| 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 | 40.6 | Very low | 45.1 | Very low | 236 Ų | 236 | 149.2 Ų | 149.2 | 100% | 1.163 | 82% | 0.823 | S | S | * | * | 0 | 138.8 | 0 | -82.6 | 164.3 | 168 | 0 | 0 | 108.6 | |||||
| 2 | V | 39.6 | Very low | 45.1 | Very low | 127 Ų | 127 | 146.4 Ų | 146.4 | 77% | 0.77 | 82% | 0.822 | S | S | * | * | trans | 52.2 | 136.8 | 137.5 | 153.5 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 3 | R | 44 | Very low | 44.4 | Very low | 222 Ų | 222 | 152.2 Ų | 152.2 | 84% | 0.838 | 82% | 0.823 | S | S | * | * | cis | -162 | 168.9 | -4.3 | -102.3 | 172.8 | -174.9 | 174.6 | 0.5 | 106.5 | ||||
| 4 | S | 43.1 | Very low | 45 | Very low | 95 Ų | 95 | 151 Ų | 151 | 66% | 0.664 | 82% | 0.823 | S | S | * | * | cis | 177 | 148.1 | -35.5 | -92.2 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 5 | R | 53.4 | Low | 45.1 | Very low | 241 Ų | 241 | 151.5 Ų | 151.5 | 91% | 0.909 | 82% | 0.817 | S | S | * | * | trans | 76.1 | 137.3 | 160.6 | -64.7 | 163.2 | -178.8 | -92.6 | -2 | 119.2 | ||||
| 6 | L | 48.5 | Very low | 45.2 | Very low | 161 Ų | 161 | 147.9 Ų | 147.9 | 84% | 0.843 | 82% | 0.815 | S | S | * | * | trans | -51.2 | 150.8 | 158.6 | -62.8 | 141.1 | 0 | 0 | 0 | 112.8 | ||||
| 7 | T | 41.3 | Very low | 45.5 | Very low | 142 Ų | 142 | 148.7 Ų | 148.7 | 87% | 0.871 | 81% | 0.811 | S | S | * | * | 178 | 156.5 | 120.5 | 25.3 | 0 | 0 | 0 | 0 | 113.2 | |||||
| 8 | A | 45.9 | Very low | 46.7 | Very low | 85 Ų | 85 | 146.8 Ų | 146.8 | 70% | 0.702 | 81% | 0.807 | S | S | * | * | trans | 52 | 111.7 | 159.6 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 9 | V | 50 | Low | 47.1 | Very low | 143 Ų | 143 | 145.9 Ų | 145.9 | 87% | 0.867 | 81% | 0.809 | S | S | * | * | 62.5 | 97.9 | 72.6 | -178.7 | 0 | 0 | 0 | 0 | 113.8 | |||||
| 10 | S | 46.7 | Very low | 47.5 | Very low | 109 Ų | 109 | 143.8 Ų | 143.8 | 76% | 0.762 | 81% | 0.811 | S | S | * | * | trans | -170.2 | 90.2 | 145.8 | 37.1 | 0 | 0 | 0 | 0 | 110.7 | S12 | S10-S12 PolarHBondContact O-N 3.18Š| ||
| 11 | A | 43.6 | Very low | 47.7 | Very low | 80 Ų | 80 | 144.5 Ų | 144.5 | 66% | 0.661 | 81% | 0.813 | S | S | * | * | trans | -75.8 | 108.6 | 166.8 | 0 | 0 | 0 | 0 | 0 | 108.9 | W13 | A11-W13 VanDerWaalsContact C-N 3.31Å; A11-W13 PolarHBondContact O-N 3.14Å | ||
| 12 | S | 44.4 | Very low | 48.4 | Very low | 116 Ų | 116 | 141.5 Ų | 141.5 | 81% | 0.811 | 80% | 0.798 | S | S | * | * | trans | -73.6 | 82.6 | 176.6 | -64.9 | 0 | 0 | 0 | 0 | 111.5 | S10 V14 | S10-S12 PolarHBondContact O-N 3.18Å; S12-V14 PolarHBondContact O-N 3.3Å | ||
| 13 | W | 36.5 | Very low | 49 | Very low | 222 Ų | 222 | 139 Ų | 139 | 84% | 0.841 | 80% | 0.798 | S | S | * | * | trans | -73 | 97.5 | 165.8 | -74.1 | 77.9 | 0 | 0 | 0 | 109.5 | A11 Q15 | A11-W13 VanDerWaalsContact C-N 3.31Å; A11-W13 PolarHBondContact O-N 3.14Å; W13-Q15 PolarHBondContact O-N 2.91Å | ||
| 14 | V | 52.8 | Low | 49.6 | Very low | 135 Ų | 135 | 139.9 Ų | 139.9 | 82% | 0.818 | 80% | 0.801 | S | S | * | * | trans | -71 | 115.1 | 164.7 | 172 | 0 | 0 | 0 | 0 | 108.2 | S12 A16 | S12-V14 PolarHBondContact O-N 3.3Å; V14-A16 PolarHBondContact O-N 3.31Å; V14-A16 VanDerWaalsContact O-N 3.14Å | ||
| 15 | Q | 46 | Very low | 50.4 | Low | 158 Ų | 158 | 147.2 Ų | 147.2 | 74% | 0.738 | 81% | 0.814 | S | S | * | * | trans | -75.1 | 100 | -177.1 | -72.2 | 151 | -66.2 | 0 | 0 | 111.3 | W13 | W13-Q15 PolarHBondContact O-N 2.91Š| ||
| 16 | A | 46.9 | Very low | 50.2 | Low | 94 Ų | 94 | 145.5 Ų | 145.5 | 78% | 0.777 | 81% | 0.814 | S | S | * | * | trans | -83.3 | 109.1 | 161.9 | 0 | 0 | 0 | 0 | 0 | 109.4 | V14 P18 | V14-A16 PolarHBondContact O-N 3.31Å; V14-A16 VanDerWaalsContact O-N 3.14Å; A16-P18 WeakPolarHBondContact O-CD 3.34Å | ||
| 17 | H | 49.9 | Very low | 50.6 | Low | 162 Ų | 162 | 142.3 Ų | 142.3 | 75% | 0.75 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -84.5 | 116.1 | 173.1 | -72.6 | -94.9 | 0 | 0 | 0 | 110.3 | ||
| 18 | P | 66.8 | Low | 51.3 | Low | 115 Ų | 115 | 145 Ų | 145 | 75% | 0.747 | 81% | 0.805 | S | S | * | * | P | Polyproline II helix | trans | -76.4 | 148.9 | 169 | 31.6 | -33.5 | 0 | 0 | 0 | 111 | A16 | A16-P18 WeakPolarHBondContact O-CD 3.34Š|
| 19 | P | 55.4 | Low | 52.1 | Low | 130 Ų | 130 | 152.1 Ų | 152.1 | 84% | 0.844 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -69.3 | 151.9 | 177.3 | 29.7 | -35.3 | 0 | 0 | 0 | 111.9 | ||
| 20 | A | 54.3 | Low | 52.6 | Low | 103 Ų | 103 | 154.1 Ų | 154.1 | 85% | 0.851 | 81% | 0.81 | S | S | * | * | P | Polyproline II helix | trans | -82 | 123.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||
| 21 | D | 52.1 | Low | 53.5 | Low | 158 Ų | 158 | 154.2 Ų | 154.2 | 85% | 0.845 | 81% | 0.808 | S | S | * | * | trans | -154.2 | 165.3 | 135.1 | -152.1 | -82.3 | 0 | 0 | 0 | 109.7 | ||||
| 22 | M | 54.1 | Low | 54.7 | Low | 173 Ų | 173 | 155.8 Ų | 155.8 | 85% | 0.852 | 81% | 0.812 | S | S | * | * | trans | -80.9 | 126.2 | -150.7 | -70.1 | -74.9 | -101.3 | 0 | 0 | 114.2 | ||||
| 23 | G | 53.3 | Low | 55.7 | Low | 74 Ų | 74 | 156 Ų | 156 | 76% | 0.763 | 81% | 0.811 | S | S | * | * | trans | -68 | 132.8 | -175.9 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 24 | R | 56.4 | Low | 57 | Low | 242 Ų | 242 | 154.8 Ų | 154.8 | 91% | 0.913 | 81% | 0.811 | S | S | * | * | trans | -127.2 | 75.3 | 154.9 | -75.3 | -176.2 | 174.7 | 159.9 | -0.1 | 110.3 | K26 | R24-K26 VanDerWaalsContact C-N 3.34Å; R24-K26 PolarHBondContact O-N 2.89Å | ||
| 25 | R | 59.3 | Low | 57.3 | Low | 248 Ų | 248 | 158.1 Ų | 158.1 | 94% | 0.936 | 81% | 0.814 | S | S | * | * | trans | -55.9 | 103.3 | 157.7 | -69.8 | -179.5 | -175.4 | 165.4 | 2.7 | 106.5 | S27 | R25-S27 VanDerWaalsContact C-N 3.28Å; R25-S27 PolarHBondContact O-N 3.34Å | ||
| 26 | K | 50.9 | Low | 57.9 | Low | 206 Ų | 206 | 159.6 Ų | 159.6 | 90% | 0.896 | 82% | 0.818 | S | S | * | * | trans | -69.7 | 94.4 | -178.6 | -165.7 | 158.5 | -176 | 173.9 | 0 | 107.5 | R24 K28 | R24-K26 VanDerWaalsContact C-N 3.34Å; R24-K26 PolarHBondContact O-N 2.89Å; K26-K28 PolarHBondContact O-N 2.79Å | ||
| 27 | S | 55.4 | Low | 58.2 | Low | 94 Ų | 94 | 163.5 Ų | 163.5 | 66% | 0.657 | 82% | 0.823 | S | S | * | * | trans | -37.5 | 130.3 | 176.6 | 171.4 | 0 | 0 | 0 | 0 | 109.9 | R25 R29 | R25-S27 VanDerWaalsContact C-N 3.28Å; R25-S27 PolarHBondContact O-N 3.34Å; S27-R29 PolarHBondContact O-N 2.83Å | ||
| 28 | K | 56.9 | Low | 58.5 | Low | 199 Ų | 199 | 162.8 Ų | 162.8 | 87% | 0.865 | 83% | 0.83 | S | S | * | * | trans | -63.5 | 82.8 | 167.8 | -174 | 173.5 | -176.9 | 175.8 | 0 | 106.7 | K26 K30 | K26-K28 PolarHBondContact O-N 2.79Å; K28-K30 PolarHBondContact O-N 2.7Å | ||
| 29 | R | 61.3 | Low | 57.7 | Low | 233 Ų | 233 | 159.9 Ų | 159.9 | 88% | 0.879 | 82% | 0.821 | S | S | * | * | trans | -56.6 | 101.7 | -179.6 | -121.6 | -174.8 | -178 | -164.2 | 0.7 | 105.7 | S27 | S27-R29 PolarHBondContact O-N 2.83Š| ||
| 30 | K | 62 | Low | 57.4 | Low | 185 Ų | 185 | 158.9 Ų | 158.9 | 80% | 0.804 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -53.8 | 129.7 | 167.1 | -64.9 | -177.6 | -179.6 | -179.1 | 0 | 105.1 | K28 | K28-K30 PolarHBondContact O-N 2.7Š|
| 31 | P | 66 | Low | 57.4 | Low | 111 Ų | 111 | 161.8 Ų | 161.8 | 72% | 0.721 | 81% | 0.813 | S | S | * | * | P | Polyproline II helix | trans | -52.9 | 139.2 | 173.1 | 23.4 | -32.5 | 0 | 0 | 0 | 107.4 | P33 | P31-P33 VanDerWaalsContact O-N 3.15Š|
| 32 | P | 67.1 | Low | 57.6 | Low | 114 Ų | 114 | 160.8 Ų | 160.8 | 74% | 0.74 | 80% | 0.803 | S | S | * | * | P | Polyproline II helix | trans | -52.3 | 129.2 | 176.8 | 22.9 | -32.4 | 0 | 0 | 0 | 107.1 | K34 | P32-K34 PolarHBondContact O-N 2.96Š|
| 33 | P | 65.9 | Low | 58.1 | Low | 121 Ų | 121 | 155.1 Ų | 155.1 | 79% | 0.786 | 78% | 0.778 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 119.8 | 179 | 22.5 | -31.8 | 0 | 0 | 0 | 106.4 | P31 K35 | P31-P33 VanDerWaalsContact O-N 3.15Å; P33-K35 PolarHBondContact O-N 2.95Å |
| 34 | K | 64 | Low | 59.2 | Low | 196 Ų | 196 | 155.7 Ų | 155.7 | 85% | 0.852 | 76% | 0.761 | S | S | * | * | P | Polyproline II helix | trans | -48.7 | 118.5 | 175.6 | -68.9 | -176.2 | 178.7 | -177.1 | 0 | 105.2 | P32 K36 | P32-K34 PolarHBondContact O-N 2.96Å; K34-K36 PolarHBondContact O-N 3Å |
| 35 | K | 60.1 | Low | 60.8 | Low | 204 Ų | 204 | 145.5 Ų | 145.5 | 89% | 0.887 | 72% | 0.723 | S | S | * | * | trans | -51.8 | 110.6 | 174.1 | -83.7 | -175.2 | 174.2 | -176.9 | 0 | 104.9 | P33 M37 | P33-K35 PolarHBondContact O-N 2.95Å; K35-M37 PolarHBondContact O-N 2.82Å | ||
| 36 | K | 57 | Low | 62.3 | Low | 189 Ų | 189 | 135.7 Ų | 135.7 | 82% | 0.822 | 69% | 0.691 | S | S | * | * | trans | -58.4 | 115.3 | 167.8 | -65.2 | -171.1 | 179 | -171.2 | 0 | 103.2 | K34 T38 | K34-K36 PolarHBondContact O-N 3Å; K36-T38 VanDerWaalsContact C-N 3.27Å; K36-T38 PolarHBondContact O-N 2.84Å | ||
| 37 | M | 52.8 | Low | 64.4 | Low | 177 Ų | 177 | 125.9 Ų | 125.9 | 87% | 0.872 | 65% | 0.649 | S | S | * | * | trans | -67 | 99.8 | -179.8 | -167 | 138.6 | 75.4 | 0 | 0 | 105.4 | K35 G39 | K35-M37 PolarHBondContact O-N 2.82Å; M37-G39 WeakPolarHBondContact O-CA 3.46Å; M37-G39 PolarHBondContact O-N 2.82Å | ||
| 38 | T | 56.9 | Low | 66.1 | Low | 147 Ų | 147 | 124 Ų | 124 | 90% | 0.902 | 63% | 0.634 | S | S | * | * | trans | -64.9 | 84.7 | 167.7 | 46.8 | 0 | 0 | 0 | 0 | 105.1 | K36 | K36-T38 VanDerWaalsContact C-N 3.27Å; K36-T38 PolarHBondContact O-N 2.84Å | ||
| 39 | G | 50.1 | Low | 67.7 | Low | 54 Ų | 54 | 119.5 Ų | 119.5 | 56% | 0.557 | 62% | 0.615 | S | S | * | * | trans | -140.5 | 6.8 | -146.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | M37 | M37-G39 WeakPolarHBondContact O-CA 3.46Å; M37-G39 PolarHBondContact O-N 2.82Å | ||
| 40 | T | 50.2 | Low | 69.2 | Low | 108 Ų | 108 | 110.2 Ų | 110.2 | 66% | 0.663 | 59% | 0.585 | S | S | * | * | trans | -130.9 | 118.8 | 155.8 | -30.8 | 0 | 0 | 0 | 0 | 105.5 | E42 | T40-E42 PolarHBondContact O-N 3.23Š| ||
| 41 | L | 53.3 | Low | 70.6 | Confident | 165 Ų | 165 | 107.5 Ų | 107.5 | 86% | 0.864 | 58% | 0.579 | S | S | * | * | trans | -64.8 | 102.2 | 149.4 | -84.3 | 160.6 | 0 | 0 | 0 | 103.5 | T43 | L41-T43 PolarHBondContact O-N 2.92Š| ||
| 42 | E | 57.3 | Low | 71.9 | Confident | 137 Ų | 137 | 107.1 Ų | 107.1 | 64% | 0.64 | 57% | 0.568 | S | S | * | * | trans | -64.4 | 85.2 | -177.9 | -76.7 | 179.4 | 162.4 | 0 | 0 | 108.9 | T40 Q44 | T40-E42 PolarHBondContact O-N 3.23Å; E42-Q44 HydrophobicContact CB-CG 3.89Å; E42-Q44 VanDerWaalsContact CB-NE2 3.31Å; E42-Q44 WeakPolarHBondContact O-CG 3.36Å; E42-Q44 PolarHBondContact O-N 2.8Å; E42-Q44 PolarHBondContact O-NE2 3.22Å | ||
| 43 | T | 62.8 | Low | 73 | Confident | 53 Ų | 53 | 108.5 Ų | 108.5 | 33% | 0.325 | 56% | 0.564 | S | S | . | * | trans | -68.1 | 80.1 | 167.9 | 45.3 | 0 | 0 | 0 | 0 | 107.7 | L41 F45 P88 | L41-T43 PolarHBondContact O-N 2.92Å; T43-F45 VanDerWaalsContact C-N 3.33Å; T43-F45 VanDerWaalsContact CB-CE2 3.5Å; T43-F45 HydrophobicContact CG2-CE2 4.38Å; T43-F45 HydrophobicContact CG2-CZ 4.21Å; T43-F45 VanDerWaalsContact O-CD2 3.3Å; T43-F45 WeakPolarHBondContact O-CD2 3.13Å; T43-F45 PolarHBondContact O-N 2.92Å; T43-P88 HydrophobicContact CG2-CB 4.22Å | ||
| 44 | Q | 77 | Confident | 74.1 | Confident | 87 Ų | 87 | 108.9 Ų | 108.9 | 41% | 0.407 | 55% | 0.553 | S | S | . | * | trans | -78.1 | 77.4 | -171.7 | -83.5 | 155.2 | 98.1 | 0 | 0 | 110.3 | E42 K54 | E42-Q44 HydrophobicContact CB-CG 3.89Å; E42-Q44 VanDerWaalsContact CB-NE2 3.31Å; E42-Q44 WeakPolarHBondContact O-CG 3.36Å; E42-Q44 PolarHBondContact O-N 2.8Å; E42-Q44 PolarHBondContact O-NE2 3.22Å; Q44-K54 HydrophobicContact CB-CB 4.29Å; Q44-K54 HydrophobicContact CB-CD 4.45Å; Q44-K54 HydrophobicContact CB-CG 3.96Å; Q44-K54 HydrophobicContact CG-CB 4.01Å; Q44-K54 HydrophobicContact CG-CD 3.97Å; Q44-K54 HydrophobicContact CG-CG 3.88Å | ||
| 45 | F | 89.6 | Confident | 75.4 | Confident | 27 Ų | 27 | 99.7 Ų | 99.7 | 12% | 0.118 | 51% | 0.514 | C | S | . | . | B | Isolated β-bridge | trans | -83.5 | 153.7 | 176.6 | -55.1 | -61.3 | 0 | 0 | 0 | 112 | T43 K54 S55 C56 V58 P88 V89 Y92 | T43-F45 VanDerWaalsContact C-N 3.33Å; T43-F45 VanDerWaalsContact CB-CE2 3.5Å; T43-F45 HydrophobicContact CG2-CE2 4.38Å; T43-F45 HydrophobicContact CG2-CZ 4.21Å; T43-F45 VanDerWaalsContact O-CD2 3.3Å; T43-F45 WeakPolarHBondContact O-CD2 3.13Å; T43-F45 PolarHBondContact O-N 2.92Å; F45-K54 WeakPolarHBondContact O-CA 3.4Å; F45-K54 PolarHBondContact O-N 2.83Å; F45-S55 PolarHBondContact O-N 3.34Å; F45-C56 HydrophobicContact CB-CB 4.16Å; F45-V58 HydrophobicContact CD2-CG2 3.93Å; F45-V58 HydrophobicContact CE2-CG2 3.8Å; F45-P88 HydrophobicContact CE2-CB 4.41Å; F45-V89 HydrophobicContact CE1-CB 4.28Å; F45-V89 HydrophobicContact CE1-CG2 4.23Å; F45-V89 HydrophobicContact CZ-CB 4.05Å; F45-V89 HydrophobicContact CZ-CG2 4.49Å; F45-Y92 HydrophobicContact CB-CD2 3.55Å; F45-Y92 HydrophobicContact CB-CE2 3.67Å; F45-Y92 HydrophobicContact CB-CG 4.05Å; F45-Y92 AromaticContact CD1-CD1 3.73Å; F45-Y92 HydrophobicContact CD1-CD1 3.73Å; F45-Y92 HydrophobicContact CD1-CD2 4.06Å; F45-Y92 HydrophobicContact CD1-CE1 4.21Å; F45-Y92 AromaticContact CD1-CG 3.63Å; F45-Y92 HydrophobicContact CD1-CG 3.63Å; F45-Y92 HydrophobicContact CD2-CD2 4.25Å; F45-Y92 HydrophobicContact CD2-CG 4.19Å; F45-Y92 HydrophobicContact CE1-CD1 4.13Å; F45-Y92 HydrophobicContact CE1-CG 4.09Å; F45-Y92 HydrophobicContact CG-CD1 4.25Å; F45-Y92 AromaticContact CG-CD2 3.71Å; F45-Y92 HydrophobicContact CG-CD2 3.71Å; F45-Y92 HydrophobicContact CG-CE2 4.25Å; F45-Y92 AromaticContact CG-CG 3.7Å; F45-Y92 HydrophobicContact CG-CG 3.7Å |
| 46 | T | 92.6 | Very high | 77 | Confident | 42 Ų | 42 | 90.3 Ų | 90.3 | 26% | 0.258 | 47% | 0.474 | S | S | . | . | P | Polyproline II helix | trans | -99.1 | 133.3 | 176.3 | -62.9 | 0 | 0 | 0 | 0 | 108.9 | Y92 | T46-Y92 VanDerWaalsContact O-CE2 3.3Å; T46-Y92 WeakPolarHBondContact O-CE2 3.39Å; T46-Y92 PolarHBondContact O-OH 3.5Å; T46-Y92 VanDerWaalsContact O-OH 3.06Å |
| 47 | C | 93.1 | Very high | 78.7 | Confident | 0 Ų | 0 | 86 Ų | 86 | 0% | 0 | 46% | 0.46 | C | S | . | . | P | Polyproline II helix | trans | -71.7 | 129.1 | -179.4 | -177.7 | 0 | 0 | 0 | 0 | 111.3 | F49 N51 H52 S55 C56 C71 | C47-F49 PolarHBondContact O-N 3.39Å; C47-F49 PolarHBondContact SG-N 3.29Å; C47-N51 VanDerWaalsContact O-CA 3.22Å; C47-N51 WeakPolarHBondContact O-CA 3.46Å; C47-N51 PolarHBondContact O-N 3.39Å; C47-H52 PolarHBondContact N-O 3.04Å; C47-S55 WeakPolarHBondContact CB-OG 3.28Å; C47-C56 WeakPolarHBondContact CA-SG 3.45Å; C47-C56 VanDerWaalsContact CB-SG 3.54Å; C47-C71 HydrophobicContact CB-CB 4.24Å; C47-C71 VanDerWaalsContact SG-SG 3.62Å |
| 48 | P | 91.6 | Very high | 80.6 | Confident | 54 Ų | 54 | 79 Ų | 79 | 35% | 0.351 | 43% | 0.428 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.7 | -27.7 | 177.4 | 25.8 | -34.6 | 0 | 0 | 0 | 113.1 | W95 I96 | P48-W95 HydrophobicContact CG-CD2 4.45Å; P48-W95 HydrophobicContact CG-CE3 4.36Å; P48-W95 HydrophobicContact CG-CZ3 4.47Å; P48-I96 HydrophobicContact CB-CD1 3.75Å; P48-I96 HydrophobicContact CG-CD1 3.81Å |
| 49 | F | 90.1 | Very high | 82.4 | Confident | 106 Ų | 106 | 79.2 Ų | 79.2 | 47% | 0.465 | 42% | 0.416 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.5 | -49.2 | -177.4 | -61.1 | -82.2 | 0 | 0 | 0 | 113.5 | C47 E76 W95 C99 | C47-F49 PolarHBondContact O-N 3.39Å; C47-F49 PolarHBondContact SG-N 3.29Å; F49-E76 HydrophobicContact CD2-CB 4.21Å; F49-E76 HydrophobicContact CD2-CG 3.98Å; F49-E76 HydrophobicContact CE2-CB 4.39Å; F49-E76 HydrophobicContact CE2-CG 3.69Å; F49-E76 HydrophobicContact CZ-CG 4.09Å; F49-W95 AromaticContact CD2-CZ2 3.96Å; F49-W95 HydrophobicContact CD2-CZ2 3.96Å; F49-W95 AromaticContact CE2-CE2 3.83Å; F49-W95 AromaticContact CE2-CZ2 3.66Å; F49-W95 HydrophobicContact CE2-CZ2 3.66Å; F49-W95 AromaticContact CE2-NE1 3.77Å; F49-C99 WeakPolarHBondContact CZ-SG 3.48Å |
| 50 | C | 93.7 | Very high | 84.5 | Confident | 38 Ų | 38 | 78.7 Ų | 78.7 | 26% | 0.257 | 40% | 0.399 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -109.3 | 0.3 | -174 | 71.7 | 0 | 0 | 0 | 0 | 114.4 | H52 C74 | C50-H52 PolarHBondContact O-CD2 3.37Å; C50-H52 VanDerWaalsContact O-CD2 3.29Å; C50-H52 PolarHBondContact O-N 2.92Å; C50-C74 HydrophobicContact CB-CB 3.97Å |
| 51 | N | 91.7 | Very high | 86.6 | Confident | 127 Ų | 127 | 76.1 Ų | 76.1 | 68% | 0.679 | 38% | 0.382 | S | S | * | . | trans | 51.7 | 24 | 177.5 | -157.4 | 84.4 | 0 | 0 | 0 | 114.9 | C47 | C47-N51 VanDerWaalsContact O-CA 3.22Å; C47-N51 WeakPolarHBondContact O-CA 3.46Å; C47-N51 PolarHBondContact O-N 3.39Å | ||
| 52 | H | 92.1 | Very high | 88.5 | Confident | 103 Ų | 103 | 72.9 Ų | 72.9 | 48% | 0.477 | 36% | 0.358 | S | S | . | . | trans | -81.8 | 120.7 | 171.9 | -85.1 | -94.1 | 0 | 0 | 0 | 109 | C47 C50 S55 V73 | C47-H52 PolarHBondContact N-O 3.04Å; C50-H52 PolarHBondContact O-CD2 3.37Å; C50-H52 VanDerWaalsContact O-CD2 3.29Å; C50-H52 PolarHBondContact O-N 2.92Å; H52-S55 WeakPolarHBondContact O-CB 3.46Å; H52-S55 PolarHBondContact O-OG 2.79Å; H52-V73 HydrophobicContact CB-CG2 4.1Å | ||
| 53 | E | 90.8 | Very high | 90.3 | Very high | 143 Ų | 143 | 70.9 Ų | 70.9 | 67% | 0.668 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.5 | 149 | 171.4 | -57.6 | -176 | 176.9 | 0 | 0 | 110.6 | S55 | E53-S55 PolarHBondContact O-N 2.93Å; E53-S55 VanDerWaalsContact O-N 3.08Å |
| 54 | K | 89.1 | Confident | 91.8 | Very high | 129 Ų | 129 | 77.5 Ų | 77.5 | 56% | 0.561 | 38% | 0.384 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 60.3 | 21.4 | 170.5 | -38.5 | -171.3 | 171.7 | -159.1 | 0 | 114 | Q44 F45 | Q44-K54 HydrophobicContact CB-CB 4.29Å; Q44-K54 HydrophobicContact CB-CD 4.45Å; Q44-K54 HydrophobicContact CB-CG 3.96Å; Q44-K54 HydrophobicContact CG-CB 4.01Å; Q44-K54 HydrophobicContact CG-CD 3.97Å; Q44-K54 HydrophobicContact CG-CG 3.88Å; F45-K54 WeakPolarHBondContact O-CA 3.4Å; F45-K54 PolarHBondContact O-N 2.83Å |
| 55 | S | 91.6 | Very high | 92.7 | Very high | 4 Ų | 4 | 77.6 Ų | 77.6 | 3% | 0.028 | 39% | 0.387 | C | S | . | . | trans | -97.6 | -9.9 | -172.3 | 61.5 | 0 | 0 | 0 | 0 | 113.8 | F45 C47 H52 E53 C71 T72 | F45-S55 PolarHBondContact O-N 3.34Å; C47-S55 WeakPolarHBondContact CB-OG 3.28Å; H52-S55 WeakPolarHBondContact O-CB 3.46Å; H52-S55 PolarHBondContact O-OG 2.79Å; E53-S55 PolarHBondContact O-N 2.93Å; E53-S55 VanDerWaalsContact O-N 3.08Å; S55-C71 CarbonylContact O-C 3.59Å; S55-C71 WeakPolarHBondContact O-CA 3.35Å; S55-T72 PolarHBondContact O-N 2.74Å; S55-T72 PolarHBondContact O-OG1 3.27Å | ||
| 56 | C | 93.4 | Very high | 93.1 | Very high | 7 Ų | 7 | 77.5 Ų | 77.5 | 5% | 0.047 | 39% | 0.389 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.9 | 122.1 | -175 | -51.2 | 0 | 0 | 0 | 0 | 112.1 | F45 C47 I69 S70 W95 | F45-C56 HydrophobicContact CB-CB 4.16Å; C47-C56 WeakPolarHBondContact CA-SG 3.45Å; C47-C56 VanDerWaalsContact CB-SG 3.54Å; C56-I69 HydrophobicContact CB-CD1 4.1Å; C56-I69 HydrophobicContact CB-CG1 4.16Å; C56-S70 CarbonylContact C-O 3.59Å; C56-S70 VanDerWaalsContact CA-O 3.32Å; C56-S70 WeakPolarHBondContact CA-O 3.48Å; C56-W95 HydrophobicContact CB-CZ3 4.27Å |
| 57 | D | 92.6 | Very high | 93.3 | Very high | 98 Ų | 98 | 75.5 Ų | 75.5 | 52% | 0.524 | 38% | 0.377 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.4 | 137.2 | 172.4 | -83.3 | -72.9 | 0 | 0 | 0 | 110.2 | I69 S70 T72 | D57-I69 WeakPolarHBondContact O-CA 3.32Å; D57-S70 PolarHBondContact N-O 3.07Å; D57-S70 PolarHBondContact O-N 2.73Å; D57-T72 WeakPolarHBondContact OD2-CG2 3.49Å |
| 58 | V | 93.8 | Very high | 93.4 | Very high | 31 Ų | 31 | 76.7 Ų | 76.7 | 19% | 0.188 | 38% | 0.384 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.6 | 128.3 | 177.5 | -176.3 | 0 | 0 | 0 | 0 | 110.9 | F45 M60 V68 I69 P88 V91 | F45-V58 HydrophobicContact CD2-CG2 3.93Å; F45-V58 HydrophobicContact CE2-CG2 3.8Å; V58-M60 HydrophobicContact CG1-CG 4.46Å; V58-M60 HydrophobicContact CG1-SD 3.95Å; V58-V68 CarbonylContact C-O 3.56Å; V58-V68 WeakPolarHBondContact CA-O 3.37Å; V58-I69 HydrophobicContact CG2-CB 4.13Å; V58-I69 HydrophobicContact CG2-CD1 3.7Å; V58-I69 HydrophobicContact CG2-CG1 3.85Å; V58-P88 HydrophobicContact CB-CB 4.11Å; V58-P88 HydrophobicContact CG1-CB 3.91Å; V58-V91 HydrophobicContact CG1-CB 4.07Å; V58-V91 HydrophobicContact CG1-CG1 4.01Å; V58-V91 HydrophobicContact CG1-CG2 4.41Å |
| 59 | K | 93.4 | Very high | 93.6 | Very high | 151 Ų | 151 | 74.1 Ų | 74.1 | 66% | 0.657 | 37% | 0.367 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -118.2 | 113.5 | 179.8 | -176.8 | -178.4 | 177 | -173.4 | 0 | 110.2 | V68 | K59-V68 PolarHBondContact N-O 2.9Å; K59-V68 PolarHBondContact O-N 2.84Å |
| 60 | M | 94.1 | Very high | 93.8 | Very high | 43 Ų | 43 | 70.9 Ų | 70.9 | 21% | 0.212 | 36% | 0.358 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -95 | 99.8 | 179.8 | -57.8 | -61.9 | -101.2 | 0 | 0 | 111.2 | V58 R62 I82 S86 E87 P88 V91 | V58-M60 HydrophobicContact CG1-CG 4.46Å; V58-M60 HydrophobicContact CG1-SD 3.95Å; M60-R62 PolarHBondContact O-N 2.95Å; M60-I82 HydrophobicContact CB-CD1 3.91Å; M60-I82 HydrophobicContact CE-CB 4.4Å; M60-I82 HydrophobicContact CE-CD1 3.82Å; M60-I82 HydrophobicContact CE-CG2 4.03Å; M60-I82 HydrophobicContact CG-CD1 4.42Å; M60-I82 HydrophobicContact SD-CD1 3.76Å; M60-I82 HydrophobicContact SD-CG2 4.34Å; M60-S86 WeakPolarHBondContact CE-O 3.3Å; M60-E87 WeakPolarHBondContact CE-O 3.41Å; M60-P88 HydrophobicContact CG-CG 4.39Å; M60-V91 HydrophobicContact CE-CG2 3.87Å; M60-V91 HydrophobicContact SD-CG2 3.6Å; M60-V91 VanDerWaalsContact SD-CG2 3.6Å |
| 61 | D | 94.7 | Very high | 93.8 | Very high | 54 Ų | 54 | 69.2 Ų | 69.2 | 29% | 0.289 | 35% | 0.346 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.6 | 91.3 | 169.5 | -170 | -21.6 | 0 | 0 | 0 | 110.3 | A63 R64 N65 T66 | D61-A63 VanDerWaalsContact C-N 3.25Å; D61-A63 PolarHBondContact O-N 3.33Å; D61-A63 WeakPolarHBondContact OD1-CA 3.39Å; D61-A63 WeakPolarHBondContact OD1-CB 3.43Å; D61-A63 PolarHBondContact OD1-N 3.08Å; D61-R64 HydrophobicContact CB-CB 4.4Å; D61-R64 PolarHBondContact O-N 2.99Å; D61-R64 PolarHBondContact OD1-N 2.64Å; D61-R64 VanDerWaalsContact OD2-CD 3.28Å; D61-R64 WeakPolarHBondContact OD2-CD 3.32Å; D61-R64 WeakPolarHBondContact OD2-CG 3.36Å; D61-R64 IonicContact OD2-NE 3.73Å; D61-N65 PolarHBondContact O-N 2.96Å; D61-N65 VanDerWaalsContact O-N 3.08Å; D61-T66 WeakPolarHBondContact CA-O 3.37Å; D61-T66 WeakPolarHBondContact CB-O 3.36Å; D61-T66 PolarHBondContact N-O 2.87Å; D61-T66 PolarHBondContact O-N 3.17Å |
| 62 | R | 93.4 | Very high | 93.9 | Very high | 96 Ų | 96 | 67 Ų | 67 | 36% | 0.362 | 34% | 0.338 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.4 | -19.3 | 177.1 | -55 | -62.7 | -177.6 | 164.8 | 3.3 | 113.5 | M60 T83 S86 | M60-R62 PolarHBondContact O-N 2.95Å; R62-T83 PolarHBondContact NH1-O 2.91Å; R62-S86 PolarHBondContact NH1-O 2.9Å; R62-S86 PolarHBondContact NH2-O 2.92Å |
| 63 | A | 94.9 | Very high | 94 | Very high | 96 Ų | 96 | 65.7 Ų | 65.7 | 79% | 0.793 | 34% | 0.337 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.6 | -25.8 | 177.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | D61 | D61-A63 VanDerWaalsContact C-N 3.25Å; D61-A63 PolarHBondContact O-N 3.33Å; D61-A63 WeakPolarHBondContact OD1-CA 3.39Å; D61-A63 WeakPolarHBondContact OD1-CB 3.43Å; D61-A63 PolarHBondContact OD1-N 3.08Å |
| 64 | R | 94.8 | Very high | 94.2 | Very high | 191 Ų | 191 | 61.3 Ų | 61.3 | 72% | 0.721 | 32% | 0.321 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.6 | 3.7 | 174.4 | -62.8 | -177.4 | 179.1 | -104.2 | -4 | 113.8 | D61 T66 | D61-R64 HydrophobicContact CB-CB 4.4Å; D61-R64 PolarHBondContact O-N 2.99Å; D61-R64 PolarHBondContact OD1-N 2.64Å; D61-R64 VanDerWaalsContact OD2-CD 3.28Å; D61-R64 WeakPolarHBondContact OD2-CD 3.32Å; D61-R64 WeakPolarHBondContact OD2-CG 3.36Å; D61-R64 IonicContact OD2-NE 3.73Å; R64-T66 PolarHBondContact O-N 3.49Å; R64-T66 PolarHBondContact O-OG1 3.25Å |
| 65 | N | 96.3 | Very high | 94.4 | Very high | 89 Ų | 89 | 62 Ų | 62 | 48% | 0.476 | 33% | 0.33 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 47.9 | 41.9 | -171.3 | -74.8 | 99.2 | 0 | 0 | 0 | 112.2 | D61 P81 I82 | D61-N65 PolarHBondContact O-N 2.96Å; D61-N65 VanDerWaalsContact O-N 3.08Å; N65-P81 CarbonylContact O-C 3.6Å; N65-P81 WeakPolarHBondContact O-CA 3.44Å; N65-I82 WeakPolarHBondContact CA-O 3.47Å; N65-I82 VanDerWaalsContact CB-O 3.32Å; N65-I82 WeakPolarHBondContact CB-O 3.38Å; N65-I82 PolarHBondContact ND2-O 3.06Å; N65-I82 PolarHBondContact O-N 2.84Å |
| 66 | T | 97 | Very high | 94.5 | Very high | 25 Ų | 25 | 66.1 Ų | 66.1 | 15% | 0.153 | 35% | 0.349 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.2 | 123.2 | -171.7 | -62.2 | 0 | 0 | 0 | 0 | 110.7 | D61 R64 V68 Q79 I82 | D61-T66 WeakPolarHBondContact CA-O 3.37Å; D61-T66 WeakPolarHBondContact CB-O 3.36Å; D61-T66 PolarHBondContact N-O 2.87Å; D61-T66 PolarHBondContact O-N 3.17Å; R64-T66 PolarHBondContact O-N 3.49Å; R64-T66 PolarHBondContact O-OG1 3.25Å; T66-V68 HydrophobicContact CG2-CG2 4.19Å; T66-Q79 HydrophobicContact CG2-CG 3.29Å; T66-I82 WeakPolarHBondContact O-CD1 3.4Å |
| 67 | G | 96.4 | Very high | 94.5 | Very high | 0 Ų | 0 | 71.8 Ų | 71.8 | 0% | 0 | 38% | 0.375 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.5 | 134.3 | 168 | 0 | 0 | 0 | 0 | 0 | 109.7 | Q79 T80 | G67-Q79 WeakPolarHBondContact O-CA 3.45Å; G67-T80 PolarHBondContact N-O 2.9Å; G67-T80 PolarHBondContact O-N 2.93Å |
| 68 | V | 95.9 | Very high | 94.6 | Very high | 25 Ų | 25 | 69.7 Ų | 69.7 | 15% | 0.152 | 36% | 0.361 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.5 | 132.7 | 174.2 | -177.6 | 0 | 0 | 0 | 0 | 108.4 | V58 K59 T66 E77 F78 Q79 | V58-V68 CarbonylContact C-O 3.56Å; V58-V68 WeakPolarHBondContact CA-O 3.37Å; K59-V68 PolarHBondContact N-O 2.9Å; K59-V68 PolarHBondContact O-N 2.84Å; T66-V68 HydrophobicContact CG2-CG2 4.19Å; V68-E77 HydrophobicContact CG1-CG 3.6Å; V68-F78 WeakPolarHBondContact CA-O 3.41Å; V68-Q79 HydrophobicContact CG2-CG 4.12Å |
| 69 | I | 95.3 | Very high | 94.8 | Very high | 0 Ų | 0 | 74.1 Ų | 74.1 | 0% | 0 | 38% | 0.38 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.5 | 135.9 | 171.4 | -177.7 | 162.7 | 0 | 0 | 0 | 109.5 | C56 D57 V58 E77 F78 V91 Y92 W95 | C56-I69 HydrophobicContact CB-CD1 4.1Å; C56-I69 HydrophobicContact CB-CG1 4.16Å; D57-I69 WeakPolarHBondContact O-CA 3.32Å; V58-I69 HydrophobicContact CG2-CB 4.13Å; V58-I69 HydrophobicContact CG2-CD1 3.7Å; V58-I69 HydrophobicContact CG2-CG1 3.85Å; I69-E77 CarbonylContact O-C 3.59Å; I69-E77 WeakPolarHBondContact O-CA 3.45Å; I69-F78 HydrophobicContact CG2-CB 3.92Å; I69-F78 HydrophobicContact CG2-CD1 4.04Å; I69-F78 PolarHBondContact N-O 3.31Å; I69-F78 PolarHBondContact O-N 3.08Å; I69-V91 HydrophobicContact CB-CG1 3.93Å; I69-V91 HydrophobicContact CG2-CG1 3.99Å; I69-Y92 HydrophobicContact CD1-CD2 3.79Å; I69-Y92 HydrophobicContact CD1-CG 4.46Å; I69-W95 HydrophobicContact CB-CE3 4.5Å; I69-W95 HydrophobicContact CD1-CD2 4.4Å; I69-W95 HydrophobicContact CD1-CE3 3.45Å; I69-W95 VanDerWaalsContact CD1-CE3 3.45Å; I69-W95 HydrophobicContact CD1-CZ3 3.7Å; I69-W95 HydrophobicContact CG1-CE3 3.8Å; I69-W95 HydrophobicContact CG1-CH2 4.49Å; I69-W95 HydrophobicContact CG1-CZ3 3.76Å; I69-W95 HydrophobicContact CG2-CB 4.01Å; I69-W95 HydrophobicContact CG2-CD2 3.78Å; I69-W95 HydrophobicContact CG2-CE3 3.89Å; I69-W95 HydrophobicContact CG2-CG 3.9Å; I69-W95 HydrophobicContact CG2-CZ3 4.47Å |
| 70 | S | 94.7 | Very high | 95 | Very high | 39 Ų | 39 | 67.5 Ų | 67.5 | 27% | 0.273 | 35% | 0.352 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -139.5 | 135.9 | -175.6 | 62.7 | 0 | 0 | 0 | 0 | 111.1 | C56 D57 E76 | C56-S70 CarbonylContact C-O 3.59Å; C56-S70 VanDerWaalsContact CA-O 3.32Å; C56-S70 WeakPolarHBondContact CA-O 3.48Å; D57-S70 PolarHBondContact N-O 3.07Å; D57-S70 PolarHBondContact O-N 2.73Å; S70-E76 CarbonylContact C-O 3.58Å; S70-E76 WeakPolarHBondContact CA-O 3.29Å |
| 71 | C | 94.4 | Very high | 95.1 | Very high | 2 Ų | 2 | 70.7 Ų | 70.7 | 1% | 0.014 | 38% | 0.376 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.7 | 123 | 174.9 | -179.1 | 0 | 0 | 0 | 0 | 111.6 | C47 S55 V73 C74 L75 E76 W95 | C47-C71 HydrophobicContact CB-CB 4.24Å; C47-C71 VanDerWaalsContact SG-SG 3.62Å; S55-C71 CarbonylContact O-C 3.59Å; S55-C71 WeakPolarHBondContact O-CA 3.35Å; C71-V73 PolarHBondContact O-N 2.84Å; C71-V73 PolarHBondContact SG-N 3.35Å; C71-V73 VanDerWaalsContact SG-N 3.39Å; C71-C74 VanDerWaalsContact CB-SG 3.55Å; C71-C74 PolarHBondContact SG-N 2.82Å; C71-L75 WeakPolarHBondContact O-CA 3.49Å; C71-L75 PolarHBondContact O-N 2.94Å; C71-E76 PolarHBondContact N-O 2.87Å; C71-W95 HydrophobicContact CB-CH2 4.23Å |
| 72 | T | 92.8 | Very high | 95.2 | Very high | 82 Ų | 82 | 68.4 Ų | 68.4 | 50% | 0.503 | 36% | 0.364 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.9 | -12.9 | 177.5 | 58.1 | 0 | 0 | 0 | 0 | 114.5 | S55 D57 | S55-T72 PolarHBondContact O-N 2.74Å; S55-T72 PolarHBondContact O-OG1 3.27Å; D57-T72 WeakPolarHBondContact OD2-CG2 3.49Å |
| 73 | V | 94.7 | Very high | 95.3 | Very high | 74 Ų | 74 | 67.6 Ų | 67.6 | 45% | 0.448 | 37% | 0.369 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -101 | -53.2 | -177 | 179.2 | 0 | 0 | 0 | 0 | 112.3 | H52 C71 | H52-V73 HydrophobicContact CB-CG2 4.1Å; C71-V73 PolarHBondContact O-N 2.84Å; C71-V73 PolarHBondContact SG-N 3.35Å; C71-V73 VanDerWaalsContact SG-N 3.39Å |
| 74 | C | 95.3 | Very high | 95.2 | Very high | 51 Ų | 51 | 72.8 Ų | 72.8 | 35% | 0.345 | 37% | 0.37 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -94.3 | -6.2 | 178.6 | 68.9 | 0 | 0 | 0 | 0 | 114.1 | C50 C71 E76 | C50-C74 HydrophobicContact CB-CB 3.97Å; C71-C74 VanDerWaalsContact CB-SG 3.55Å; C71-C74 PolarHBondContact SG-N 2.82Å; C74-E76 PolarHBondContact O-N 3.02Å |
| 75 | L | 93.3 | Very high | 95.2 | Very high | 144 Ų | 144 | 70.9 Ų | 70.9 | 75% | 0.754 | 37% | 0.373 | S | S | * | . | trans | 62.2 | 18.5 | 177.7 | -51.2 | 179.1 | 0 | 0 | 0 | 115.1 | C71 | C71-L75 WeakPolarHBondContact O-CA 3.49Å; C71-L75 PolarHBondContact O-N 2.94Å | ||
| 76 | E | 92.8 | Very high | 95 | Very high | 91 Ų | 91 | 67.5 Ų | 67.5 | 43% | 0.425 | 36% | 0.357 | S | S | . | . | trans | -75.3 | 139.9 | 172.9 | -165.5 | 56.7 | -100.1 | 0 | 0 | 110.6 | F49 S70 C71 C74 W95 | F49-E76 HydrophobicContact CD2-CB 4.21Å; F49-E76 HydrophobicContact CD2-CG 3.98Å; F49-E76 HydrophobicContact CE2-CB 4.39Å; F49-E76 HydrophobicContact CE2-CG 3.69Å; F49-E76 HydrophobicContact CZ-CG 4.09Å; S70-E76 CarbonylContact C-O 3.58Å; S70-E76 WeakPolarHBondContact CA-O 3.29Å; C71-E76 PolarHBondContact N-O 2.87Å; C74-E76 PolarHBondContact O-N 3.02Å; E76-W95 HydrophobicContact CB-CZ2 4.32Å; E76-W95 HydrophobicContact CG-CZ2 4.21Å | ||
| 77 | E | 94.3 | Very high | 94.9 | Very high | 126 Ų | 126 | 72.2 Ų | 72.2 | 59% | 0.589 | 38% | 0.377 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -131.9 | 137.3 | -177.5 | -175.1 | 176.4 | 88.6 | 0 | 0 | 110.9 | V68 I69 | V68-E77 HydrophobicContact CG1-CG 3.6Å; I69-E77 CarbonylContact O-C 3.59Å; I69-E77 WeakPolarHBondContact O-CA 3.45Å |
| 78 | F | 95.4 | Very high | 94.7 | Very high | 54 Ų | 54 | 74 Ų | 74 | 24% | 0.237 | 39% | 0.389 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.9 | 148.6 | 176.2 | 175 | -105.7 | 0 | 0 | 0 | 111.5 | V68 I69 D94 W95 A98 | V68-F78 WeakPolarHBondContact CA-O 3.41Å; I69-F78 HydrophobicContact CG2-CB 3.92Å; I69-F78 HydrophobicContact CG2-CD1 4.04Å; I69-F78 PolarHBondContact N-O 3.31Å; I69-F78 PolarHBondContact O-N 3.08Å; F78-D94 HydrophobicContact CE1-CB 4.18Å; F78-W95 HydrophobicContact CB-CD2 4.35Å; F78-W95 HydrophobicContact CB-CG 3.88Å; F78-W95 VanDerWaalsContact CB-NE1 3.32Å; F78-W95 HydrophobicContact CD1-CB 3.61Å; F78-W95 AromaticContact CD1-CD1 3.59Å; F78-W95 AromaticContact CD1-CG 3.78Å; F78-W95 HydrophobicContact CD1-CG 3.78Å; F78-W95 HydrophobicContact CE1-CB 4.05Å; F78-W95 HydrophobicContact CG-CB 4.31Å; F78-W95 AromaticContact CG-CD1 3.36Å; F78-W95 AromaticContact CG-CG 3.99Å; F78-W95 HydrophobicContact CG-CG 3.99Å; F78-W95 AromaticContact CG-NE1 3.95Å; F78-A98 HydrophobicContact CE1-CB 4.41Å; F78-A98 HydrophobicContact CE2-CB 3.69Å; F78-A98 HydrophobicContact CZ-CB 3.62Å |
| 79 | Q | 96.8 | Very high | 94.6 | Very high | 124 Ų | 124 | 75.9 Ų | 75.9 | 58% | 0.579 | 40% | 0.4 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -129.7 | 126.5 | -177.2 | -172.1 | -174.4 | -78.1 | 0 | 0 | 110.7 | T66 G67 V68 | T66-Q79 HydrophobicContact CG2-CG 3.29Å; G67-Q79 WeakPolarHBondContact O-CA 3.45Å; V68-Q79 HydrophobicContact CG2-CG 4.12Å |
| 80 | T | 96.9 | Very high | 94.6 | Very high | 12 Ų | 12 | 78.9 Ų | 78.9 | 7% | 0.074 | 42% | 0.416 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.7 | 146.7 | 177 | -172.9 | 0 | 0 | 0 | 0 | 111.4 | G67 I82 V91 D94 | G67-T80 PolarHBondContact N-O 2.9Å; G67-T80 PolarHBondContact O-N 2.93Å; T80-I82 HydrophobicContact CG2-CG2 4.28Å; T80-V91 HydrophobicContact CG2-CB 4.09Å; T80-V91 HydrophobicContact CG2-CG1 3.85Å; T80-V91 HydrophobicContact CG2-CG2 3.82Å; T80-D94 WeakPolarHBondContact CB-OD2 3.3Å; T80-D94 HydrophobicContact CG2-CB 4.16Å; T80-D94 VanDerWaalsContact CG2-OD2 3.29Å; T80-D94 WeakPolarHBondContact CG2-OD2 3.42Å; T80-D94 PolarHBondContact OG1-OD2 3.49Å |
| 81 | P | 97.3 | Very high | 94.6 | Very high | 110 Ų | 110 | 77 Ų | 77 | 71% | 0.714 | 40% | 0.403 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -64.3 | 135.7 | 170 | 27.1 | -36 | 0 | 0 | 0 | 112.1 | N65 | N65-P81 CarbonylContact O-C 3.6Å; N65-P81 WeakPolarHBondContact O-CA 3.44Å |
| 82 | I | 97.2 | Very high | 94.7 | Very high | 6 Ų | 6 | 79.3 Ų | 79.3 | 3% | 0.031 | 41% | 0.412 | C | S | . | . | trans | -122.1 | 145.6 | 177.3 | 63.2 | 174.3 | 0 | 0 | 0 | 112.6 | M60 N65 T66 T80 V91 | M60-I82 HydrophobicContact CB-CD1 3.91Å; M60-I82 HydrophobicContact CE-CB 4.4Å; M60-I82 HydrophobicContact CE-CD1 3.82Å; M60-I82 HydrophobicContact CE-CG2 4.03Å; M60-I82 HydrophobicContact CG-CD1 4.42Å; M60-I82 HydrophobicContact SD-CD1 3.76Å; M60-I82 HydrophobicContact SD-CG2 4.34Å; N65-I82 WeakPolarHBondContact CA-O 3.47Å; N65-I82 VanDerWaalsContact CB-O 3.32Å; N65-I82 WeakPolarHBondContact CB-O 3.38Å; N65-I82 PolarHBondContact ND2-O 3.06Å; N65-I82 PolarHBondContact O-N 2.84Å; T66-I82 WeakPolarHBondContact O-CD1 3.4Å; T80-I82 HydrophobicContact CG2-CG2 4.28Å; I82-V91 HydrophobicContact CG2-CG2 3.58Å | ||
| 83 | T | 95.4 | Very high | 94.8 | Very high | 78 Ų | 78 | 78 Ų | 78 | 48% | 0.479 | 41% | 0.406 | S | S | . | . | trans | -88.9 | -173.2 | 172.4 | 73.9 | 0 | 0 | 0 | 0 | 111 | R62 L85 S86 | R62-T83 PolarHBondContact NH1-O 2.91Å; T83-L85 PolarHBondContact OG1-N 3.12Å; T83-L85 VanDerWaalsContact OG1-N 3.12Å; T83-S86 PolarHBondContact N-OG 3.01Å; T83-S86 PolarHBondContact OG1-N 2.74Å; T83-S86 PolarHBondContact OG1-OG 3.17Å | ||
| 84 | Y | 92.3 | Very high | 94.9 | Very high | 205 Ų | 205 | 77.3 Ų | 77.3 | 80% | 0.804 | 40% | 0.4 | S | S | * | . | S | Bend | trans | -73.9 | -28.7 | 168 | -175 | -96.1 | 0 | 0 | 0 | 112.6 | ||
| 85 | L | 94.4 | Very high | 94.9 | Very high | 151 Ų | 151 | 75.1 Ų | 75.1 | 79% | 0.791 | 38% | 0.384 | S | S | * | . | S | Bend | trans | -81.2 | -21.6 | -179.2 | -65.3 | 174.1 | 0 | 0 | 0 | 112.8 | T83 | T83-L85 PolarHBondContact OG1-N 3.12Å; T83-L85 VanDerWaalsContact OG1-N 3.12Å |
| 86 | S | 93.5 | Very high | 95 | Very high | 19 Ų | 19 | 70.1 Ų | 70.1 | 13% | 0.133 | 36% | 0.358 | C | S | . | . | trans | -62.5 | 137.2 | -174.5 | -54.7 | 0 | 0 | 0 | 0 | 112.4 | M60 R62 T83 D90 | M60-S86 WeakPolarHBondContact CE-O 3.3Å; R62-S86 PolarHBondContact NH1-O 2.9Å; R62-S86 PolarHBondContact NH2-O 2.92Å; T83-S86 PolarHBondContact N-OG 3.01Å; T83-S86 PolarHBondContact OG1-N 2.74Å; T83-S86 PolarHBondContact OG1-OG 3.17Å; S86-D90 WeakPolarHBondContact CA-OD2 3.37Å | ||
| 87 | E | 93.8 | Very high | 95.1 | Very high | 124 Ų | 124 | 70.5 Ų | 70.5 | 58% | 0.579 | 36% | 0.363 | S | S | * | . | trans | -104.1 | 163.9 | 176.5 | -62.8 | -160.2 | 115.2 | 0 | 0 | 111 | M60 V89 D90 | M60-E87 WeakPolarHBondContact CE-O 3.41Å; E87-V89 HydrophobicContact CB-CG1 4Å; E87-V89 PolarHBondContact O-N 2.75Å; E87-V89 VanDerWaalsContact O-N 3.13Å; E87-D90 PolarHBondContact N-OD2 3.33Å; E87-D90 WeakPolarHBondContact O-CB 3.34Å; E87-D90 PolarHBondContact O-N 2.76Å | ||
| 88 | P | 92.3 | Very high | 95.1 | Very high | 38 Ų | 38 | 66.2 Ų | 66.2 | 25% | 0.247 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -61.1 | -20.8 | 179.4 | -24.5 | 35.2 | 0 | 0 | 0 | 114.2 | T43 F45 V58 M60 Y92 | T43-P88 HydrophobicContact CG2-CB 4.22Å; F45-P88 HydrophobicContact CE2-CB 4.41Å; V58-P88 HydrophobicContact CB-CB 4.11Å; V58-P88 HydrophobicContact CG1-CB 3.91Å; M60-P88 HydrophobicContact CG-CG 4.39Å; P88-Y92 PolarHBondContact O-N 3.03Å |
| 89 | V | 93.8 | Very high | 94.9 | Very high | 64 Ų | 64 | 64.5 Ų | 64.5 | 39% | 0.388 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -70.2 | -33.5 | 173.7 | 62.2 | 0 | 0 | 0 | 0 | 112.3 | F45 E87 V91 Y92 S93 | F45-V89 HydrophobicContact CE1-CB 4.28Å; F45-V89 HydrophobicContact CE1-CG2 4.23Å; F45-V89 HydrophobicContact CZ-CB 4.05Å; F45-V89 HydrophobicContact CZ-CG2 4.49Å; E87-V89 HydrophobicContact CB-CG1 4Å; E87-V89 PolarHBondContact O-N 2.75Å; E87-V89 VanDerWaalsContact O-N 3.13Å; V89-V91 VanDerWaalsContact C-N 3.33Å; V89-V91 PolarHBondContact O-N 3.18Å; V89-Y92 PolarHBondContact O-N 3.18Å; V89-S93 PolarHBondContact O-N 3.13Å; V89-S93 PolarHBondContact O-OG 2.64Å |
| 90 | D | 94.8 | Very high | 94.7 | Very high | 62 Ų | 62 | 64.9 Ų | 64.9 | 33% | 0.332 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -64.1 | -42.8 | 176.9 | -54.5 | -28 | 0 | 0 | 0 | 110.2 | S86 E87 Y92 S93 D94 | S86-D90 WeakPolarHBondContact CA-OD2 3.37Å; E87-D90 PolarHBondContact N-OD2 3.33Å; E87-D90 WeakPolarHBondContact O-CB 3.34Å; E87-D90 PolarHBondContact O-N 2.76Å; D90-Y92 VanDerWaalsContact C-N 3.26Å; D90-Y92 PolarHBondContact O-N 3.23Å; D90-S93 PolarHBondContact O-N 2.86Å; D90-D94 WeakPolarHBondContact O-CB 3.22Å; D90-D94 PolarHBondContact O-N 2.93Å |
| 91 | V | 95.4 | Very high | 94.5 | Very high | 0 Ų | 0 | 67.5 Ų | 67.5 | 0% | 0 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -62.2 | -34 | 176.3 | 177 | 0 | 0 | 0 | 0 | 112.2 | V58 M60 I69 T80 I82 V89 W95 | V58-V91 HydrophobicContact CG1-CB 4.07Å; V58-V91 HydrophobicContact CG1-CG1 4.01Å; V58-V91 HydrophobicContact CG1-CG2 4.41Å; M60-V91 HydrophobicContact CE-CG2 3.87Å; M60-V91 HydrophobicContact SD-CG2 3.6Å; M60-V91 VanDerWaalsContact SD-CG2 3.6Å; I69-V91 HydrophobicContact CB-CG1 3.93Å; I69-V91 HydrophobicContact CG2-CG1 3.99Å; T80-V91 HydrophobicContact CG2-CB 4.09Å; T80-V91 HydrophobicContact CG2-CG1 3.85Å; T80-V91 HydrophobicContact CG2-CG2 3.82Å; I82-V91 HydrophobicContact CG2-CG2 3.58Å; V89-V91 VanDerWaalsContact C-N 3.33Å; V89-V91 PolarHBondContact O-N 3.18Å; V91-W95 PolarHBondContact O-N 3.47Å |
| 92 | Y | 95.8 | Very high | 94.1 | Very high | 51 Ų | 51 | 66.1 Ų | 66.1 | 20% | 0.2 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -71.2 | -44.5 | 174.3 | 175.3 | -101.9 | 0 | 0 | 0 | 111.5 | F45 T46 I69 P88 V89 D90 W95 I96 | F45-Y92 HydrophobicContact CB-CD2 3.55Å; F45-Y92 HydrophobicContact CB-CE2 3.67Å; F45-Y92 HydrophobicContact CB-CG 4.05Å; F45-Y92 AromaticContact CD1-CD1 3.73Å; F45-Y92 HydrophobicContact CD1-CD1 3.73Å; F45-Y92 HydrophobicContact CD1-CD2 4.06Å; F45-Y92 HydrophobicContact CD1-CE1 4.21Å; F45-Y92 AromaticContact CD1-CG 3.63Å; F45-Y92 HydrophobicContact CD1-CG 3.63Å; F45-Y92 HydrophobicContact CD2-CD2 4.25Å; F45-Y92 HydrophobicContact CD2-CG 4.19Å; F45-Y92 HydrophobicContact CE1-CD1 4.13Å; F45-Y92 HydrophobicContact CE1-CG 4.09Å; F45-Y92 HydrophobicContact CG-CD1 4.25Å; F45-Y92 AromaticContact CG-CD2 3.71Å; F45-Y92 HydrophobicContact CG-CD2 3.71Å; F45-Y92 HydrophobicContact CG-CE2 4.25Å; F45-Y92 AromaticContact CG-CG 3.7Å; F45-Y92 HydrophobicContact CG-CG 3.7Å; T46-Y92 VanDerWaalsContact O-CE2 3.3Å; T46-Y92 WeakPolarHBondContact O-CE2 3.39Å; T46-Y92 PolarHBondContact O-OH 3.5Å; T46-Y92 VanDerWaalsContact O-OH 3.06Å; I69-Y92 HydrophobicContact CD1-CD2 3.79Å; I69-Y92 HydrophobicContact CD1-CG 4.46Å; P88-Y92 PolarHBondContact O-N 3.03Å; V89-Y92 PolarHBondContact O-N 3.18Å; D90-Y92 VanDerWaalsContact C-N 3.26Å; D90-Y92 PolarHBondContact O-N 3.23Å; Y92-W95 HydrophobicContact CD2-CE3 4.29Å; Y92-W95 WeakPolarHBondContact O-CB 3.46Å; Y92-W95 PolarHBondContact O-N 2.98Å; Y92-W95 VanDerWaalsContact O-N 3.17Å; Y92-I96 HydrophobicContact CD1-CG1 4.47Å; Y92-I96 HydrophobicContact CE1-CD1 4.38Å; Y92-I96 HydrophobicContact CE1-CG1 4.01Å; Y92-I96 HydrophobicContact CE2-CD1 4.04Å; Y92-I96 HydrophobicContact CE2-CG1 4.34Å; Y92-I96 WeakPolarHBondContact O-CG1 3.44Å; Y92-I96 PolarHBondContact O-N 2.96Å; Y92-I96 VanDerWaalsContact O-N 3.1Å |
| 93 | S | 95.2 | Very high | 93.4 | Very high | 54 Ų | 54 | 72.2 Ų | 72.2 | 38% | 0.378 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -59.9 | -48.6 | 175.5 | -60.7 | 0 | 0 | 0 | 0 | 112 | V89 D90 W95 I96 D97 | V89-S93 PolarHBondContact O-N 3.13Å; V89-S93 PolarHBondContact O-OG 2.64Å; D90-S93 PolarHBondContact O-N 2.86Å; S93-W95 PolarHBondContact O-N 3.33Å; S93-W95 VanDerWaalsContact O-N 3.16Å; S93-I96 PolarHBondContact O-N 3.03Å; S93-D97 PolarHBondContact O-N 3.1Å |
| 94 | D | 96.7 | Very high | 92.2 | Very high | 60 Ų | 60 | 79.6 Ų | 79.6 | 32% | 0.321 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -54 | -35.6 | 174.9 | -74.4 | -5.2 | 0 | 0 | 0 | 112 | F78 T80 D90 A98 | F78-D94 HydrophobicContact CE1-CB 4.18Å; T80-D94 WeakPolarHBondContact CB-OD2 3.3Å; T80-D94 HydrophobicContact CG2-CB 4.16Å; T80-D94 VanDerWaalsContact CG2-OD2 3.29Å; T80-D94 WeakPolarHBondContact CG2-OD2 3.42Å; T80-D94 PolarHBondContact OG1-OD2 3.49Å; D90-D94 WeakPolarHBondContact O-CB 3.22Å; D90-D94 PolarHBondContact O-N 2.93Å; D94-A98 VanDerWaalsContact O-CB 3.22Å; D94-A98 WeakPolarHBondContact O-CB 3.49Å; D94-A98 PolarHBondContact O-N 3.16Å |
| 95 | W | 95.8 | Very high | 92.2 | Very high | 5 Ų | 5 | 73.4 Ų | 73.4 | 2% | 0.019 | 41% | 0.409 | C | S | . | . | H | α-helix | trans | -71.8 | -40 | 177.9 | -170.9 | 29.2 | 0 | 0 | 0 | 112.5 | P48 F49 C56 I69 C71 E76 F78 V91 Y92 S93 A98 C99 | P48-W95 HydrophobicContact CG-CD2 4.45Å; P48-W95 HydrophobicContact CG-CE3 4.36Å; P48-W95 HydrophobicContact CG-CZ3 4.47Å; F49-W95 AromaticContact CD2-CZ2 3.96Å; F49-W95 HydrophobicContact CD2-CZ2 3.96Å; F49-W95 AromaticContact CE2-CE2 3.83Å; F49-W95 AromaticContact CE2-CZ2 3.66Å; F49-W95 HydrophobicContact CE2-CZ2 3.66Å; F49-W95 AromaticContact CE2-NE1 3.77Å; C56-W95 HydrophobicContact CB-CZ3 4.27Å; I69-W95 HydrophobicContact CB-CE3 4.5Å; I69-W95 HydrophobicContact CD1-CD2 4.4Å; I69-W95 HydrophobicContact CD1-CE3 3.45Å; I69-W95 VanDerWaalsContact CD1-CE3 3.45Å; I69-W95 HydrophobicContact CD1-CZ3 3.7Å; I69-W95 HydrophobicContact CG1-CE3 3.8Å; I69-W95 HydrophobicContact CG1-CH2 4.49Å; I69-W95 HydrophobicContact CG1-CZ3 3.76Å; I69-W95 HydrophobicContact CG2-CB 4.01Å; I69-W95 HydrophobicContact CG2-CD2 3.78Å; I69-W95 HydrophobicContact CG2-CE3 3.89Å; I69-W95 HydrophobicContact CG2-CG 3.9Å; I69-W95 HydrophobicContact CG2-CZ3 4.47Å; C71-W95 HydrophobicContact CB-CH2 4.23Å; E76-W95 HydrophobicContact CB-CZ2 4.32Å; E76-W95 HydrophobicContact CG-CZ2 4.21Å; F78-W95 HydrophobicContact CB-CD2 4.35Å; F78-W95 HydrophobicContact CB-CG 3.88Å; F78-W95 VanDerWaalsContact CB-NE1 3.32Å; F78-W95 HydrophobicContact CD1-CB 3.61Å; F78-W95 AromaticContact CD1-CD1 3.59Å; F78-W95 AromaticContact CD1-CG 3.78Å; F78-W95 HydrophobicContact CD1-CG 3.78Å; F78-W95 HydrophobicContact CE1-CB 4.05Å; F78-W95 HydrophobicContact CG-CB 4.31Å; F78-W95 AromaticContact CG-CD1 3.36Å; F78-W95 AromaticContact CG-CG 3.99Å; F78-W95 HydrophobicContact CG-CG 3.99Å; F78-W95 AromaticContact CG-NE1 3.95Å; V91-W95 PolarHBondContact O-N 3.47Å; Y92-W95 HydrophobicContact CD2-CE3 4.29Å; Y92-W95 WeakPolarHBondContact O-CB 3.46Å; Y92-W95 PolarHBondContact O-N 2.98Å; Y92-W95 VanDerWaalsContact O-N 3.17Å; S93-W95 PolarHBondContact O-N 3.33Å; S93-W95 VanDerWaalsContact O-N 3.16Å; W95-A98 PolarHBondContact O-N 3.17Å; W95-C99 WeakPolarHBondContact O-CB 3.13Å; W95-C99 PolarHBondContact O-N 2.96Å; W95-C99 PolarHBondContact O-SG 3.07Å |
| 96 | I | 95.4 | Very high | 92.1 | Very high | 39 Ų | 39 | 69.3 Ų | 69.3 | 20% | 0.2 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -62.1 | -50.5 | 173.7 | -59.5 | -56.8 | 0 | 0 | 0 | 109.9 | P48 Y92 S93 A98 C99 E100 | P48-I96 HydrophobicContact CB-CD1 3.75Å; P48-I96 HydrophobicContact CG-CD1 3.81Å; Y92-I96 HydrophobicContact CD1-CG1 4.47Å; Y92-I96 HydrophobicContact CE1-CD1 4.38Å; Y92-I96 HydrophobicContact CE1-CG1 4.01Å; Y92-I96 HydrophobicContact CE2-CD1 4.04Å; Y92-I96 HydrophobicContact CE2-CG1 4.34Å; Y92-I96 WeakPolarHBondContact O-CG1 3.44Å; Y92-I96 PolarHBondContact O-N 2.96Å; Y92-I96 VanDerWaalsContact O-N 3.1Å; S93-I96 PolarHBondContact O-N 3.03Å; I96-A98 VanDerWaalsContact C-N 3.3Å; I96-A98 PolarHBondContact O-N 3.31Å; I96-C99 WeakPolarHBondContact O-CA 3.22Å; I96-C99 WeakPolarHBondContact O-CB 3.46Å; I96-C99 PolarHBondContact O-N 3.48Å; I96-E100 PolarHBondContact O-N 3.4Å |
| 97 | D | 95.3 | Very high | 92 | Very high | 99 Ų | 99 | 72.1 Ų | 72.1 | 53% | 0.529 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -59.3 | -40.9 | 179.7 | -68.4 | -6.9 | 0 | 0 | 0 | 111.6 | S93 E100 A101 | S93-D97 PolarHBondContact O-N 3.1Å; D97-E100 PolarHBondContact O-N 2.89Å; D97-A101 WeakPolarHBondContact O-CB 3.34Å; D97-A101 PolarHBondContact O-N 2.75Å |
| 98 | A | 93.8 | Very high | 91.9 | Very high | 36 Ų | 36 | 69 Ų | 69 | 30% | 0.298 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -66.3 | -36.1 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113 | F78 D94 W95 I96 A102 | F78-A98 HydrophobicContact CE1-CB 4.41Å; F78-A98 HydrophobicContact CE2-CB 3.69Å; F78-A98 HydrophobicContact CZ-CB 3.62Å; D94-A98 VanDerWaalsContact O-CB 3.22Å; D94-A98 WeakPolarHBondContact O-CB 3.49Å; D94-A98 PolarHBondContact O-N 3.16Å; W95-A98 PolarHBondContact O-N 3.17Å; I96-A98 VanDerWaalsContact C-N 3.3Å; I96-A98 PolarHBondContact O-N 3.31Å; A98-A102 WeakPolarHBondContact O-CB 3.48Å; A98-A102 PolarHBondContact O-N 3.46Å; A98-A102 VanDerWaalsContact O-N 3.11Å |
| 99 | C | 91.3 | Very high | 91.9 | Very high | 17 Ų | 17 | 70.9 Ų | 70.9 | 12% | 0.115 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -67.4 | -41.9 | 173.9 | -68.7 | 0 | 0 | 0 | 0 | 111.6 | F49 W95 I96 A102 N103 | F49-C99 WeakPolarHBondContact CZ-SG 3.48Å; W95-C99 WeakPolarHBondContact O-CB 3.13Å; W95-C99 PolarHBondContact O-N 2.96Å; W95-C99 PolarHBondContact O-SG 3.07Å; I96-C99 WeakPolarHBondContact O-CA 3.22Å; I96-C99 WeakPolarHBondContact O-CB 3.46Å; I96-C99 PolarHBondContact O-N 3.48Å; C99-A102 PolarHBondContact O-N 3.02Å; C99-N103 PolarHBondContact O-N 3.11Å; C99-N103 PolarHBondContact O-ND2 2.95Å |
| 100 | E | 91.7 | Very high | 91.8 | Very high | 132 Ų | 132 | 71.4 Ų | 71.4 | 62% | 0.617 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -64.5 | -46.8 | 176.8 | -69.2 | -173.9 | -173.9 | 0 | 0 | 111 | I96 D97 A102 N103 | I96-E100 PolarHBondContact O-N 3.4Å; D97-E100 PolarHBondContact O-N 2.89Å; E100-A102 VanDerWaalsContact C-N 3.29Å; E100-A102 PolarHBondContact O-N 3.14Å; E100-N103 PolarHBondContact O-N 2.94Å; E100-N103 VanDerWaalsContact O-N 3.14Å |
| 101 | A | 92.5 | Very high | 91.6 | Very high | 67 Ų | 67 | 72.1 Ų | 72.1 | 55% | 0.554 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -63.4 | -30.1 | 178.8 | 0 | 0 | 0 | 0 | 0 | 114 | D97 N103 | D97-A101 WeakPolarHBondContact O-CB 3.34Å; D97-A101 PolarHBondContact O-N 2.75Å; A101-N103 VanDerWaalsContact C-N 3.33Å |
| 102 | A | 89.8 | Confident | 91.3 | Very high | 81 Ų | 81 | 77.6 Ų | 77.6 | 67% | 0.669 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -77.3 | -15.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114 | A98 C99 E100 | A98-A102 WeakPolarHBondContact O-CB 3.48Å; A98-A102 PolarHBondContact O-N 3.46Å; A98-A102 VanDerWaalsContact O-N 3.11Å; C99-A102 PolarHBondContact O-N 3.02Å; E100-A102 VanDerWaalsContact C-N 3.29Å; E100-A102 PolarHBondContact O-N 3.14Å |
| 103 | N | 82.8 | Confident | 90.9 | Very high | 134 Ų | 134 | 79.8 Ų | 79.8 | 72% | 0.717 | 46% | 0.459 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -106.8 | 20.7 | -176 | -74.1 | -63.6 | 0 | 0 | 0 | 113.4 | C99 E100 A101 | C99-N103 PolarHBondContact O-N 3.11Å; C99-N103 PolarHBondContact O-ND2 2.95Å; E100-N103 PolarHBondContact O-N 2.94Å; E100-N103 VanDerWaalsContact O-N 3.14Å; A101-N103 VanDerWaalsContact C-N 3.33Å |
| 104 | Q | 70.7 | Confident | 90.5 | Very high | 234 Ų | 234 | 82.2 Ų | 82.2 | 100% | 1.093 | 47% | 0.467 | S | S | * | . | trans | -113.8 | 0 | -175.9 | -170.6 | -172.8 | -114 | 0 | 0 | 112.6 |
Retrieved 104 of 104 residues in 60.7 ms
(Link to these results)