | * | * | trans | -46.9 | 114.4 | 159.4 | 0 | 0 | 0 | 0 | 0 | 108.4 | G154 E158 | G154-A156 PolarHBondContact O-N 3.19Å; A156-E158 HydrophobicContact CB-CG 4.2Å; A156-E158 PolarHBondContact O-N 2.79Å | ||
| 157 | F | 48.3 | Very low | 55.8 | Low | 180 Ų | 180 | 117.6 Ų | 117.6 | 79% | 0.789 | 62% | 0.618 | S | S | * | * | trans | -74.8 | 62.5 | 162.5 | -117.8 | -94.2 | 0 | 0 | 0 | 107.7 | M155 L159 | M155-F157 PolarHBondContact O-N 2.92Å; M155-F157 VanDerWaalsContact O-N 3.09Å; F157-L159 HydrophobicContact CD1-CB 4.15Å; F157-L159 HydrophobicContact CD1-CD1 4.43Å; F157-L159 HydrophobicContact CE1-CB 4.4Å; F157-L159 HydrophobicContact CE1-CD1 4.18Å; F157-L159 HydrophobicContact CZ-CD1 4.48Å; F157-L159 PolarHBondContact O-N 3.46Å | ||
| 158 | E | 39.2 | Very low | 53.3 | Low | 174 Ų | 174 | 125.2 Ų | 125.2 | 81% | 0.813 | 66% | 0.661 | S | S | * | * | trans | -83.3 | 74.8 | 153.8 | -67.6 | -73.6 | 130.3 | 0 | 0 | 104.9 | A156 | A156-E158 HydrophobicContact CB-CG 4.2Å; A156-E158 PolarHBondContact O-N 2.79Å | ||
| 159 | L | 38.2 | Very low | 50.4 | Low | 98 Ų | 98 | 124.2 Ų | 124.2 | 51% | 0.513 | 67% | 0.672 | S | S | . | * | trans | -126.9 | 101.2 | 170.8 | -84.4 | 171.8 | 0 | 0 | 0 | 108.1 | F157 | F157-L159 HydrophobicContact CD1-CB 4.15Å; F157-L159 HydrophobicContact CD1-CD1 4.43Å; F157-L159 HydrophobicContact CE1-CB 4.4Å; F157-L159 HydrophobicContact CE1-CD1 4.18Å; F157-L159 HydrophobicContact CZ-CD1 4.48Å; F157-L159 PolarHBondContact O-N 3.46Å | ||
| 160 | F | 38.8 | Very low | 47.6 | Very low | 270 Ų | 270 | 132.8 Ų | 132.8 | 100% | 1.184 | 71% | 0.712 | S | S | * | * | trans | 83.6 | 0 | 162.6 | -44.9 | -72.7 | 0 | 0 | 0 | 117.6 |
Retrieved 160 of 160 residues in 150.7 ms
(Link to these results)