| 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 | 36.1 | Very low | 36.4 | Very low | 251 Ų | 251 | 135.5 Ų | 135.5 | 100% | 1.236 | 85% | 0.845 | S | S | * | * | 0 | 97.3 | 0 | -64.1 | 177.2 | 175.2 | 0 | 0 | 105 | |||||
| 2 | G | 37.5 | Very low | 36.4 | Very low | 69 Ų | 69 | 135.7 Ų | 135.7 | 71% | 0.711 | 85% | 0.845 | S | S | * | * | 113.7 | 111.1 | 53.6 | 0 | 0 | 0 | 0 | 0 | 105.8 | |||||
| 3 | N | 30.7 | Very low | 36.2 | Very low | 159 Ų | 159 | 143.3 Ų | 143.3 | 85% | 0.85 | 85% | 0.849 | S | S | * | * | trans | 149.9 | 140.7 | 156.9 | -84.1 | 0.1 | 0 | 0 | 0 | 110.3 | ||||
| 4 | T | 34 | Very low | 36.3 | Very low | 120 Ų | 120 | 141.7 Ų | 141.7 | 74% | 0.736 | 84% | 0.844 | S | S | * | * | cis | -168.8 | 139.2 | -15.8 | 16.6 | 0 | 0 | 0 | 0 | 103.1 | G6 | T4-G6 PolarHBondContact O-N 3.42Š| ||
| 5 | L | 37.8 | Very low | 36.4 | Very low | 179 Ų | 179 | 148.6 Ų | 148.6 | 94% | 0.937 | 85% | 0.849 | S | S | * | * | trans | -60.2 | 126.6 | 174 | -77.5 | 132.2 | 0 | 0 | 0 | 111.3 | ||||
| 6 | G | 34.3 | Very low | 36.4 | Very low | 76 Ų | 76 | 153.6 Ų | 153.6 | 78% | 0.784 | 85% | 0.85 | S | S | * | * | trans | -114.1 | 108.2 | 161.5 | 0 | 0 | 0 | 0 | 0 | 109.1 | T4 | T4-G6 PolarHBondContact O-N 3.42Š| ||
| 7 | L | 34.8 | Very low | 36.4 | Very low | 170 Ų | 170 | 149.8 Ų | 149.8 | 89% | 0.89 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -59.5 | 130.5 | 177.7 | -80.7 | 139 | 0 | 0 | 0 | 111.4 | ||
| 8 | A | 37.3 | Very low | 36.7 | Very low | 87 Ų | 87 | 148.4 Ų | 148.4 | 72% | 0.719 | 84% | 0.836 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 137.5 | 169.9 | 0 | 0 | 0 | 0 | 0 | 110.4 | M10 | A8-M10 PolarHBondContact O-N 3.3Š|
| 9 | P | 38.8 | Very low | 37 | Very low | 129 Ų | 129 | 151.8 Ų | 151.8 | 84% | 0.838 | 83% | 0.834 | S | S | * | * | P | Polyproline II helix | trans | -69.2 | 130 | 173.2 | -6.2 | 20.8 | 0 | 0 | 0 | 109.7 | ||
| 10 | M | 38.9 | Very low | 37.3 | Very low | 183 Ų | 183 | 156.4 Ų | 156.4 | 90% | 0.901 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -57.5 | 137.7 | 170.5 | -77.5 | -132.4 | -84.9 | 0 | 0 | 110.9 | A8 T12 | A8-M10 PolarHBondContact O-N 3.3Å; M10-T12 PolarHBondContact O-N 3.42Å |
| 11 | G | 39.8 | Very low | 38.3 | Very low | 67 Ų | 67 | 157.5 Ų | 157.5 | 69% | 0.691 | 84% | 0.838 | S | S | * | * | P | Polyproline II helix | trans | -49.3 | 124.1 | -176.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | W13 | G11-W13 PolarHBondContact O-N 3.3Š|
| 12 | T | 36.7 | Very low | 39.7 | Very low | 138 Ų | 138 | 152.3 Ų | 152.3 | 85% | 0.847 | 81% | 0.811 | S | S | * | * | trans | -74.4 | 109.2 | 166.9 | 42.9 | 0 | 0 | 0 | 0 | 108.5 | M10 | M10-T12 PolarHBondContact O-N 3.42Š| ||
| 13 | W | 33.8 | Very low | 41.5 | Very low | 235 Ų | 235 | 154.5 Ų | 154.5 | 89% | 0.89 | 81% | 0.813 | S | S | * | * | trans | -57.3 | 134.3 | 165.4 | -68.7 | 69.2 | 0 | 0 | 0 | 108.5 | G11 R15 | G11-W13 PolarHBondContact O-N 3.3Å; W13-R15 PolarHBondContact O-N 3.02Å | ||
| 14 | P | 38.1 | Very low | 44 | Very low | 121 Ų | 121 | 149.4 Ų | 149.4 | 79% | 0.786 | 79% | 0.785 | S | S | * | * | trans | -63.3 | 111.5 | 176.8 | 23.8 | -30 | 0 | 0 | 0 | 108.2 | R16 | P14-R16 PolarHBondContact O-N 3.37Š| ||
| 15 | R | 37.1 | Very low | 46.4 | Very low | 245 Ų | 245 | 146.7 Ų | 146.7 | 93% | 0.925 | 77% | 0.77 | S | S | * | * | trans | -51.2 | 108.4 | 164.3 | -95.9 | 178.1 | 160.9 | -174.4 | -5.5 | 106.5 | W13 S17 | W13-R15 PolarHBondContact O-N 3.02Å; R15-S17 PolarHBondContact O-N 3.44Å | ||
| 16 | R | 36.9 | Very low | 48.8 | Very low | 229 Ų | 229 | 140.9 Ų | 140.9 | 86% | 0.864 | 74% | 0.739 | S | S | * | * | trans | -53.8 | 108.9 | 161.8 | -81.5 | 179.7 | 171.2 | 176.8 | -1.8 | 105.6 | P14 | P14-R16 PolarHBondContact O-N 3.37Š| ||
| 17 | S | 36.7 | Very low | 51.2 | Low | 89 Ų | 89 | 137.5 Ų | 137.5 | 62% | 0.622 | 70% | 0.703 | S | S | * | * | trans | -45.9 | 135.5 | 159.7 | 48.2 | 0 | 0 | 0 | 0 | 107.2 | R15 R19 | R15-S17 PolarHBondContact O-N 3.44Å; S17-R19 PolarHBondContact O-N 3.2Å | ||
| 18 | P | 41.8 | Very low | 53.7 | Low | 125 Ų | 125 | 130.1 Ų | 130.1 | 81% | 0.812 | 67% | 0.668 | S | S | * | * | trans | -52.5 | 117.6 | 166.5 | 5.1 | -0.6 | 0 | 0 | 0 | 105.1 | R20 | P18-R20 PolarHBondContact O-N 3.22Š| ||
| 19 | R | 42.4 | Very low | 56 | Low | 213 Ų | 213 | 126.4 Ų | 126.4 | 80% | 0.804 | 64% | 0.637 | S | S | * | * | trans | -51.2 | 123.6 | 169.8 | -73.6 | 178.4 | 175.6 | 175.3 | -3.7 | 103.9 | S17 E21 | S17-R19 PolarHBondContact O-N 3.2Å; R19-E21 PolarHBondContact O-N 2.94Å | ||
| 20 | R | 43.3 | Very low | 58.3 | Low | 243 Ų | 243 | 121 Ų | 121 | 92% | 0.917 | 60% | 0.601 | S | S | * | * | trans | -53.8 | 99.2 | 172.6 | -167 | 178.2 | -171.4 | 179 | 1.3 | 104.8 | P18 E22 | P18-R20 PolarHBondContact O-N 3.22Å; R20-E22 PolarHBondContact O-N 2.93Å; R20-E22 VanDerWaalsContact O-N 3.09Å | ||
| 21 | E | 57.5 | Low | 60.5 | Low | 180 Ų | 180 | 117.7 Ų | 117.7 | 84% | 0.841 | 59% | 0.587 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 119.7 | -179.3 | -76.3 | 175.6 | 167.7 | 0 | 0 | 104.8 | R19 | R19-E21 PolarHBondContact O-N 2.94Š|
| 22 | E | 65.3 | Low | 62.7 | Low | 142 Ų | 142 | 118 Ų | 118 | 66% | 0.664 | 57% | 0.57 | S | S | * | * | P | Polyproline II helix | trans | -56.4 | 130.3 | 174.9 | -74.6 | 178.2 | 168.3 | 0 | 0 | 106.7 | R20 L24 | R20-E22 PolarHBondContact O-N 2.93Å; R20-E22 VanDerWaalsContact O-N 3.09Å; E22-L24 PolarHBondContact O-N 2.91Å; E22-L24 VanDerWaalsContact O-N 3.14Å |
| 23 | P | 76 | Confident | 65.2 | Low | 115 Ų | 115 | 111.7 Ų | 111.7 | 75% | 0.747 | 53% | 0.531 | S | S | * | . | P | Polyproline II helix | trans | -56.5 | 127.3 | -176.9 | 22.3 | -31.5 | 0 | 0 | 0 | 108.5 | ||
| 24 | L | 83.4 | Confident | 67.9 | Low | 51 Ų | 51 | 101.1 Ų | 101.1 | 27% | 0.267 | 49% | 0.492 | S | S | . | . | P | Polyproline II helix | trans | -61.9 | 140.9 | 178.1 | -66.9 | 174 | 0 | 0 | 0 | 108.8 | E22 D145 S171 | E22-L24 PolarHBondContact O-N 2.91Å; E22-L24 VanDerWaalsContact O-N 3.14Å; L24-D145 HydrophobicContact CB-CB 4.14Å; L24-S171 VanDerWaalsContact CD1-O 3.29Å; L24-S171 WeakPolarHBondContact CD1-O 3.32Å |
| 25 | P | 84.6 | Confident | 70.4 | Confident | 64 Ų | 64 | 101.6 Ų | 101.6 | 42% | 0.416 | 48% | 0.478 | S | S | . | . | P | Polyproline II helix | trans | -69.9 | 145.9 | 178.8 | 29.1 | -34.1 | 0 | 0 | 0 | 110.3 | S171 | P25-S171 WeakPolarHBondContact O-CB 3.47Å; P25-S171 PolarHBondContact O-OG 3Å |
| 26 | N | 86.3 | Confident | 73 | Confident | 57 Ų | 57 | 94 Ų | 94 | 31% | 0.305 | 46% | 0.455 | S | S | . | . | P | Polyproline II helix | trans | -60.3 | 134.1 | 173.9 | -179 | -71.2 | 0 | 0 | 0 | 110 | G28 G143 D144 Y146 T147 | N26-G28 PolarHBondContact O-N 3.15Å; N26-G28 WeakPolarHBondContact OD1-CA 3.42Å; N26-G28 PolarHBondContact OD1-N 3.37Å; N26-G143 PolarHBondContact ND2-O 3.48Å; N26-D144 VanDerWaalsContact CA-O 3.26Å; N26-D144 WeakPolarHBondContact CA-O 3.44Å; N26-D144 PolarHBondContact N-O 2.9Å; N26-Y146 PolarHBondContact ND2-O 3.5Å; N26-T147 PolarHBondContact ND2-OG1 3.16Å; N26-T147 PolarHBondContact OD1-OG1 3.46Å |
| 27 | P | 85.3 | Confident | 75.6 | Confident | 4 Ų | 4 | 83.2 Ų | 83.2 | 3% | 0.026 | 42% | 0.415 | C | S | . | . | trans | -70.6 | -12.9 | -174.8 | 26.3 | -34.5 | 0 | 0 | 0 | 115.3 | L169 V177 K200 | P27-L169 HydrophobicContact CB-CB 4.18Å; P27-L169 HydrophobicContact CG-CB 3.98Å; P27-V177 HydrophobicContact CB-CB 4.25Å; P27-V177 HydrophobicContact CB-CG1 3.4Å; P27-V177 VanDerWaalsContact CB-CG1 3.4Å; P27-V177 HydrophobicContact CB-CG2 3.78Å; P27-V177 HydrophobicContact CG-CG1 4.47Å; P27-K200 PolarHBondContact O-NZ 2.67Å | ||
| 28 | G | 87.3 | Confident | 78.2 | Confident | 15 Ų | 15 | 84.3 Ų | 84.3 | 16% | 0.155 | 41% | 0.408 | C | S | . | . | trans | 85.3 | -168.2 | -169.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | N26 T147 | N26-G28 PolarHBondContact O-N 3.15Å; N26-G28 WeakPolarHBondContact OD1-CA 3.42Å; N26-G28 PolarHBondContact OD1-N 3.37Å; G28-T147 VanDerWaalsContact O-CB 3.26Å; G28-T147 WeakPolarHBondContact O-CB 3.26Å; G28-T147 WeakPolarHBondContact O-CG2 3.43Å; G28-T147 PolarHBondContact O-OG1 3.32Å | ||
| 29 | S | 86.9 | Confident | 80.6 | Confident | 10 Ų | 10 | 82.3 Ų | 82.3 | 7% | 0.07 | 39% | 0.391 | C | S | . | . | trans | -85.8 | 156.6 | 174.5 | -174 | 0 | 0 | 0 | 0 | 111.9 | D31 E32 E140 | S29-D31 VanDerWaalsContact C-N 3.31Å; S29-D31 PolarHBondContact O-N 3.28Å; S29-E32 PolarHBondContact O-N 2.81Å; S29-E140 VanDerWaalsContact CB-OE1 3.32Å; S29-E140 WeakPolarHBondContact CB-OE1 3.35Å; S29-E140 PolarHBondContact OG-OE1 2.66Å | ||
| 30 | F | 86.9 | Confident | 83 | Confident | 16 Ų | 16 | 72.1 Ų | 72.1 | 7% | 0.07 | 35% | 0.352 | C | S | . | . | G | 310 helix | trans | -62.6 | -37.7 | 175.5 | -168 | -89 | 0 | 0 | 0 | 112.3 | E32 L33 H167 L169 E181 A198 | F30-E32 PolarHBondContact O-N 2.82Å; F30-E32 VanDerWaalsContact O-N 3.17Å; F30-L33 VanDerWaalsContact O-CB 3.31Å; F30-L33 WeakPolarHBondContact O-CB 3.38Å; F30-L33 PolarHBondContact O-N 3.15Å; F30-H167 HydrophobicContact CB-CB 3.86Å; F30-H167 AromaticContact CD1-CD2 3.82Å; F30-H167 AromaticContact CD1-CE1 3.93Å; F30-H167 AromaticContact CD1-NE2 3.7Å; F30-H167 HydrophobicContact CD2-CB 4.29Å; F30-H167 HydrophobicContact CG-CB 4.11Å; F30-H167 AromaticContact CG-CD2 3.92Å; F30-H167 AromaticContact CG-CG 3.82Å; F30-L169 HydrophobicContact CB-CD1 4Å; F30-L169 HydrophobicContact CD2-CD1 4.05Å; F30-L169 HydrophobicContact CD2-CD2 4.15Å; F30-L169 HydrophobicContact CD2-CG 4.01Å; F30-L169 HydrophobicContact CG-CD1 4.47Å; F30-E181 HydrophobicContact CE1-CB 3.98Å; F30-E181 HydrophobicContact CE1-CG 4.47Å; F30-E181 HydrophobicContact CE2-CB 3.98Å; F30-E181 HydrophobicContact CZ-CB 3.55Å; F30-E181 HydrophobicContact CZ-CG 4.47Å; F30-A198 HydrophobicContact CD2-CB 4.4Å; F30-A198 HydrophobicContact CE2-CB 3.45Å; F30-A198 VanDerWaalsContact CE2-CB 3.45Å; F30-A198 HydrophobicContact CZ-CB 3.97Å |
| 31 | D | 84.3 | Confident | 85.3 | Confident | 113 Ų | 113 | 61.6 Ų | 61.6 | 60% | 0.604 | 31% | 0.313 | S | S | * | . | G | 310 helix | trans | -62.7 | -24.7 | 177.6 | -65 | -27.5 | 0 | 0 | 0 | 113 | S29 L33 | S29-D31 VanDerWaalsContact C-N 3.31Å; S29-D31 PolarHBondContact O-N 3.28Å; D31-L33 VanDerWaalsContact C-N 3.34Å |
| 32 | E | 86.5 | Confident | 87 | Confident | 72 Ų | 72 | 53.5 Ų | 53.5 | 34% | 0.336 | 28% | 0.276 | S | S | . | . | G | 310 helix | trans | -86.9 | -4.4 | -177.1 | -62.2 | -170.6 | 136.6 | 0 | 0 | 113.4 | S29 F30 H34 R35 | S29-E32 PolarHBondContact O-N 2.81Å; F30-E32 PolarHBondContact O-N 2.82Å; F30-E32 VanDerWaalsContact O-N 3.17Å; E32-H34 VanDerWaalsContact C-N 3.34Å; E32-H34 PolarHBondContact O-N 3.1Å; E32-R35 HydrophobicContact CB-CB 4.43Å; E32-R35 WeakPolarHBondContact O-CB 3.33Å; E32-R35 PolarHBondContact O-N 3.09Å; E32-R35 IonicContact OE1-NH1 2.67Å; E32-R35 PolarHBondContact OE1-NH1 2.81Å |
| 33 | L | 88.9 | Confident | 88.1 | Confident | 6 Ų | 6 | 50 Ų | 50 | 3% | 0.031 | 27% | 0.271 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -58.1 | -45.5 | -174.4 | -156.1 | 79.5 | 0 | 0 | 0 | 112 | F30 D31 A198 K200 T209 N211 | F30-L33 VanDerWaalsContact O-CB 3.31Å; F30-L33 WeakPolarHBondContact O-CB 3.38Å; F30-L33 PolarHBondContact O-N 3.15Å; D31-L33 VanDerWaalsContact C-N 3.34Å; L33-A198 HydrophobicContact CD2-CB 3.92Å; L33-K200 HydrophobicContact CD1-CB 3.63Å; L33-K200 HydrophobicContact CD1-CD 4.05Å; L33-K200 HydrophobicContact CD1-CG 4.43Å; L33-K200 HydrophobicContact CG-CB 4.38Å; L33-T209 HydrophobicContact CG-CG2 4.04Å; L33-T209 VanDerWaalsContact O-CG2 3.27Å; L33-T209 WeakPolarHBondContact O-CG2 3.13Å; L33-N211 WeakPolarHBondContact CD2-OD1 3.35Å |
| 34 | H | 91.1 | Very high | 88.6 | Confident | 14 Ų | 14 | 52.4 Ų | 52.4 | 7% | 0.065 | 27% | 0.272 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -96.1 | -2.6 | 179.9 | -65 | -81.2 | 0 | 0 | 0 | 113.6 | E32 L36 C37 K38 T209 N211 H218 S220 | E32-H34 VanDerWaalsContact C-N 3.34Å; E32-H34 PolarHBondContact O-N 3.1Å; H34-L36 VanDerWaalsContact C-N 3.34Å; H34-L36 PolarHBondContact O-N 3.08Å; H34-C37 PolarHBondContact O-N 3.09Å; H34-C37 VanDerWaalsContact O-N 3.12Å; H34-K38 HydrophobicContact CB-CD 4.33Å; H34-K38 HydrophobicContact CB-CG 4.45Å; H34-K38 WeakPolarHBondContact O-CG 3.31Å; H34-K38 PolarHBondContact O-N 3.15Å; H34-T209 PolarHBondContact CE1-OG1 2.86Å; H34-T209 PolarHBondContact ND1-OG1 3.02Å; H34-N211 PolarHBondContact NE2-ND2 2.94Å; H34-N211 PolarHBondContact NE2-OD1 2.92Å; H34-H218 AromaticContact CD2-CE1 3.81Å; H34-H218 AromaticContact CD2-ND1 3.53Å; H34-H218 AromaticContact CE1-CE1 3.62Å; H34-H218 AromaticContact CE1-CG 3.9Å; H34-H218 AromaticContact CE1-ND1 3.25Å; H34-H218 PolarHBondContact CE1-ND1 3.14Å; H34-H218 AromaticContact CG-CE1 3.45Å; H34-H218 VanDerWaalsContact CG-CE1 3.45Å; H34-H218 AromaticContact CG-ND1 3.64Å; H34-H218 AromaticContact ND1-CE1 3.34Å; H34-H218 PolarHBondContact ND1-CE1 2.64Å; H34-H218 VanDerWaalsContact ND1-CE1 3.34Å; H34-H218 AromaticContact ND1-ND1 3.48Å; H34-H218 PolarHBondContact ND1-ND1 2.95Å; H34-H218 AromaticContact NE2-CE1 3.94Å; H34-H218 AromaticContact NE2-ND1 3.32Å; H34-H218 PolarHBondContact NE2-ND1 2.86Å; H34-S220 WeakPolarHBondContact ND1-CB 3.42Å; H34-S220 PolarHBondContact ND1-OG 2.73Å |
| 35 | R | 91.1 | Very high | 88.7 | Confident | 131 Ų | 131 | 51.6 Ų | 51.6 | 49% | 0.494 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -57.7 | -44.1 | -171.6 | -178.2 | 177.8 | 179 | 175.4 | 5.6 | 112.6 | E32 C37 K38 D39 | E32-R35 HydrophobicContact CB-CB 4.43Å; E32-R35 WeakPolarHBondContact O-CB 3.33Å; E32-R35 PolarHBondContact O-N 3.09Å; E32-R35 IonicContact OE1-NH1 2.67Å; E32-R35 PolarHBondContact OE1-NH1 2.81Å; R35-C37 VanDerWaalsContact C-N 3.28Å; R35-C37 PolarHBondContact O-N 2.82Å; R35-K38 PolarHBondContact O-N 3.02Å; R35-D39 IonicContact NE-OD2 3.55Å; R35-D39 WeakPolarHBondContact O-CB 3.48Å; R35-D39 VanDerWaalsContact O-CG 3.23Å; R35-D39 PolarHBondContact O-N 3.05Å |
| 36 | L | 90.3 | Very high | 88.8 | Confident | 86 Ų | 86 | 51.4 Ų | 51.4 | 45% | 0.45 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -59.3 | -38.1 | 179.4 | -68.9 | 176.6 | 0 | 0 | 0 | 113 | H34 V207 Y222 | H34-L36 VanDerWaalsContact C-N 3.34Å; H34-L36 PolarHBondContact O-N 3.08Å; L36-V207 HydrophobicContact CD1-CG2 4.09Å; L36-Y222 HydrophobicContact CB-CD1 4.44Å; L36-Y222 HydrophobicContact CB-CD2 4.34Å; L36-Y222 HydrophobicContact CB-CG 4.13Å; L36-Y222 VanDerWaalsContact O-CD2 3.28Å; L36-Y222 WeakPolarHBondContact O-CD2 3.48Å |
| 37 | C | 91.7 | Very high | 89 | Confident | 2 Ų | 2 | 49.5 Ų | 49.5 | 1% | 0.014 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -75.5 | -43.9 | 176.3 | -166 | 0 | 0 | 0 | 0 | 110.8 | H34 R35 D39 V40 F41 V233 | H34-C37 PolarHBondContact O-N 3.09Å; H34-C37 VanDerWaalsContact O-N 3.12Å; R35-C37 VanDerWaalsContact C-N 3.28Å; R35-C37 PolarHBondContact O-N 2.82Å; C37-D39 VanDerWaalsContact C-N 3.3Å; C37-D39 PolarHBondContact O-N 2.84Å; C37-V40 WeakPolarHBondContact O-CB 3.25Å; C37-V40 PolarHBondContact O-N 2.83Å; C37-V40 VanDerWaalsContact O-N 3.16Å; C37-F41 WeakPolarHBondContact O-CD2 3.49Å; C37-F41 WeakPolarHBondContact O-CE2 3.27Å; C37-V233 PolarHBondContact SG-N 3.19Å; C37-V233 PolarHBondContact SG-O 2.98Å; C37-V233 VanDerWaalsContact SG-O 3.39Å |
| 38 | K | 91.1 | Very high | 89.3 | Confident | 111 Ų | 111 | 51 Ų | 51 | 48% | 0.483 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -59.1 | -38.3 | 179.2 | -73.6 | -174.7 | 177.4 | -176.9 | 0 | 112.7 | H34 R35 V40 F41 | H34-K38 HydrophobicContact CB-CD 4.33Å; H34-K38 HydrophobicContact CB-CG 4.45Å; H34-K38 WeakPolarHBondContact O-CG 3.31Å; H34-K38 PolarHBondContact O-N 3.15Å; R35-K38 PolarHBondContact O-N 3.02Å; K38-V40 PolarHBondContact O-N 2.83Å; K38-F41 PolarHBondContact O-N 2.84Å |
| 39 | D | 91.6 | Very high | 89.6 | Confident | 83 Ų | 83 | 54.7 Ų | 54.7 | 44% | 0.444 | 28% | 0.276 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -67.4 | -19.3 | -179.8 | -72.7 | -14.8 | 0 | 0 | 0 | 113.7 | R35 C37 R262 | R35-D39 IonicContact NE-OD2 3.55Å; R35-D39 WeakPolarHBondContact O-CB 3.48Å; R35-D39 VanDerWaalsContact O-CG 3.23Å; R35-D39 PolarHBondContact O-N 3.05Å; C37-D39 VanDerWaalsContact C-N 3.3Å; C37-D39 PolarHBondContact O-N 2.84Å; D39-R262 PolarHBondContact O-NH1 3.39Å |
| 40 | V | 93.1 | Very high | 89.9 | Confident | 0 Ų | 0 | 56.9 Ų | 56.9 | 0% | 0 | 29% | 0.287 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -72.5 | -32.4 | 175.2 | 176.5 | 0 | 0 | 0 | 0 | 111.3 | C37 K38 Y222 Q230 H251 | C37-V40 WeakPolarHBondContact O-CB 3.25Å; C37-V40 PolarHBondContact O-N 2.83Å; C37-V40 VanDerWaalsContact O-N 3.16Å; K38-V40 PolarHBondContact O-N 2.83Å; V40-Y222 HydrophobicContact CG2-CD2 3.71Å; V40-Y222 HydrophobicContact CG2-CE2 3.64Å; V40-Q230 HydrophobicContact CG2-CB 4.36Å; V40-H251 HydrophobicContact CB-CB 4.4Å; V40-H251 HydrophobicContact CG1-CB 3.83Å |
| 41 | F | 93 | Very high | 90.3 | Very high | 22 Ų | 22 | 57.1 Ų | 57.1 | 10% | 0.096 | 29% | 0.289 | C | S | . | . | S | Bend | trans | -73.8 | 146.4 | -174.9 | -64.7 | -79.1 | 0 | 0 | 0 | 112 | C37 K38 E234 G249 L264 | C37-F41 WeakPolarHBondContact O-CD2 3.49Å; C37-F41 WeakPolarHBondContact O-CE2 3.27Å; K38-F41 PolarHBondContact O-N 2.84Å; F41-E234 HydrophobicContact CE2-CB 3.92Å; F41-E234 WeakPolarHBondContact CE2-OE2 3.07Å; F41-E234 HydrophobicContact CZ-CB 3.75Å; F41-G249 VanDerWaalsContact CE1-N 3.32Å; F41-L264 HydrophobicContact CD1-CB 4.42Å; F41-L264 HydrophobicContact CD1-CD1 3.48Å; F41-L264 VanDerWaalsContact CD1-CD1 3.48Å; F41-L264 HydrophobicContact CD1-CG 4.42Å; F41-L264 HydrophobicContact CE1-CD1 3.6Å |
| 42 | P | 92.4 | Very high | 90.8 | Very high | 9 Ų | 9 | 54.4 Ų | 54.4 | 6% | 0.058 | 28% | 0.277 | C | S | . | . | P | Polyproline II helix | trans | -69.7 | 134.5 | 172.8 | 27.8 | -31.8 | 0 | 0 | 0 | 111 | Q44 R262 L264 V274 F291 | P42-Q44 PolarHBondContact O-N 2.8Å; P42-R262 HydrophobicContact CB-CB 3.8Å; P42-R262 HydrophobicContact CG-CB 4.43Å; P42-L264 HydrophobicContact CG-CB 3.59Å; P42-V274 HydrophobicContact CB-CB 3.83Å; P42-V274 HydrophobicContact CB-CG2 3.58Å; P42-F291 HydrophobicContact CB-CZ 4.16Å; P42-F291 HydrophobicContact CG-CE1 4.25Å; P42-F291 HydrophobicContact CG-CZ 4.32Å |
| 43 | A | 88.8 | Confident | 91.1 | Very high | 68 Ų | 68 | 53.1 Ų | 53.1 | 56% | 0.562 | 27% | 0.272 | S | S | * | . | P | Polyproline II helix | trans | -68.7 | 131.5 | 169.6 | 0 | 0 | 0 | 0 | 0 | 110 | M45 V274 F291 | A43-M45 PolarHBondContact O-N 2.89Å; A43-V274 WeakPolarHBondContact O-CG2 3.37Å; A43-F291 WeakPolarHBondContact O-CZ 3.35Å |
| 44 | Q | 86.1 | Confident | 91.3 | Very high | 166 Ų | 166 | 58.9 Ų | 58.9 | 78% | 0.776 | 30% | 0.297 | S | S | * | . | P | Polyproline II helix | trans | -62.7 | 131.4 | 173.7 | -68.3 | -172.8 | 2.8 | 0 | 0 | 110 | P42 F291 | P42-Q44 PolarHBondContact O-N 2.8Å; Q44-F291 HydrophobicContact CB-CE2 4.4Å; Q44-F291 HydrophobicContact CB-CZ 4.29Å; Q44-F291 HydrophobicContact CG-CD1 4.08Å; Q44-F291 HydrophobicContact CG-CE1 3.76Å; Q44-F291 HydrophobicContact CG-CE2 4.41Å; Q44-F291 HydrophobicContact CG-CZ 3.96Å |
| 45 | M | 86.3 | Confident | 91.3 | Very high | 35 Ų | 35 | 62.6 Ų | 62.6 | 17% | 0.172 | 32% | 0.32 | C | S | . | . | trans | -134.2 | 136.5 | 179.2 | 53.4 | 179.4 | 67.7 | 0 | 0 | 110.3 | A43 V274 A287 G289 F291 | A43-M45 PolarHBondContact O-N 2.89Å; M45-V274 HydrophobicContact CE-CB 4.29Å; M45-V274 HydrophobicContact CE-CG1 3.47Å; M45-V274 VanDerWaalsContact CE-CG1 3.47Å; M45-V274 HydrophobicContact CE-CG2 3.73Å; M45-V274 HydrophobicContact CG-CG2 4.3Å; M45-V274 HydrophobicContact SD-CG1 4.28Å; M45-V274 HydrophobicContact SD-CG2 4.15Å; M45-A287 HydrophobicContact CE-CB 4.14Å; M45-G289 WeakPolarHBondContact SD-CA 3.49Å; M45-G289 PolarHBondContact SD-N 2.92Å; M45-F291 HydrophobicContact CG-CE2 4.3Å | ||
| 46 | E | 86.9 | Confident | 91.3 | Very high | 60 Ų | 60 | 60.9 Ų | 60.9 | 28% | 0.28 | 32% | 0.321 | S | S | . | . | trans | -139.1 | 136.8 | -178.2 | -166.6 | -157.4 | 126.1 | 0 | 0 | 109.1 | H67 S69 L71 | E46-H67 PolarHBondContact O-NE2 2.79Å; E46-S69 PolarHBondContact OE1-OG 3.38Å; E46-L71 WeakPolarHBondContact OE1-CB 3.4Å; E46-L71 WeakPolarHBondContact OE1-CD1 3.09Å; E46-L71 WeakPolarHBondContact OE1-CG 3.39Å | ||
| 47 | G | 89.8 | Confident | 91.3 | Very high | 17 Ų | 17 | 59.3 Ų | 59.3 | 18% | 0.175 | 32% | 0.317 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 71.3 | -147 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | M68 C301 G302 F303 | G47-M68 CarbonylContact C-O 3.57Å; G47-M68 WeakPolarHBondContact CA-O 3.39Å; G47-C301 PolarHBondContact N-O 3.15Å; G47-C301 VanDerWaalsContact N-O 3.16Å; G47-G302 CarbonylContact O-C 3.53Å; G47-G302 WeakPolarHBondContact O-CA 3.48Å; G47-F303 PolarHBondContact O-N 3.44Å |
| 48 | V | 92.1 | Very high | 91.1 | Very high | 35 Ų | 35 | 64.3 Ų | 64.3 | 21% | 0.212 | 35% | 0.352 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.4 | 121.9 | -172.8 | -174.1 | 0 | 0 | 0 | 0 | 109.8 | M68 F303 | V48-M68 HydrophobicContact CB-CB 4.29Å; V48-M68 HydrophobicContact CB-CE 3.92Å; V48-M68 HydrophobicContact CG1-CE 3.76Å; V48-M68 PolarHBondContact N-O 3.23Å; V48-M68 PolarHBondContact O-N 3.41Å; V48-F303 WeakPolarHBondContact CA-O 3.49Å; V48-F303 HydrophobicContact CB-CE1 4.17Å; V48-F303 HydrophobicContact CB-CE2 4.15Å; V48-F303 HydrophobicContact CB-CZ 3.87Å; V48-F303 HydrophobicContact CG1-CD2 3.95Å; V48-F303 HydrophobicContact CG1-CE1 4.18Å; V48-F303 HydrophobicContact CG1-CE2 3.28Å; V48-F303 HydrophobicContact CG1-CZ 3.41Å; V48-F303 VanDerWaalsContact CG1-CZ 3.41Å; V48-F303 HydrophobicContact CG2-CD1 3.99Å; V48-F303 HydrophobicContact CG2-CE1 3.23Å; V48-F303 HydrophobicContact CG2-CE2 4.01Å; V48-F303 HydrophobicContact CG2-CZ 3.23Å |
| 49 | K | 92.8 | Very high | 91.1 | Very high | 92 Ų | 92 | 61.8 Ų | 61.8 | 40% | 0.4 | 34% | 0.341 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.4 | 109.4 | 175.8 | -170 | -177.7 | -178.5 | 178.7 | 0 | 111 | V51 T65 I66 F303 S304 I305 | K49-V51 HydrophobicContact CD-CG2 4.19Å; K49-V51 HydrophobicContact CG-CG2 4.03Å; K49-T65 HydrophobicContact CD-CG2 4.36Å; K49-T65 HydrophobicContact CG-CG2 4.06Å; K49-I66 CarbonylContact C-O 3.52Å; K49-I66 WeakPolarHBondContact CA-O 3.25Å; K49-F303 PolarHBondContact N-O 2.95Å; K49-S304 CarbonylContact O-C 3.59Å; K49-S304 WeakPolarHBondContact O-CA 3.17Å; K49-S304 WeakPolarHBondContact O-CB 3.35Å; K49-S304 PolarHBondContact O-OG 2.93Å; K49-I305 PolarHBondContact O-N 2.66Å |
| 50 | L | 94.1 | Very high | 91.1 | Very high | 57 Ų | 57 | 61.5 Ų | 61.5 | 30% | 0.298 | 34% | 0.336 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.6 | 120.6 | 171 | 177.8 | 63.8 | 0 | 0 | 0 | 109.1 | V52 T65 I66 I305 V307 | L50-V52 HydrophobicContact CD1-CG2 4.39Å; L50-V52 HydrophobicContact CG-CG2 4.23Å; L50-T65 CarbonylContact O-C 3.5Å; L50-T65 WeakPolarHBondContact O-CA 3.24Å; L50-I66 HydrophobicContact CB-CB 4.4Å; L50-I66 HydrophobicContact CD2-CD1 4.4Å; L50-I66 PolarHBondContact N-O 2.81Å; L50-I66 PolarHBondContact O-N 3.45Å; L50-I305 CarbonylContact C-O 3.55Å; L50-I305 WeakPolarHBondContact CA-O 3.22Å; L50-I305 HydrophobicContact CD1-CB 3.94Å; L50-I305 HydrophobicContact CD1-CG2 4.04Å; L50-V307 HydrophobicContact CD1-CG2 4.44Å |
| 51 | V | 94.6 | Very high | 91.1 | Very high | 20 Ų | 20 | 65.2 Ų | 65.2 | 12% | 0.121 | 35% | 0.354 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.9 | 123.3 | 174.4 | -175.2 | 0 | 0 | 0 | 0 | 108.1 | K49 H64 T65 I305 T306 V307 | K49-V51 HydrophobicContact CD-CG2 4.19Å; K49-V51 HydrophobicContact CG-CG2 4.03Å; V51-H64 CarbonylContact C-O 3.51Å; V51-H64 WeakPolarHBondContact CA-O 3.1Å; V51-T65 HydrophobicContact CG2-CG2 4.14Å; V51-I305 PolarHBondContact N-O 3.38Å; V51-T306 HydrophobicContact CB-CG2 4.17Å; V51-T306 HydrophobicContact CG1-CG2 4.32Å; V51-T306 CarbonylContact O-C 3.42Å; V51-T306 VanDerWaalsContact O-CA 3.31Å; V51-T306 WeakPolarHBondContact O-CA 3.49Å; V51-V307 PolarHBondContact O-N 3.21Å |
| 52 | V | 94.4 | Very high | 91.3 | Very high | 56 Ų | 56 | 65.1 Ų | 65.1 | 34% | 0.339 | 36% | 0.355 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.7 | 103.1 | 172.9 | -176.8 | 0 | 0 | 0 | 0 | 107.4 | L50 A63 H64 V307 | L50-V52 HydrophobicContact CD1-CG2 4.39Å; L50-V52 HydrophobicContact CG-CG2 4.23Å; V52-A63 CarbonylContact O-C 3.6Å; V52-A63 VanDerWaalsContact O-CA 3.31Å; V52-A63 WeakPolarHBondContact O-CA 3.45Å; V52-H64 HydrophobicContact CB-CB 4.36Å; V52-H64 PolarHBondContact N-O 3.44Å; V52-H64 PolarHBondContact O-N 2.99Å; V52-V307 CarbonylContact C-O 3.59Å; V52-V307 WeakPolarHBondContact CA-O 3.41Å |
| 53 | N | 93.7 | Very high | 91.4 | Very high | 46 Ų | 46 | 65.1 Ų | 65.1 | 25% | 0.246 | 36% | 0.356 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -92.2 | 132.4 | 174.8 | -167.4 | 8.3 | 0 | 0 | 0 | 109.5 | V62 A63 V307 | N53-V62 PolarHBondContact OD1-O 2.84Å; N53-A63 HydrophobicContact CB-CB 4.21Å; N53-V307 PolarHBondContact N-O 3.13Å |
| 54 | K | 92.8 | Very high | 91.7 | Very high | 127 Ų | 127 | 65 Ų | 65 | 55% | 0.552 | 34% | 0.344 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -129.7 | 114.5 | 176.7 | -170.9 | 173.2 | -177 | 178.7 | 0 | 109.3 | L56 V62 | K54-L56 HydrophobicContact CD-CD2 3.82Å; K54-L56 HydrophobicContact CG-CD2 3.92Å; K54-L56 PolarHBondContact O-N 3.3Å; K54-V62 PolarHBondContact N-O 2.94Å; K54-V62 PolarHBondContact O-N 3.26Å |
| 55 | V | 90.9 | Very high | 92 | Very high | 91 Ų | 91 | 58 Ų | 58 | 55% | 0.552 | 31% | 0.312 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -80.6 | 113.7 | 171 | -175.7 | 0 | 0 | 0 | 0 | 107.9 | S57 | V55-S57 WeakPolarHBondContact CG1-O 3.47Å |
| 56 | L | 90.6 | Very high | 92.4 | Very high | 96 Ų | 96 | 59.7 Ų | 59.7 | 50% | 0.503 | 32% | 0.321 | S | S | . | . | trans | -91.5 | -32.4 | -179 | -65.2 | 177.6 | 0 | 0 | 0 | 111.5 | K54 F60 V62 | K54-L56 HydrophobicContact CD-CD2 3.82Å; K54-L56 HydrophobicContact CG-CD2 3.92Å; K54-L56 PolarHBondContact O-N 3.3Å; L56-F60 HydrophobicContact CB-CD1 4.13Å; L56-F60 HydrophobicContact CD1-CD1 3.74Å; L56-F60 HydrophobicContact CD1-CE1 3.78Å; L56-F60 HydrophobicContact CG-CD1 4.44Å; L56-F60 PolarHBondContact N-O 2.76Å; L56-V62 HydrophobicContact CD1-CB 4.49Å; L56-V62 HydrophobicContact CD1-CG2 3.76Å | ||
| 57 | S | 91.4 | Very high | 92.6 | Very high | 53 Ų | 53 | 59.6 Ų | 59.6 | 37% | 0.371 | 32% | 0.321 | S | S | . | . | S | Bend | trans | -149.8 | 175.4 | 171.6 | 72.7 | 0 | 0 | 0 | 0 | 110.1 | V55 H59 F60 | V55-S57 WeakPolarHBondContact CG1-O 3.47Å; S57-H59 PolarHBondContact O-N 2.86Å; S57-H59 VanDerWaalsContact O-N 3.16Å; S57-H59 PolarHBondContact OG-N 2.77Å; S57-F60 PolarHBondContact N-O 2.88Å; S57-F60 VanDerWaalsContact N-O 3.13Å; S57-F60 PolarHBondContact O-N 3.49Å; S57-F60 WeakPolarHBondContact OG-CB 3.34Å; S57-F60 PolarHBondContact OG-N 2.8Å |
| 58 | S | 86.9 | Confident | 92.6 | Very high | 107 Ų | 107 | 63.1 Ų | 63.1 | 75% | 0.748 | 33% | 0.334 | S | S | * | . | S | Bend | trans | -56.3 | -26.4 | 171.6 | 43.1 | 0 | 0 | 0 | 0 | 113.5 | ||
| 59 | H | 90.3 | Very high | 92.2 | Very high | 57 Ų | 57 | 62.7 Ų | 62.7 | 26% | 0.264 | 33% | 0.332 | S | S | . | . | S | Bend | trans | -104.4 | -18.1 | -174.3 | -57.5 | 90 | 0 | 0 | 0 | 113 | S57 Y82 A83 D85 | S57-H59 PolarHBondContact O-N 2.86Å; S57-H59 VanDerWaalsContact O-N 3.16Å; S57-H59 PolarHBondContact OG-N 2.77Å; H59-Y82 HydrophobicContact CB-CD2 4.17Å; H59-Y82 HydrophobicContact CB-CE2 3.79Å; H59-Y82 CarbonylContact O-C 3.56Å; H59-Y82 VanDerWaalsContact O-CA 3.24Å; H59-Y82 WeakPolarHBondContact O-CA 3.2Å; H59-Y82 WeakPolarHBondContact O-CD2 3.13Å; H59-A83 WeakPolarHBondContact CA-O 3.36Å; H59-A83 VanDerWaalsContact CB-O 3.27Å; H59-A83 WeakPolarHBondContact CB-O 3.4Å; H59-A83 PolarHBondContact CD2-O 3.16Å; H59-A83 PolarHBondContact O-N 3.35Å; H59-D85 IonicContact CD2-OD1 3.14Å; H59-D85 IonicContact CE1-OD1 2.86Å; H59-D85 IonicContact NE2-OD1 3.92Å; H59-D85 PolarHBondContact NE2-OD1 3.18Å |
| 60 | F | 92.6 | Very high | 91.3 | Very high | 77 Ų | 77 | 63 Ų | 63 | 34% | 0.338 | 35% | 0.352 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131 | 122 | -169.7 | -166.5 | -112.9 | 0 | 0 | 0 | 112 | L56 S57 V62 A80 Y82 | L56-F60 HydrophobicContact CB-CD1 4.13Å; L56-F60 HydrophobicContact CD1-CD1 3.74Å; L56-F60 HydrophobicContact CD1-CE1 3.78Å; L56-F60 HydrophobicContact CG-CD1 4.44Å; L56-F60 PolarHBondContact N-O 2.76Å; S57-F60 PolarHBondContact N-O 2.88Å; S57-F60 VanDerWaalsContact N-O 3.13Å; S57-F60 PolarHBondContact O-N 3.49Å; S57-F60 WeakPolarHBondContact OG-CB 3.34Å; S57-F60 PolarHBondContact OG-N 2.8Å; F60-V62 HydrophobicContact CD1-CG2 4.05Å; F60-V62 HydrophobicContact CE1-CG2 3.33Å; F60-V62 HydrophobicContact CZ-CG2 3.73Å; F60-A80 HydrophobicContact CE2-CB 4.43Å; F60-A80 HydrophobicContact CZ-CB 4.31Å; F60-Y82 HydrophobicContact CD2-CD2 4.49Å |
| 61 | Q | 93.6 | Very high | 90.4 | Very high | 79 Ų | 79 | 66.5 Ų | 66.5 | 37% | 0.369 | 37% | 0.37 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.5 | 141.6 | 177.3 | 61.9 | -178.4 | -24.5 | 0 | 0 | 110.2 | A81 | Q61-A81 HydrophobicContact CG-CB 3.7Å; Q61-A81 PolarHBondContact N-O 3.18Å; Q61-A81 PolarHBondContact O-N 2.82Å |
| 62 | V | 95.4 | Very high | 89.4 | Confident | 19 Ų | 19 | 67.4 Ų | 67.4 | 12% | 0.115 | 38% | 0.384 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.8 | 126.9 | 177.3 | -179.3 | 0 | 0 | 0 | 0 | 108.2 | N53 K54 L56 F60 L78 H79 | N53-V62 PolarHBondContact OD1-O 2.84Å; K54-V62 PolarHBondContact N-O 2.94Å; K54-V62 PolarHBondContact O-N 3.26Å; L56-V62 HydrophobicContact CD1-CB 4.49Å; L56-V62 HydrophobicContact CD1-CG2 3.76Å; F60-V62 HydrophobicContact CD1-CG2 4.05Å; F60-V62 HydrophobicContact CE1-CG2 3.33Å; F60-V62 HydrophobicContact CZ-CG2 3.73Å; V62-L78 HydrophobicContact CG1-CD1 3.71Å; V62-H79 CarbonylContact C-O 3.59Å; V62-H79 WeakPolarHBondContact CA-O 3.39Å |
| 63 | A | 94.9 | Very high | 88.5 | Confident | 9 Ų | 9 | 72.5 Ų | 72.5 | 7% | 0.074 | 41% | 0.408 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.3 | 133.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | V52 N53 H79 | V52-A63 CarbonylContact O-C 3.6Å; V52-A63 VanDerWaalsContact O-CA 3.31Å; V52-A63 WeakPolarHBondContact O-CA 3.45Å; N53-A63 HydrophobicContact CB-CB 4.21Å; A63-H79 HydrophobicContact CB-CB 4.16Å; A63-H79 PolarHBondContact N-O 2.92Å; A63-H79 PolarHBondContact O-N 2.84Å |
| 64 | H | 94.9 | Very high | 88.1 | Confident | 67 Ų | 67 | 74.7 Ų | 74.7 | 31% | 0.31 | 43% | 0.425 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.2 | 116.2 | 176.2 | -62 | -85.1 | 0 | 0 | 0 | 108.2 | V51 V52 Y76 | V51-H64 CarbonylContact C-O 3.51Å; V51-H64 WeakPolarHBondContact CA-O 3.1Å; V52-H64 HydrophobicContact CB-CB 4.36Å; V52-H64 PolarHBondContact N-O 3.44Å; V52-H64 PolarHBondContact O-N 2.99Å; H64-Y76 HydrophobicContact CB-CE2 4.05Å; H64-Y76 PolarHBondContact CE1-OH 2.93Å; H64-Y76 AromaticContact ND1-CE2 3.91Å; H64-Y76 AromaticContact ND1-CZ 3.7Å; H64-Y76 PolarHBondContact ND1-OH 2.8Å |
| 65 | T | 93.9 | Very high | 87.8 | Confident | 19 Ų | 19 | 69.5 Ų | 69.5 | 12% | 0.117 | 41% | 0.407 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.1 | 119.4 | 178.2 | -64 | 0 | 0 | 0 | 0 | 109.6 | K49 L50 V51 Y76 H77 | K49-T65 HydrophobicContact CD-CG2 4.36Å; K49-T65 HydrophobicContact CG-CG2 4.06Å; L50-T65 CarbonylContact O-C 3.5Å; L50-T65 WeakPolarHBondContact O-CA 3.24Å; V51-T65 HydrophobicContact CG2-CG2 4.14Å; T65-Y76 WeakPolarHBondContact O-CA 3.47Å; T65-H77 PolarHBondContact N-O 2.99Å; T65-H77 PolarHBondContact O-N 3.11Å |
| 66 | I | 93.6 | Very high | 87.9 | Confident | 69 Ų | 69 | 69.3 Ų | 69.3 | 35% | 0.354 | 40% | 0.397 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.4 | 118 | 171.2 | -58 | 170.1 | 0 | 0 | 0 | 106.8 | K49 L50 M68 Y76 | K49-I66 CarbonylContact C-O 3.52Å; K49-I66 WeakPolarHBondContact CA-O 3.25Å; L50-I66 HydrophobicContact CB-CB 4.4Å; L50-I66 HydrophobicContact CD2-CD1 4.4Å; L50-I66 PolarHBondContact N-O 2.81Å; L50-I66 PolarHBondContact O-N 3.45Å; I66-M68 HydrophobicContact CG2-CG 4.29Å; I66-Y76 HydrophobicContact CG1-CD2 3.94Å |
| 67 | H | 90.6 | Very high | 88 | Confident | 59 Ų | 59 | 67.5 Ų | 67.5 | 27% | 0.273 | 39% | 0.386 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.7 | 126.8 | 174.3 | -174.9 | -115.8 | 0 | 0 | 0 | 109.7 | E46 P74 G75 | E46-H67 PolarHBondContact O-NE2 2.79Å; H67-P74 CarbonylContact O-C 3.6Å; H67-P74 VanDerWaalsContact O-CA 3.27Å; H67-P74 WeakPolarHBondContact O-CA 3.21Å; H67-G75 PolarHBondContact N-O 3.47Å; H67-G75 PolarHBondContact O-N 3.49Å |
| 68 | M | 89.9 | Confident | 88.1 | Confident | 91 Ų | 91 | 68.2 Ų | 68.2 | 45% | 0.448 | 39% | 0.385 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.3 | 110.3 | 175.5 | -64 | 176.2 | -76.1 | 0 | 0 | 107.4 | G47 V48 I66 P74 | G47-M68 CarbonylContact C-O 3.57Å; G47-M68 WeakPolarHBondContact CA-O 3.39Å; V48-M68 HydrophobicContact CB-CB 4.29Å; V48-M68 HydrophobicContact CB-CE 3.92Å; V48-M68 HydrophobicContact CG1-CE 3.76Å; V48-M68 PolarHBondContact N-O 3.23Å; V48-M68 PolarHBondContact O-N 3.41Å; I66-M68 HydrophobicContact CG2-CG 4.29Å; M68-P74 HydrophobicContact CG-CB 4.42Å |
| 69 | S | 83.8 | Confident | 88.5 | Confident | 26 Ų | 26 | 65.7 Ų | 65.7 | 18% | 0.182 | 36% | 0.361 | C | S | . | . | trans | -105.3 | 154.4 | 175.8 | 168.4 | 0 | 0 | 0 | 0 | 110.5 | E46 L71 G72 | E46-S69 PolarHBondContact OE1-OG 3.38Å; S69-L71 PolarHBondContact OG-N 3.16Å; S69-G72 PolarHBondContact OG-N 2.67Å | ||
| 70 | A | 74.4 | Confident | 88.8 | Confident | 98 Ų | 98 | 64.5 Ų | 64.5 | 81% | 0.81 | 36% | 0.362 | S | S | * | . | S | Bend | trans | -85.1 | -20.1 | 170.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||
| 71 | L | 74.7 | Confident | 88.8 | Confident | 130 Ų | 130 | 61.1 Ų | 61.1 | 68% | 0.681 | 35% | 0.348 | S | S | * | . | S | Bend | trans | -105.3 | -27 | -178.6 | -61.2 | 179.1 | 0 | 0 | 0 | 112.9 | E46 S69 | E46-L71 WeakPolarHBondContact OE1-CB 3.4Å; E46-L71 WeakPolarHBondContact OE1-CD1 3.09Å; E46-L71 WeakPolarHBondContact OE1-CG 3.39Å; S69-L71 PolarHBondContact OG-N 3.16Å |
| 72 | G | 73.7 | Confident | 88.8 | Confident | 40 Ų | 40 | 62.1 Ų | 62.1 | 41% | 0.412 | 35% | 0.349 | S | S | . | . | S | Bend | trans | -110.5 | 171.3 | -179.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | S69 | S69-G72 PolarHBondContact OG-N 2.67Š|
| 73 | L | 77 | Confident | 88.6 | Confident | 162 Ų | 162 | 62.5 Ų | 62.5 | 85% | 0.848 | 35% | 0.354 | S | S | * | . | trans | -70.6 | 137.4 | 172.1 | -70.4 | 168.5 | 0 | 0 | 0 | 110 | G75 | L73-G75 PolarHBondContact O-N 2.82Š| ||
| 74 | P | 83.3 | Confident | 88.3 | Confident | 93 Ų | 93 | 62.5 Ų | 62.5 | 60% | 0.604 | 36% | 0.355 | S | S | * | . | trans | -63.3 | 137.3 | 170.7 | 28.2 | -33.3 | 0 | 0 | 0 | 109.4 | H67 M68 | H67-P74 CarbonylContact O-C 3.6Å; H67-P74 VanDerWaalsContact O-CA 3.27Å; H67-P74 WeakPolarHBondContact O-CA 3.21Å; M68-P74 HydrophobicContact CG-CB 4.42Å | ||
| 75 | G | 87.3 | Confident | 87.8 | Confident | 17 Ų | 17 | 65.2 Ų | 65.2 | 18% | 0.175 | 37% | 0.372 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.7 | 143.5 | -175.1 | 0 | 0 | 0 | 0 | 0 | 111.3 | H67 L73 | H67-G75 PolarHBondContact N-O 3.47Å; H67-G75 PolarHBondContact O-N 3.49Å; L73-G75 PolarHBondContact O-N 2.82Å |
| 76 | Y | 92.6 | Very high | 87 | Confident | 88 Ų | 88 | 72.7 Ų | 72.7 | 35% | 0.345 | 40% | 0.398 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.6 | 130.2 | 167.8 | 167.9 | -97.9 | 0 | 0 | 0 | 109 | H64 T65 I66 L78 D102 S103 | H64-Y76 HydrophobicContact CB-CE2 4.05Å; H64-Y76 PolarHBondContact CE1-OH 2.93Å; H64-Y76 AromaticContact ND1-CE2 3.91Å; H64-Y76 AromaticContact ND1-CZ 3.7Å; H64-Y76 PolarHBondContact ND1-OH 2.8Å; T65-Y76 WeakPolarHBondContact O-CA 3.47Å; I66-Y76 HydrophobicContact CG1-CD2 3.94Å; Y76-L78 HydrophobicContact CE1-CB 4.03Å; Y76-D102 CarbonylContact O-C 3.57Å; Y76-D102 WeakPolarHBondContact O-CA 3.43Å; Y76-S103 PolarHBondContact O-N 2.88Å |
| 77 | H | 93.1 | Very high | 86.2 | Confident | 57 Ų | 57 | 75.2 Ų | 75.2 | 26% | 0.264 | 41% | 0.408 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119 | 126.3 | 177.1 | -67.4 | -104 | 0 | 0 | 0 | 109.5 | T65 D100 M101 D102 | T65-H77 PolarHBondContact N-O 2.99Å; T65-H77 PolarHBondContact O-N 3.11Å; H77-D100 IonicContact CG-OD1 2.66Å; H77-D100 IonicContact ND1-OD1 3.87Å; H77-D100 PolarHBondContact ND1-OD1 2.79Å; H77-M101 WeakPolarHBondContact CA-O 3.11Å; H77-D102 WeakPolarHBondContact CE1-CB 3.16Å |
| 78 | L | 94.4 | Very high | 85.1 | Confident | 68 Ų | 68 | 76.7 Ų | 76.7 | 36% | 0.356 | 42% | 0.418 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.7 | 115.3 | 169.8 | 177.5 | 64.9 | 0 | 0 | 0 | 108.5 | V62 Y76 D100 M101 | V62-L78 HydrophobicContact CG1-CD1 3.71Å; Y76-L78 HydrophobicContact CE1-CB 4.03Å; L78-D100 CarbonylContact O-C 3.59Å; L78-D100 WeakPolarHBondContact O-CA 3.5Å; L78-M101 PolarHBondContact N-O 2.8Å; L78-M101 PolarHBondContact O-N 2.82Å |
| 79 | H | 95 | Very high | 83.8 | Confident | 54 Ų | 54 | 74.2 Ų | 74.2 | 25% | 0.25 | 41% | 0.409 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.8 | 129.5 | 174.8 | -173.6 | 85.8 | 0 | 0 | 0 | 109.6 | V62 A63 V98 G99 D100 | V62-H79 CarbonylContact C-O 3.59Å; V62-H79 WeakPolarHBondContact CA-O 3.39Å; A63-H79 HydrophobicContact CB-CB 4.16Å; A63-H79 PolarHBondContact N-O 2.92Å; A63-H79 PolarHBondContact O-N 2.84Å; H79-V98 WeakPolarHBondContact CE1-CG1 3.21Å; H79-G99 CarbonylContact C-O 3.57Å; H79-G99 WeakPolarHBondContact CA-O 3.25Å; H79-D100 IonicContact ND1-OD2 2.76Å |
| 80 | A | 95.1 | Very high | 82.8 | Confident | 33 Ų | 33 | 78.8 Ų | 78.8 | 27% | 0.273 | 44% | 0.438 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.8 | 131.6 | 173.1 | 0 | 0 | 0 | 0 | 0 | 108.8 | F60 V98 G99 | F60-A80 HydrophobicContact CE2-CB 4.43Å; F60-A80 HydrophobicContact CZ-CB 4.31Å; A80-V98 WeakPolarHBondContact O-CA 3.39Å; A80-G99 PolarHBondContact N-O 2.83Å; A80-G99 PolarHBondContact O-N 3.22Å |
| 81 | A | 94.4 | Very high | 82.2 | Confident | 5 Ų | 5 | 79.9 Ų | 79.9 | 4% | 0.041 | 44% | 0.435 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.4 | 134.3 | 176.1 | 0 | 0 | 0 | 0 | 0 | 110.7 | Q61 V97 V98 | Q61-A81 HydrophobicContact CG-CB 3.7Å; Q61-A81 PolarHBondContact N-O 3.18Å; Q61-A81 PolarHBondContact O-N 2.82Å; A81-V97 CarbonylContact C-O 3.53Å; A81-V97 WeakPolarHBondContact CA-O 3.41Å; A81-V98 HydrophobicContact CB-CG1 4.42Å; A81-V98 HydrophobicContact CB-CG2 3.99Å |
| 82 | Y | 93.3 | Very high | 82.1 | Confident | 100 Ų | 100 | 75 Ų | 75 | 39% | 0.392 | 41% | 0.409 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.3 | 129 | 172.8 | 175.1 | -100.8 | 0 | 0 | 0 | 109 | H59 F60 P95 T96 V97 | H59-Y82 HydrophobicContact CB-CD2 4.17Å; H59-Y82 HydrophobicContact CB-CE2 3.79Å; H59-Y82 CarbonylContact O-C 3.56Å; H59-Y82 VanDerWaalsContact O-CA 3.24Å; H59-Y82 WeakPolarHBondContact O-CA 3.2Å; H59-Y82 WeakPolarHBondContact O-CD2 3.13Å; F60-Y82 HydrophobicContact CD2-CD2 4.49Å; Y82-P95 HydrophobicContact CE1-CG 4.45Å; Y82-T96 CarbonylContact O-C 3.57Å; Y82-T96 VanDerWaalsContact O-CA 3.32Å; Y82-T96 WeakPolarHBondContact O-CA 3.28Å; Y82-V97 PolarHBondContact N-O 2.82Å; Y82-V97 PolarHBondContact O-N 3.2Å |
| 83 | A | 91.1 | Very high | 82.4 | Confident | 28 Ų | 28 | 74.9 Ų | 74.9 | 23% | 0.231 | 40% | 0.4 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119 | 131.3 | 172.3 | 0 | 0 | 0 | 0 | 0 | 108.7 | H59 V93 | H59-A83 WeakPolarHBondContact CA-O 3.36Å; H59-A83 VanDerWaalsContact CB-O 3.27Å; H59-A83 WeakPolarHBondContact CB-O 3.4Å; H59-A83 PolarHBondContact CD2-O 3.16Å; H59-A83 PolarHBondContact O-N 3.35Å; A83-V93 HydrophobicContact CB-CB 4.31Å; A83-V93 HydrophobicContact CB-CG1 3.99Å |
| 84 | G | 87.4 | Confident | 82.8 | Confident | 8 Ų | 8 | 67.2 Ų | 67.2 | 8% | 0.082 | 36% | 0.359 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.5 | -163.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114 | V93 P95 | G84-V93 WeakPolarHBondContact O-CG1 3.35Å; G84-P95 PolarHBondContact N-O 2.92Å |
| 85 | D | 84.3 | Confident | 83.2 | Confident | 124 Ų | 124 | 64.8 Ų | 64.8 | 66% | 0.663 | 34% | 0.344 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -93.6 | -21.1 | -176 | -67.2 | -54.2 | 0 | 0 | 0 | 114 | H59 Q87 | H59-D85 IonicContact CD2-OD1 3.14Å; H59-D85 IonicContact CE1-OD1 2.86Å; H59-D85 IonicContact NE2-OD1 3.92Å; H59-D85 PolarHBondContact NE2-OD1 3.18Å; D85-Q87 PolarHBondContact O-N 2.82Å |
| 86 | W | 78.8 | Confident | 83.3 | Confident | 177 Ų | 177 | 65.5 Ų | 65.5 | 67% | 0.67 | 35% | 0.345 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -84.2 | 105.4 | -173 | -63.2 | -44.7 | 0 | 0 | 0 | 111.3 | V93 F94 | W86-V93 CarbonylContact O-C 3.53Å; W86-V93 WeakPolarHBondContact O-CA 3.38Å; W86-F94 HydrophobicContact CB-CB 4.45Å; W86-F94 WeakPolarHBondContact CB-O 3.4Å; W86-F94 PolarHBondContact N-O 2.87Å; W86-F94 PolarHBondContact O-N 3.26Å |
| 87 | Q | 75.3 | Confident | 83.4 | Confident | 122 Ų | 122 | 64.2 Ų | 64.2 | 57% | 0.57 | 35% | 0.346 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -104.9 | 106 | 177.1 | -167.9 | 167.8 | 38.2 | 0 | 0 | 110.3 | D85 S89 P90 V93 | D85-Q87 PolarHBondContact O-N 2.82Å; Q87-S89 WeakPolarHBondContact CG-O 3.43Å; Q87-P90 PolarHBondContact NE2-O 3.21Å; Q87-V93 HydrophobicContact CG-CG2 4.21Å |
| 88 | L | 67.4 | Low | 83.5 | Confident | 90 Ų | 90 | 63 Ų | 63 | 47% | 0.471 | 34% | 0.342 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82 | -29 | 173.3 | -108.7 | 85.5 | 0 | 0 | 0 | 112.2 | E92 F94 L114 | L88-E92 PolarHBondContact N-O 2.82Å; L88-F94 HydrophobicContact CB-CE2 4.42Å; L88-L114 HydrophobicContact CD1-CD2 3.43Å; L88-L114 VanDerWaalsContact CD1-CD2 3.43Å |
| 89 | S | 64.1 | Low | 83.5 | Confident | 38 Ų | 38 | 60.7 Ų | 60.7 | 27% | 0.266 | 34% | 0.336 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -143.4 | 152.1 | -175.7 | 169.1 | 0 | 0 | 0 | 0 | 109 | Q87 T91 E92 | Q87-S89 WeakPolarHBondContact CG-O 3.43Å; S89-T91 PolarHBondContact O-N 3.45Å; S89-T91 PolarHBondContact OG-N 2.94Å; S89-T91 PolarHBondContact OG-OG1 2.78Å; S89-T91 VanDerWaalsContact OG-OG1 3.11Å; S89-E92 PolarHBondContact O-N 2.87Å |
| 90 | P | 61.4 | Low | 83.5 | Confident | 123 Ų | 123 | 60.1 Ų | 60.1 | 80% | 0.799 | 33% | 0.334 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -50.3 | -25.8 | 174 | -26.6 | 34 | 0 | 0 | 0 | 113.9 | Q87 | Q87-P90 PolarHBondContact NE2-O 3.21Š|
| 91 | T | 63.3 | Low | 83.4 | Confident | 120 Ų | 120 | 63.2 Ų | 63.2 | 74% | 0.736 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101 | -10.2 | -177 | 56.5 | 0 | 0 | 0 | 0 | 114.7 | S89 | S89-T91 PolarHBondContact O-N 3.45Å; S89-T91 PolarHBondContact OG-N 2.94Å; S89-T91 PolarHBondContact OG-OG1 2.78Å; S89-T91 VanDerWaalsContact OG-OG1 3.11Å |
| 92 | E | 71.6 | Confident | 83.2 | Confident | 29 Ų | 29 | 64.4 Ų | 64.4 | 14% | 0.136 | 35% | 0.35 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.7 | 114.8 | -170.4 | -62 | 175.1 | 158.8 | 0 | 0 | 110.9 | L88 S89 F94 R120 R142 | L88-E92 PolarHBondContact N-O 2.82Å; S89-E92 PolarHBondContact O-N 2.87Å; E92-F94 HydrophobicContact CB-CE2 3.68Å; E92-F94 HydrophobicContact CB-CZ 4.06Å; E92-R120 IonicContact OE1-CZ 3.47Å; E92-R120 IonicContact OE1-NH1 3.29Å; E92-R120 PolarHBondContact OE1-NH1 3.12Å; E92-R120 IonicContact OE1-NH2 2.88Å; E92-R120 IonicContact OE2-CZ 3.44Å; E92-R120 IonicContact OE2-NH1 3.31Å; E92-R120 PolarHBondContact OE2-NH1 3.3Å; E92-R120 IonicContact OE2-NH2 3.87Å; E92-R120 PolarHBondContact OE2-NH2 3.43Å; E92-R142 IonicContact OE1-CZ 2.89Å; E92-R142 IonicContact OE1-NH1 3.62Å; E92-R142 PolarHBondContact OE1-NH1 3.23Å; E92-R142 IonicContact OE1-NH2 3.2Å; E92-R142 PolarHBondContact OE1-NH2 2.86Å; E92-R142 IonicContact OE2-NH1 3.59Å |
| 93 | V | 81.3 | Confident | 82.9 | Confident | 36 Ų | 36 | 63.8 Ų | 63.8 | 22% | 0.218 | 36% | 0.36 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115 | 139.3 | 177.9 | -175.2 | 0 | 0 | 0 | 0 | 108.6 | A83 G84 W86 Q87 T96 | A83-V93 HydrophobicContact CB-CB 4.31Å; A83-V93 HydrophobicContact CB-CG1 3.99Å; G84-V93 WeakPolarHBondContact O-CG1 3.35Å; W86-V93 CarbonylContact O-C 3.53Å; W86-V93 WeakPolarHBondContact O-CA 3.38Å; Q87-V93 HydrophobicContact CG-CG2 4.21Å; V93-T96 PolarHBondContact O-OG1 3.31Å |
| 94 | F | 84.9 | Confident | 82.6 | Confident | 1 Ų | 1 | 65.4 Ų | 65.4 | 0% | 0.004 | 37% | 0.37 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.2 | 146.2 | -176.2 | -60.4 | -89.8 | 0 | 0 | 0 | 111 | W86 L88 E92 L112 L114 R120 | W86-F94 HydrophobicContact CB-CB 4.45Å; W86-F94 WeakPolarHBondContact CB-O 3.4Å; W86-F94 PolarHBondContact N-O 2.87Å; W86-F94 PolarHBondContact O-N 3.26Å; L88-F94 HydrophobicContact CB-CE2 4.42Å; E92-F94 HydrophobicContact CB-CE2 3.68Å; E92-F94 HydrophobicContact CB-CZ 4.06Å; F94-L112 HydrophobicContact CD1-CD2 4.19Å; F94-L112 HydrophobicContact CD1-CG 3.88Å; F94-L112 HydrophobicContact CE1-CD1 3.92Å; F94-L112 HydrophobicContact CE1-CD2 3.62Å; F94-L112 HydrophobicContact CE1-CG 3.5Å; F94-L112 VanDerWaalsContact CE1-CG 3.5Å; F94-L112 HydrophobicContact CZ-CD2 4.22Å; F94-L114 HydrophobicContact CB-CB 4.11Å; F94-L114 HydrophobicContact CD1-CB 3.97Å; F94-L114 HydrophobicContact CD2-CB 4.49Å; F94-L114 HydrophobicContact CE1-CB 4.5Å; F94-L114 HydrophobicContact CG-CB 3.95Å; F94-R120 HydrophobicContact CE1-CG 4.37Å; F94-R120 HydrophobicContact CZ-CG 4.33Å |
| 95 | P | 90.3 | Very high | 82.4 | Confident | 42 Ų | 42 | 66.1 Ų | 66.1 | 27% | 0.273 | 38% | 0.377 | S | S | . | . | E | Extended strand (participates in β ladder) | cis | -65.3 | 146.4 | -18.2 | 30.2 | -36.9 | 0 | 0 | 0 | 111.4 | Y82 G84 L112 I113 | Y82-P95 HydrophobicContact CE1-CG 4.45Å; G84-P95 PolarHBondContact N-O 2.92Å; P95-L112 CarbonylContact C-O 3.48Å; P95-L112 WeakPolarHBondContact CA-O 3.26Å; P95-I113 HydrophobicContact CB-CG2 4.01Å |
| 96 | T | 91.2 | Very high | 82.7 | Confident | 32 Ų | 32 | 61.2 Ų | 61.2 | 20% | 0.196 | 35% | 0.353 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.7 | 126.2 | 170.5 | -72.3 | 0 | 0 | 0 | 0 | 109.4 | Y82 V93 V98 L112 | Y82-T96 CarbonylContact O-C 3.57Å; Y82-T96 VanDerWaalsContact O-CA 3.32Å; Y82-T96 WeakPolarHBondContact O-CA 3.28Å; V93-T96 PolarHBondContact O-OG1 3.31Å; T96-V98 HydrophobicContact CG2-CG2 3.86Å; T96-L112 PolarHBondContact N-O 2.67Å; T96-L112 PolarHBondContact O-N 3.18Å |
| 97 | V | 94.3 | Very high | 83.3 | Confident | 61 Ų | 61 | 56 Ų | 56 | 37% | 0.37 | 34% | 0.338 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.3 | 126 | 176.3 | -178.8 | 0 | 0 | 0 | 0 | 108 | A81 Y82 Q110 V111 | A81-V97 CarbonylContact C-O 3.53Å; A81-V97 WeakPolarHBondContact CA-O 3.41Å; Y82-V97 PolarHBondContact N-O 2.82Å; Y82-V97 PolarHBondContact O-N 3.2Å; V97-Q110 CarbonylContact C-O 3.51Å; V97-Q110 WeakPolarHBondContact CA-O 3.39Å; V97-V111 HydrophobicContact CG1-CG2 4.26Å; V97-V111 HydrophobicContact CG2-CG1 4.3Å; V97-V111 HydrophobicContact CG2-CG2 4.47Å |
| 98 | V | 94.3 | Very high | 84.2 | Confident | 31 Ų | 31 | 53.3 Ų | 53.3 | 19% | 0.188 | 33% | 0.327 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.4 | 131.2 | -179.9 | -177.2 | 0 | 0 | 0 | 0 | 108.1 | H79 A80 A81 T96 A109 Q110 | H79-V98 WeakPolarHBondContact CE1-CG1 3.21Å; A80-V98 WeakPolarHBondContact O-CA 3.39Å; A81-V98 HydrophobicContact CB-CG1 4.42Å; A81-V98 HydrophobicContact CB-CG2 3.99Å; T96-V98 HydrophobicContact CG2-CG2 3.86Å; V98-A109 CarbonylContact O-C 3.54Å; V98-A109 WeakPolarHBondContact O-CA 3.16Å; V98-Q110 HydrophobicContact CB-CB 4.42Å; V98-Q110 PolarHBondContact N-O 2.77Å; V98-Q110 PolarHBondContact O-N 2.81Å |
| 99 | G | 95.1 | Very high | 85.5 | Confident | 21 Ų | 21 | 50.1 Ų | 50.1 | 22% | 0.216 | 31% | 0.314 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.7 | 131.5 | 173.4 | 0 | 0 | 0 | 0 | 0 | 110.3 | H79 A80 N108 | H79-G99 CarbonylContact C-O 3.57Å; H79-G99 WeakPolarHBondContact CA-O 3.25Å; A80-G99 PolarHBondContact N-O 2.83Å; A80-G99 PolarHBondContact O-N 3.22Å; G99-N108 CarbonylContact C-O 3.53Å; G99-N108 WeakPolarHBondContact CA-O 3.31Å |
| 100 | D | 94.1 | Very high | 87 | Confident | 42 Ų | 42 | 51.4 Ų | 51.4 | 23% | 0.225 | 32% | 0.315 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.2 | 125 | 169.5 | -172.1 | -95.5 | 0 | 0 | 0 | 108.7 | H77 L78 H79 L107 N108 | H77-D100 IonicContact CG-OD1 2.66Å; H77-D100 IonicContact ND1-OD1 3.87Å; H77-D100 PolarHBondContact ND1-OD1 2.79Å; L78-D100 CarbonylContact O-C 3.59Å; L78-D100 WeakPolarHBondContact O-CA 3.5Å; H79-D100 IonicContact ND1-OD2 2.76Å; D100-L107 CarbonylContact O-C 3.58Å; D100-L107 WeakPolarHBondContact O-CA 3.3Å; D100-N108 HydrophobicContact CB-CB 4.4Å; D100-N108 PolarHBondContact N-O 2.72Å; D100-N108 PolarHBondContact O-N 2.75Å |
| 101 | M | 93 | Very high | 88.5 | Confident | 98 Ų | 98 | 47.7 Ų | 47.7 | 48% | 0.483 | 29% | 0.29 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124 | 126.8 | 177.8 | -172.2 | 175.4 | -179.5 | 0 | 0 | 110 | H77 L78 S106 L107 | H77-M101 WeakPolarHBondContact CA-O 3.11Å; L78-M101 PolarHBondContact N-O 2.8Å; L78-M101 PolarHBondContact O-N 2.82Å; M101-S106 WeakPolarHBondContact CA-O 3.24Å; M101-L107 HydrophobicContact CB-CD1 4.16Å |
| 102 | D | 90.7 | Very high | 89.9 | Confident | 29 Ų | 29 | 43.8 Ų | 43.8 | 16% | 0.155 | 27% | 0.265 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.7 | 162.7 | 174.5 | 79.8 | 20.2 | 0 | 0 | 0 | 112.1 | Y76 H77 S104 G105 S106 | Y76-D102 CarbonylContact O-C 3.57Å; Y76-D102 WeakPolarHBondContact O-CA 3.43Å; H77-D102 WeakPolarHBondContact CE1-CB 3.16Å; D102-S104 PolarHBondContact O-N 3.26Å; D102-S104 VanDerWaalsContact OD1-C 3.29Å; D102-S104 VanDerWaalsContact OD1-CA 3.25Å; D102-S104 WeakPolarHBondContact OD1-CA 3.5Å; D102-S104 WeakPolarHBondContact OD1-CB 3.42Å; D102-S104 PolarHBondContact OD1-N 3.18Å; D102-S104 PolarHBondContact OD1-OG 3.25Å; D102-S104 PolarHBondContact OD2-OG 3.45Å; D102-G105 PolarHBondContact O-N 2.78Å; D102-G105 PolarHBondContact OD1-N 2.81Å; D102-S106 VanDerWaalsContact CG-CB 3.46Å; D102-S106 PolarHBondContact N-O 2.87Å; D102-S106 PolarHBondContact OD1-N 2.88Å; D102-S106 WeakPolarHBondContact OD2-CB 3.29Å; D102-S106 PolarHBondContact OD2-OG 2.8Å |
| 103 | S | 87.2 | Confident | 90.9 | Very high | 87 Ų | 87 | 45.7 Ų | 45.7 | 61% | 0.608 | 28% | 0.275 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.5 | -13.4 | 177.5 | 53.4 | 0 | 0 | 0 | 0 | 114.5 | Y76 | Y76-S103 PolarHBondContact O-N 2.88Š|
| 104 | S | 85.1 | Confident | 91.3 | Very high | 62 Ų | 62 | 46 Ų | 46 | 43% | 0.434 | 28% | 0.276 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.4 | -7.5 | 179.1 | 79 | 0 | 0 | 0 | 0 | 113.2 | D102 S106 | D102-S104 PolarHBondContact O-N 3.26Å; D102-S104 VanDerWaalsContact OD1-C 3.29Å; D102-S104 VanDerWaalsContact OD1-CA 3.25Å; D102-S104 WeakPolarHBondContact OD1-CA 3.5Å; D102-S104 WeakPolarHBondContact OD1-CB 3.42Å; D102-S104 PolarHBondContact OD1-N 3.18Å; D102-S104 PolarHBondContact OD1-OG 3.25Å; D102-S104 PolarHBondContact OD2-OG 3.45Å; S104-S106 PolarHBondContact OG-OG 2.84Å |
| 105 | G | 83.6 | Confident | 91.4 | Very high | 23 Ų | 23 | 50.9 Ų | 50.9 | 24% | 0.237 | 30% | 0.301 | C | S | . | . | S | Bend | trans | 93.6 | 12.4 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | D102 Q129 | D102-G105 PolarHBondContact O-N 2.78Å; D102-G105 PolarHBondContact OD1-N 2.81Å; G105-Q129 PolarHBondContact O-N 2.98Å |
| 106 | S | 90.4 | Very high | 91.2 | Very high | 22 Ų | 22 | 51.4 Ų | 51.4 | 15% | 0.154 | 31% | 0.309 | C | S | . | . | trans | -78.7 | 126.7 | 167.8 | -38.3 | 0 | 0 | 0 | 0 | 109.4 | M101 D102 S104 T127 | M101-S106 WeakPolarHBondContact CA-O 3.24Å; D102-S106 VanDerWaalsContact CG-CB 3.46Å; D102-S106 PolarHBondContact N-O 2.87Å; D102-S106 PolarHBondContact OD1-N 2.88Å; D102-S106 WeakPolarHBondContact OD2-CB 3.29Å; D102-S106 PolarHBondContact OD2-OG 2.8Å; S104-S106 PolarHBondContact OG-OG 2.84Å; S106-T127 VanDerWaalsContact CA-O 3.24Å; S106-T127 WeakPolarHBondContact CA-O 3.44Å; S106-T127 WeakPolarHBondContact CB-O 3.44Å | ||
| 107 | L | 91.6 | Very high | 90.8 | Very high | 67 Ų | 67 | 58 Ų | 58 | 35% | 0.351 | 34% | 0.338 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.2 | 133.2 | 178 | 175.5 | 70.4 | 0 | 0 | 0 | 109 | D100 M101 A109 Q126 T127 | D100-L107 CarbonylContact O-C 3.58Å; D100-L107 WeakPolarHBondContact O-CA 3.3Å; M101-L107 HydrophobicContact CB-CD1 4.16Å; L107-A109 HydrophobicContact CG-CB 4.48Å; L107-Q126 CarbonylContact O-C 3.58Å; L107-Q126 WeakPolarHBondContact O-CA 3.27Å; L107-T127 WeakPolarHBondContact CB-OG1 3.24Å; L107-T127 PolarHBondContact N-O 3.04Å; L107-T127 PolarHBondContact N-OG1 3.25Å; L107-T127 PolarHBondContact O-N 2.85Å |
| 108 | N | 94.1 | Very high | 90.4 | Very high | 66 Ų | 66 | 59.8 Ų | 59.8 | 35% | 0.353 | 34% | 0.338 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.2 | 115.7 | 164.2 | -170 | -37 | 0 | 0 | 0 | 108.3 | G99 D100 F125 | G99-N108 CarbonylContact C-O 3.53Å; G99-N108 WeakPolarHBondContact CA-O 3.31Å; D100-N108 HydrophobicContact CB-CB 4.4Å; D100-N108 PolarHBondContact N-O 2.72Å; D100-N108 PolarHBondContact O-N 2.75Å; N108-F125 CarbonylContact C-O 3.54Å; N108-F125 WeakPolarHBondContact CA-O 3.29Å |
| 109 | A | 94.2 | Very high | 90.1 | Very high | 23 Ų | 23 | 61.3 Ų | 61.3 | 19% | 0.19 | 35% | 0.345 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120 | 128.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 109.9 | V98 L107 V124 F125 | V98-A109 CarbonylContact O-C 3.54Å; V98-A109 WeakPolarHBondContact O-CA 3.16Å; L107-A109 HydrophobicContact CG-CB 4.48Å; A109-V124 CarbonylContact O-C 3.57Å; A109-V124 WeakPolarHBondContact O-CA 2.97Å; A109-F125 HydrophobicContact CB-CB 4.46Å; A109-F125 PolarHBondContact N-O 3.07Å; A109-F125 PolarHBondContact O-N 3.34Å |
| 110 | Q | 94.7 | Very high | 89.9 | Confident | 64 Ų | 64 | 61.2 Ų | 61.2 | 30% | 0.299 | 34% | 0.338 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122 | 128.6 | 174.7 | 176.8 | 178.9 | -1 | 0 | 0 | 109.5 | V97 V98 K122 A123 V124 | V97-Q110 CarbonylContact C-O 3.51Å; V97-Q110 WeakPolarHBondContact CA-O 3.39Å; V98-Q110 HydrophobicContact CB-CB 4.42Å; V98-Q110 PolarHBondContact N-O 2.77Å; V98-Q110 PolarHBondContact O-N 2.81Å; Q110-K122 HydrophobicContact CG-CG 4.36Å; Q110-A123 CarbonylContact C-O 3.57Å; Q110-A123 WeakPolarHBondContact CA-O 3.33Å; Q110-V124 HydrophobicContact CB-CG2 4.37Å; Q110-V124 HydrophobicContact CG-CG2 4.09Å |
| 111 | V | 94.2 | Very high | 89.9 | Confident | 45 Ų | 45 | 60.4 Ų | 60.4 | 27% | 0.273 | 34% | 0.337 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.4 | 122.2 | 176.6 | 179.8 | 0 | 0 | 0 | 0 | 107.8 | V97 I113 K122 A123 | V97-V111 HydrophobicContact CG1-CG2 4.26Å; V97-V111 HydrophobicContact CG2-CG1 4.3Å; V97-V111 HydrophobicContact CG2-CG2 4.47Å; V111-I113 HydrophobicContact CG1-CG2 4.01Å; V111-K122 CarbonylContact O-C 3.57Å; V111-K122 VanDerWaalsContact O-CA 3.25Å; V111-K122 WeakPolarHBondContact O-CA 3.49Å; V111-A123 PolarHBondContact N-O 3.47Å; V111-A123 PolarHBondContact O-N 2.86Å |
| 112 | L | 92.6 | Very high | 89.9 | Confident | 38 Ų | 38 | 58.7 Ų | 58.7 | 20% | 0.199 | 33% | 0.327 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119 | 120.1 | 177.3 | 178.2 | 68.7 | 0 | 0 | 0 | 108.9 | F94 P95 T96 K122 | F94-L112 HydrophobicContact CD1-CD2 4.19Å; F94-L112 HydrophobicContact CD1-CG 3.88Å; F94-L112 HydrophobicContact CE1-CD1 3.92Å; F94-L112 HydrophobicContact CE1-CD2 3.62Å; F94-L112 HydrophobicContact CE1-CG 3.5Å; F94-L112 VanDerWaalsContact CE1-CG 3.5Å; F94-L112 HydrophobicContact CZ-CD2 4.22Å; P95-L112 CarbonylContact C-O 3.48Å; P95-L112 WeakPolarHBondContact CA-O 3.26Å; T96-L112 PolarHBondContact N-O 2.67Å; T96-L112 PolarHBondContact O-N 3.18Å; L112-K122 HydrophobicContact CD1-CB 3.86Å |
| 113 | I | 91.8 | Very high | 90.1 | Very high | 69 Ų | 69 | 58.1 Ų | 58.1 | 35% | 0.354 | 33% | 0.326 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.3 | 150.6 | -178.2 | 56.6 | 166.9 | 0 | 0 | 0 | 110.9 | P95 V111 L115 R120 A121 | P95-I113 HydrophobicContact CB-CG2 4.01Å; V111-I113 HydrophobicContact CG1-CG2 4.01Å; I113-L115 HydrophobicContact CD1-CD1 3.55Å; I113-L115 HydrophobicContact CD1-CG 4.47Å; I113-L115 HydrophobicContact CG1-CD1 3.67Å; I113-R120 WeakPolarHBondContact O-CA 3.41Å; I113-A121 HydrophobicContact CD1-CB 4.37Å; I113-A121 HydrophobicContact CG1-CB 4Å; I113-A121 WeakPolarHBondContact CG1-O 3.47Å; I113-A121 PolarHBondContact N-O 2.95Å; I113-A121 PolarHBondContact O-N 2.86Å |
| 114 | L | 90.4 | Very high | 90.4 | Very high | 44 Ų | 44 | 55.2 Ų | 55.2 | 23% | 0.23 | 31% | 0.305 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.9 | 111.9 | 172.3 | -170.7 | 76.7 | 0 | 0 | 0 | 108.1 | L88 F94 A116 R120 | L88-L114 HydrophobicContact CD1-CD2 3.43Å; L88-L114 VanDerWaalsContact CD1-CD2 3.43Å; F94-L114 HydrophobicContact CB-CB 4.11Å; F94-L114 HydrophobicContact CD1-CB 3.97Å; F94-L114 HydrophobicContact CD2-CB 4.49Å; F94-L114 HydrophobicContact CE1-CB 4.5Å; F94-L114 HydrophobicContact CG-CB 3.95Å; L114-A116 VanDerWaalsContact CD1-O 3.24Å; L114-A116 WeakPolarHBondContact CD1-O 3.47Å; L114-A116 VanDerWaalsContact CG-O 3.27Å; L114-A116 WeakPolarHBondContact CG-O 3.31Å; L114-R120 HydrophobicContact CD1-CG 3.72Å |
| 115 | L | 86.1 | Confident | 90.8 | Very high | 103 Ų | 103 | 55.3 Ų | 55.3 | 54% | 0.539 | 30% | 0.297 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.8 | -36 | 179.4 | -83.6 | 73.9 | 0 | 0 | 0 | 111.4 | I113 L119 A121 | I113-L115 HydrophobicContact CD1-CD1 3.55Å; I113-L115 HydrophobicContact CD1-CG 4.47Å; I113-L115 HydrophobicContact CG1-CD1 3.67Å; L115-L119 HydrophobicContact CB-CD2 4.1Å; L115-L119 HydrophobicContact CB-CG 4.3Å; L115-L119 HydrophobicContact CD2-CD2 4.31Å; L115-L119 PolarHBondContact N-O 2.78Å; L115-A121 HydrophobicContact CD1-CB 3.28Å |
| 116 | A | 86.4 | Confident | 91.2 | Very high | 53 Ų | 53 | 58.1 Ų | 58.1 | 44% | 0.438 | 30% | 0.304 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -148.6 | 168.3 | 175.5 | 0 | 0 | 0 | 0 | 0 | 109 | L114 R118 L119 | L114-A116 VanDerWaalsContact CD1-O 3.24Å; L114-A116 WeakPolarHBondContact CD1-O 3.47Å; L114-A116 VanDerWaalsContact CG-O 3.27Å; L114-A116 WeakPolarHBondContact CG-O 3.31Å; A116-R118 PolarHBondContact O-N 2.82Å; A116-L119 HydrophobicContact CB-CB 4.05Å; A116-L119 PolarHBondContact N-O 2.62Å; A116-L119 PolarHBondContact O-N 3.02Å; A116-L119 VanDerWaalsContact O-O 3.08Å |
| 117 | E | 82.8 | Confident | 91.3 | Very high | 170 Ų | 170 | 57.8 Ų | 57.8 | 79% | 0.794 | 30% | 0.301 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -49.5 | -28.6 | -176.5 | -63.6 | -178.2 | 173.2 | 0 | 0 | 114.4 | ||
| 118 | R | 85.5 | Confident | 91.1 | Very high | 98 Ų | 98 | 59.8 Ų | 59.8 | 37% | 0.37 | 31% | 0.309 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -118.3 | -5.2 | -179.5 | -64.5 | -179.3 | 179.4 | -92.2 | 9.1 | 114.7 | A116 Y141 R142 D144 | A116-R118 PolarHBondContact O-N 2.82Å; R118-Y141 HydrophobicContact CB-CD2 4.47Å; R118-Y141 HydrophobicContact CB-CE2 4.03Å; R118-Y141 WeakPolarHBondContact O-CA 3.22Å; R118-R142 WeakPolarHBondContact CB-O 3.46Å; R118-R142 PolarHBondContact NH1-O 3.5Å; R118-R142 PolarHBondContact O-N 2.97Å; R118-D144 IonicContact CZ-OD1 2.85Å; R118-D144 IonicContact NH1-OD1 2.82Å; R118-D144 PolarHBondContact NH1-OD1 2.82Å; R118-D144 IonicContact NH2-OD1 3.1Å; R118-D144 PolarHBondContact NH2-OD1 3.18Å; R118-D144 IonicContact NH2-OD2 3.81Å |
| 119 | L | 89.3 | Confident | 90.6 | Very high | 64 Ų | 64 | 63.1 Ų | 63.1 | 34% | 0.335 | 32% | 0.322 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.3 | 121.2 | -175.6 | -175.9 | 67.6 | 0 | 0 | 0 | 110.5 | L115 A116 Y141 | L115-L119 HydrophobicContact CB-CD2 4.1Å; L115-L119 HydrophobicContact CB-CG 4.3Å; L115-L119 HydrophobicContact CD2-CD2 4.31Å; L115-L119 PolarHBondContact N-O 2.78Å; A116-L119 HydrophobicContact CB-CB 4.05Å; A116-L119 PolarHBondContact N-O 2.62Å; A116-L119 PolarHBondContact O-N 3.02Å; A116-L119 VanDerWaalsContact O-O 3.08Å; L119-Y141 HydrophobicContact CD1-CD2 4.44Å |
| 120 | R | 90.4 | Very high | 89.8 | Confident | 19 Ų | 19 | 66.8 Ų | 66.8 | 7% | 0.072 | 35% | 0.353 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.6 | 142.9 | 179.5 | -59.6 | 146.9 | 178.6 | -126.3 | -4.7 | 108.6 | E92 F94 I113 L114 G139 E140 R142 | E92-R120 IonicContact OE1-CZ 3.47Å; E92-R120 IonicContact OE1-NH1 3.29Å; E92-R120 PolarHBondContact OE1-NH1 3.12Å; E92-R120 IonicContact OE1-NH2 2.88Å; E92-R120 IonicContact OE2-CZ 3.44Å; E92-R120 IonicContact OE2-NH1 3.31Å; E92-R120 PolarHBondContact OE2-NH1 3.3Å; E92-R120 IonicContact OE2-NH2 3.87Å; E92-R120 PolarHBondContact OE2-NH2 3.43Å; F94-R120 HydrophobicContact CE1-CG 4.37Å; F94-R120 HydrophobicContact CZ-CG 4.33Å; I113-R120 WeakPolarHBondContact O-CA 3.41Å; L114-R120 HydrophobicContact CD1-CG 3.72Å; R120-G139 CarbonylContact O-C 3.59Å; R120-G139 WeakPolarHBondContact O-CA 3.35Å; R120-E140 HydrophobicContact CB-CB 4.32Å; R120-E140 WeakPolarHBondContact CD-OE2 3.43Å; R120-E140 PolarHBondContact N-O 3.08Å; R120-E140 IonicContact NE-OE2 3.25Å; R120-E140 IonicContact NH1-OE2 2.67Å; R120-E140 PolarHBondContact NH1-OE2 3.48Å; R120-E140 PolarHBondContact O-N 3.02Å; R120-R142 VanDerWaalsContact CZ-NH1 3.32Å |
| 121 | A | 93.4 | Very high | 89.3 | Confident | 25 Ų | 25 | 71.5 Ų | 71.5 | 21% | 0.207 | 37% | 0.372 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122 | 138.4 | 166.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | I113 L115 D138 | I113-A121 HydrophobicContact CD1-CB 4.37Å; I113-A121 HydrophobicContact CG1-CB 4Å; I113-A121 WeakPolarHBondContact CG1-O 3.47Å; I113-A121 PolarHBondContact N-O 2.95Å; I113-A121 PolarHBondContact O-N 2.86Å; L115-A121 HydrophobicContact CD1-CB 3.28Å; A121-D138 CarbonylContact C-O 3.57Å; A121-D138 VanDerWaalsContact CA-O 3.25Å; A121-D138 WeakPolarHBondContact CA-O 3.47Å |
| 122 | K | 93.6 | Very high | 88.8 | Confident | 61 Ų | 61 | 76.2 Ų | 76.2 | 27% | 0.265 | 39% | 0.389 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.4 | 131.1 | 173.3 | 172 | -177.4 | 161.1 | -172.3 | 0 | 108.2 | Q110 V111 L112 V124 F137 D138 | Q110-K122 HydrophobicContact CG-CG 4.36Å; V111-K122 CarbonylContact O-C 3.57Å; V111-K122 VanDerWaalsContact O-CA 3.25Å; V111-K122 WeakPolarHBondContact O-CA 3.49Å; L112-K122 HydrophobicContact CD1-CB 3.86Å; K122-V124 HydrophobicContact CD-CG2 4.43Å; K122-V124 VanDerWaalsContact CE-CG2 3.45Å; K122-V124 HydrophobicContact CG-CG2 4.14Å; K122-F137 CarbonylContact O-C 3.56Å; K122-D138 HydrophobicContact CB-CB 4.13Å; K122-D138 WeakPolarHBondContact CD-OD2 3.39Å; K122-D138 PolarHBondContact N-O 2.77Å; K122-D138 PolarHBondContact O-N 2.81Å |
| 123 | A | 94.4 | Very high | 88.4 | Confident | 18 Ų | 18 | 78.3 Ų | 78.3 | 15% | 0.149 | 40% | 0.4 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.1 | 132.1 | 172.7 | 0 | 0 | 0 | 0 | 0 | 108.5 | Q110 V111 F125 Q136 F137 | Q110-A123 CarbonylContact C-O 3.57Å; Q110-A123 WeakPolarHBondContact CA-O 3.33Å; V111-A123 PolarHBondContact N-O 3.47Å; V111-A123 PolarHBondContact O-N 2.86Å; A123-F125 HydrophobicContact CB-CE2 3.85Å; A123-F125 HydrophobicContact CB-CZ 4.26Å; A123-Q136 CarbonylContact C-O 3.49Å; A123-Q136 WeakPolarHBondContact CA-O 3.29Å; A123-F137 HydrophobicContact CB-CD1 3.89Å; A123-F137 HydrophobicContact CB-CE1 4.04Å |
| 124 | V | 94.1 | Very high | 88.2 | Confident | 26 Ų | 26 | 77.3 Ų | 77.3 | 16% | 0.158 | 40% | 0.398 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.7 | 129.2 | 176.8 | -176.2 | 0 | 0 | 0 | 0 | 108.5 | A109 Q110 K122 W135 Q136 | A109-V124 CarbonylContact O-C 3.57Å; A109-V124 WeakPolarHBondContact O-CA 2.97Å; Q110-V124 HydrophobicContact CB-CG2 4.37Å; Q110-V124 HydrophobicContact CG-CG2 4.09Å; K122-V124 HydrophobicContact CD-CG2 4.43Å; K122-V124 VanDerWaalsContact CE-CG2 3.45Å; K122-V124 HydrophobicContact CG-CG2 4.14Å; V124-W135 CarbonylContact O-C 3.56Å; V124-W135 WeakPolarHBondContact O-CA 3.43Å; V124-Q136 HydrophobicContact CB-CB 4.38Å; V124-Q136 PolarHBondContact N-O 2.81Å; V124-Q136 PolarHBondContact O-N 2.88Å |
| 125 | F | 93.4 | Very high | 88.2 | Confident | 63 Ų | 63 | 80.4 Ų | 80.4 | 28% | 0.276 | 41% | 0.406 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.6 | 128.1 | 177.1 | -59 | -82.5 | 0 | 0 | 0 | 109.1 | N108 A109 A123 W135 F137 | N108-F125 CarbonylContact C-O 3.54Å; N108-F125 WeakPolarHBondContact CA-O 3.29Å; A109-F125 HydrophobicContact CB-CB 4.46Å; A109-F125 PolarHBondContact N-O 3.07Å; A109-F125 PolarHBondContact O-N 3.34Å; A123-F125 HydrophobicContact CB-CE2 3.85Å; A123-F125 HydrophobicContact CB-CZ 4.26Å; F125-W135 HydrophobicContact CD1-CB 3.8Å; F125-W135 HydrophobicContact CE1-CB 4.08Å; F125-F137 HydrophobicContact CE1-CE1 4.28Å; F125-F137 AromaticContact CE1-CZ 3.95Å; F125-F137 HydrophobicContact CE1-CZ 3.95Å; F125-F137 AromaticContact CZ-CE1 3.83Å; F125-F137 HydrophobicContact CZ-CE1 3.83Å; F125-F137 AromaticContact CZ-CZ 3.97Å; F125-F137 HydrophobicContact CZ-CZ 3.97Å |
| 126 | Q | 92.4 | Very high | 88.6 | Confident | 83 Ų | 83 | 79 Ų | 79 | 39% | 0.388 | 40% | 0.397 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124 | 121 | 174 | -161.9 | -179.9 | -10.8 | 0 | 0 | 109.9 | L107 L133 T134 | L107-Q126 CarbonylContact O-C 3.58Å; L107-Q126 WeakPolarHBondContact O-CA 3.27Å; Q126-L133 PolarHBondContact O-N 2.77Å; Q126-T134 WeakPolarHBondContact CB-OG1 3.48Å; Q126-T134 PolarHBondContact N-O 2.79Å; Q126-T134 PolarHBondContact O-N 2.79Å; Q126-T134 PolarHBondContact OE1-OG1 3.2Å |
| 127 | T | 91.3 | Very high | 89 | Confident | 14 Ų | 14 | 80.6 Ų | 80.6 | 9% | 0.086 | 39% | 0.394 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.8 | 150.2 | 171.1 | 74.5 | 0 | 0 | 0 | 0 | 109.6 | S106 L107 K131 F132 | S106-T127 VanDerWaalsContact CA-O 3.24Å; S106-T127 WeakPolarHBondContact CA-O 3.44Å; S106-T127 WeakPolarHBondContact CB-O 3.44Å; L107-T127 WeakPolarHBondContact CB-OG1 3.24Å; L107-T127 PolarHBondContact N-O 3.04Å; L107-T127 PolarHBondContact N-OG1 3.25Å; L107-T127 PolarHBondContact O-N 2.85Å; T127-K131 WeakPolarHBondContact CA-O 3.42Å; T127-F132 HydrophobicContact CG2-CD1 3.62Å; T127-F132 HydrophobicContact CG2-CE1 3.61Å; T127-F132 HydrophobicContact CG2-CG 4.23Å; T127-F132 HydrophobicContact CG2-CZ 4.22Å |
| 128 | Q | 87.2 | Confident | 89.5 | Confident | 110 Ų | 110 | 73.2 Ų | 73.2 | 51% | 0.514 | 36% | 0.36 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.3 | 111.1 | 164.2 | -178.8 | 178.5 | 34.8 | 0 | 0 | 107 | A130 K131 L133 | Q128-A130 PolarHBondContact O-N 2.98Å; Q128-A130 VanDerWaalsContact O-N 3.11Å; Q128-K131 PolarHBondContact N-O 2.79Å; Q128-K131 PolarHBondContact O-N 3.13Å; Q128-L133 HydrophobicContact CB-CD1 3.36Å; Q128-L133 HydrophobicContact CB-CG 3.95Å; Q128-L133 HydrophobicContact CG-CD1 4.32Å |
| 129 | Q | 84.3 | Confident | 89.9 | Confident | 136 Ų | 136 | 69.8 Ų | 69.8 | 64% | 0.636 | 36% | 0.356 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.3 | -114.7 | -173.7 | -52.5 | -178.3 | -34.4 | 0 | 0 | 111.3 | G105 | G105-Q129 PolarHBondContact O-N 2.98Š|
| 130 | A | 77.4 | Confident | 90.1 | Very high | 100 Ų | 100 | 67.8 Ų | 67.8 | 83% | 0.826 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.6 | 1.6 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | Q128 | Q128-A130 PolarHBondContact O-N 2.98Å; Q128-A130 VanDerWaalsContact O-N 3.11Å |
| 131 | K | 84.9 | Confident | 90.3 | Very high | 163 Ų | 163 | 71.1 Ų | 71.1 | 71% | 0.709 | 36% | 0.358 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -116.3 | 134.8 | -176 | -67 | -177.1 | -180 | -179.3 | 0 | 111.4 | T127 Q128 L133 | T127-K131 WeakPolarHBondContact CA-O 3.42Å; Q128-K131 PolarHBondContact N-O 2.79Å; Q128-K131 PolarHBondContact O-N 3.13Å; K131-L133 PolarHBondContact O-N 2.85Å |
| 132 | F | 82.3 | Confident | 90.1 | Very high | 143 Ų | 143 | 71.9 Ų | 71.9 | 63% | 0.627 | 36% | 0.355 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -74.3 | 118.2 | 167 | -70.9 | -90.9 | 0 | 0 | 0 | 108.3 | T127 | T127-F132 HydrophobicContact CG2-CD1 3.62Å; T127-F132 HydrophobicContact CG2-CE1 3.61Å; T127-F132 HydrophobicContact CG2-CG 4.23Å; T127-F132 HydrophobicContact CG2-CZ 4.22Å |
| 133 | L | 85.1 | Confident | 89.9 | Confident | 82 Ų | 82 | 69.2 Ų | 69.2 | 43% | 0.429 | 35% | 0.345 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.2 | -52.6 | 178.3 | -86.3 | 170.6 | 0 | 0 | 0 | 110.4 | Q126 Q128 K131 N154 | Q126-L133 PolarHBondContact O-N 2.77Å; Q128-L133 HydrophobicContact CB-CD1 3.36Å; Q128-L133 HydrophobicContact CB-CG 3.95Å; Q128-L133 HydrophobicContact CG-CD1 4.32Å; K131-L133 PolarHBondContact O-N 2.85Å; L133-N154 PolarHBondContact O-ND2 3.17Å |
| 134 | T | 88.3 | Confident | 89.5 | Confident | 49 Ų | 49 | 73.1 Ų | 73.1 | 30% | 0.301 | 36% | 0.363 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.3 | 141 | -177 | 64.1 | 0 | 0 | 0 | 0 | 111.6 | Q126 N154 | Q126-T134 WeakPolarHBondContact CB-OG1 3.48Å; Q126-T134 PolarHBondContact N-O 2.79Å; Q126-T134 PolarHBondContact O-N 2.79Å; Q126-T134 PolarHBondContact OE1-OG1 3.2Å; T134-N154 WeakPolarHBondContact CA-OD1 3.07Å |
| 135 | W | 90.1 | Very high | 89.4 | Confident | 108 Ų | 108 | 74.4 Ų | 74.4 | 41% | 0.409 | 37% | 0.369 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.4 | 126.6 | 168.1 | 51 | 9.8 | 0 | 0 | 0 | 107.9 | V124 F125 N154 | V124-W135 CarbonylContact O-C 3.56Å; V124-W135 WeakPolarHBondContact O-CA 3.43Å; F125-W135 HydrophobicContact CD1-CB 3.8Å; F125-W135 HydrophobicContact CE1-CB 4.08Å; W135-N154 VanDerWaalsContact CD1-CA 3.47Å; W135-N154 PolarHBondContact N-OD1 3.39Å; W135-N154 PolarHBondContact O-N 2.83Å; W135-N154 PolarHBondContact O-OD1 2.83Å |
| 136 | Q | 93.5 | Very high | 89.3 | Confident | 73 Ų | 73 | 75 Ų | 75 | 34% | 0.341 | 37% | 0.37 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.3 | 132.9 | -173.9 | -174.3 | 177.1 | -49.5 | 0 | 0 | 109.4 | A123 V124 D138 T151 L152 | A123-Q136 CarbonylContact C-O 3.49Å; A123-Q136 WeakPolarHBondContact CA-O 3.29Å; V124-Q136 HydrophobicContact CB-CB 4.38Å; V124-Q136 PolarHBondContact N-O 2.81Å; V124-Q136 PolarHBondContact O-N 2.88Å; Q136-D138 WeakPolarHBondContact CG-OD1 3.42Å; Q136-D138 PolarHBondContact NE2-OD1 2.87Å; Q136-D138 PolarHBondContact NE2-OD2 2.81Å; Q136-T151 HydrophobicContact CG-CG2 3.57Å; Q136-L152 CarbonylContact C-O 3.55Å; Q136-L152 VanDerWaalsContact CA-O 3.31Å; Q136-L152 WeakPolarHBondContact CA-O 3.46Å |
| 137 | F | 94.5 | Very high | 89.4 | Confident | 88 Ų | 88 | 71.1 Ų | 71.1 | 39% | 0.386 | 35% | 0.353 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120 | 116.3 | 174.8 | -58.8 | -78.5 | 0 | 0 | 0 | 108.9 | K122 A123 F125 T151 L152 | K122-F137 CarbonylContact O-C 3.56Å; A123-F137 HydrophobicContact CB-CD1 3.89Å; A123-F137 HydrophobicContact CB-CE1 4.04Å; F125-F137 HydrophobicContact CE1-CE1 4.28Å; F125-F137 AromaticContact CE1-CZ 3.95Å; F125-F137 HydrophobicContact CE1-CZ 3.95Å; F125-F137 AromaticContact CZ-CE1 3.83Å; F125-F137 HydrophobicContact CZ-CE1 3.83Å; F125-F137 AromaticContact CZ-CZ 3.97Å; F125-F137 HydrophobicContact CZ-CZ 3.97Å; F137-T151 CarbonylContact O-C 3.47Å; F137-T151 WeakPolarHBondContact O-CA 3.27Å; F137-L152 PolarHBondContact N-O 3.17Å; F137-L152 PolarHBondContact O-N 2.85Å |
| 138 | D | 93.6 | Very high | 89.5 | Confident | 14 Ų | 14 | 71.9 Ų | 71.9 | 8% | 0.075 | 36% | 0.36 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.2 | 131.4 | 176.3 | -47.3 | -50.5 | 0 | 0 | 0 | 109.3 | A121 K122 Q136 L150 T151 | A121-D138 CarbonylContact C-O 3.57Å; A121-D138 VanDerWaalsContact CA-O 3.25Å; A121-D138 WeakPolarHBondContact CA-O 3.47Å; K122-D138 HydrophobicContact CB-CB 4.13Å; K122-D138 WeakPolarHBondContact CD-OD2 3.39Å; K122-D138 PolarHBondContact N-O 2.77Å; K122-D138 PolarHBondContact O-N 2.81Å; Q136-D138 WeakPolarHBondContact CG-OD1 3.42Å; Q136-D138 PolarHBondContact NE2-OD1 2.87Å; Q136-D138 PolarHBondContact NE2-OD2 2.81Å; D138-L150 CarbonylContact C-O 3.57Å; D138-L150 WeakPolarHBondContact CA-O 3.47Å; D138-T151 WeakPolarHBondContact OD1-CB 2.98Å; D138-T151 WeakPolarHBondContact OD1-CG2 3.31Å; D138-T151 PolarHBondContact OD1-OG1 2.84Å |
| 139 | G | 94.6 | Very high | 89.9 | Confident | 27 Ų | 27 | 67.3 Ų | 67.3 | 28% | 0.278 | 34% | 0.34 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.3 | 113.7 | 166.4 | 0 | 0 | 0 | 0 | 0 | 109.4 | R120 T149 L150 | R120-G139 CarbonylContact O-C 3.59Å; R120-G139 WeakPolarHBondContact O-CA 3.35Å; G139-T149 CarbonylContact O-C 3.53Å; G139-T149 WeakPolarHBondContact O-CA 3.27Å; G139-L150 PolarHBondContact N-O 2.81Å; G139-L150 PolarHBondContact O-N 2.87Å |
| 140 | E | 93.8 | Very high | 90.5 | Very high | 22 Ų | 22 | 64.8 Ų | 64.8 | 10% | 0.103 | 33% | 0.33 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.8 | 123.5 | 179.5 | -179.1 | -172.4 | -145 | 0 | 0 | 109.7 | S29 R120 R142 T147 T149 | S29-E140 VanDerWaalsContact CB-OE1 3.32Å; S29-E140 WeakPolarHBondContact CB-OE1 3.35Å; S29-E140 PolarHBondContact OG-OE1 2.66Å; R120-E140 HydrophobicContact CB-CB 4.32Å; R120-E140 WeakPolarHBondContact CD-OE2 3.43Å; R120-E140 PolarHBondContact N-O 3.08Å; R120-E140 IonicContact NE-OE2 3.25Å; R120-E140 IonicContact NH1-OE2 2.67Å; R120-E140 PolarHBondContact NH1-OE2 3.48Å; R120-E140 PolarHBondContact O-N 3.02Å; E140-R142 VanDerWaalsContact CD-NE 3.27Å; E140-R142 HydrophobicContact CG-CG 4.15Å; E140-R142 IonicContact OE1-CZ 3.48Å; E140-R142 VanDerWaalsContact OE1-CZ 3.31Å; E140-R142 IonicContact OE1-NE 3.92Å; E140-R142 PolarHBondContact OE1-NE 3.34Å; E140-R142 IonicContact OE1-NH2 3.5Å; E140-R142 PolarHBondContact OE1-NH2 2.93Å; E140-R142 IonicContact OE2-CZ 2.77Å; E140-R142 IonicContact OE2-NE 3.51Å; E140-R142 PolarHBondContact OE2-NE 2.92Å; E140-R142 IonicContact OE2-NH2 2.75Å; E140-R142 PolarHBondContact OE2-NH2 2.97Å; E140-R142 VanDerWaalsContact OE2-NH2 3.1Å; E140-T147 HydrophobicContact CG-CG2 4.04Å; E140-T149 HydrophobicContact CB-CG2 4.23Å |
| 141 | Y | 93.3 | Very high | 91.3 | Very high | 89 Ų | 89 | 60.7 Ų | 60.7 | 35% | 0.349 | 30% | 0.295 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.1 | 117.2 | 172.8 | -177.7 | -88.5 | 0 | 0 | 0 | 109.9 | R118 L119 Y146 T147 A148 | R118-Y141 HydrophobicContact CB-CD2 4.47Å; R118-Y141 HydrophobicContact CB-CE2 4.03Å; R118-Y141 WeakPolarHBondContact O-CA 3.22Å; L119-Y141 HydrophobicContact CD1-CD2 4.44Å; Y141-Y146 AromaticContact CD1-CE2 3.68Å; Y141-Y146 HydrophobicContact CD1-CE2 3.68Å; Y141-Y146 AromaticContact CE1-CE2 3.67Å; Y141-Y146 HydrophobicContact CE1-CE2 3.67Å; Y141-Y146 AromaticContact CE1-CZ 3.64Å; Y141-Y146 WeakPolarHBondContact CE1-OH 3.48Å; Y141-T147 WeakPolarHBondContact O-CA 3.42Å; Y141-A148 PolarHBondContact N-O 2.88Å; Y141-A148 PolarHBondContact O-N 3.37Å |
| 142 | R | 90.5 | Very high | 91.7 | Very high | 40 Ų | 40 | 56 Ų | 56 | 15% | 0.151 | 28% | 0.277 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.2 | 104.1 | 177.2 | -69.2 | -166 | -177.3 | 164.6 | 7.2 | 110.9 | E92 R118 R120 E140 T147 | E92-R142 IonicContact OE1-CZ 2.89Å; E92-R142 IonicContact OE1-NH1 3.62Å; E92-R142 PolarHBondContact OE1-NH1 3.23Å; E92-R142 IonicContact OE1-NH2 3.2Å; E92-R142 PolarHBondContact OE1-NH2 2.86Å; E92-R142 IonicContact OE2-NH1 3.59Å; R118-R142 WeakPolarHBondContact CB-O 3.46Å; R118-R142 PolarHBondContact NH1-O 3.5Å; R118-R142 PolarHBondContact O-N 2.97Å; R120-R142 VanDerWaalsContact CZ-NH1 3.32Å; E140-R142 VanDerWaalsContact CD-NE 3.27Å; E140-R142 HydrophobicContact CG-CG 4.15Å; E140-R142 IonicContact OE1-CZ 3.48Å; E140-R142 VanDerWaalsContact OE1-CZ 3.31Å; E140-R142 IonicContact OE1-NE 3.92Å; E140-R142 PolarHBondContact OE1-NE 3.34Å; E140-R142 IonicContact OE1-NH2 3.5Å; E140-R142 PolarHBondContact OE1-NH2 2.93Å; E140-R142 IonicContact OE2-CZ 2.77Å; E140-R142 IonicContact OE2-NE 3.51Å; E140-R142 PolarHBondContact OE2-NE 2.92Å; E140-R142 IonicContact OE2-NH2 2.75Å; E140-R142 PolarHBondContact OE2-NH2 2.97Å; E140-R142 VanDerWaalsContact OE2-NH2 3.1Å; R142-T147 HydrophobicContact CG-CG2 3.97Å |
| 143 | G | 88.3 | Confident | 92.1 | Very high | 6 Ų | 6 | 49.6 Ų | 49.6 | 6% | 0.062 | 25% | 0.252 | C | S | . | . | trans | -77.2 | -171.4 | 168.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | N26 Y146 | N26-G143 PolarHBondContact ND2-O 3.48Å; G143-Y146 VanDerWaalsContact CA-O 3.31Å; G143-Y146 WeakPolarHBondContact CA-O 3.39Å; G143-Y146 PolarHBondContact N-O 2.94Å | ||
| 144 | D | 87.3 | Confident | 92.3 | Very high | 99 Ų | 99 | 48.2 Ų | 48.2 | 53% | 0.529 | 25% | 0.245 | S | C | . | . | S | Bend | trans | -77.6 | -44.6 | 177.1 | -64.2 | -33.5 | 0 | 0 | 0 | 111.1 | N26 R118 | N26-D144 VanDerWaalsContact CA-O 3.26Å; N26-D144 WeakPolarHBondContact CA-O 3.44Å; N26-D144 PolarHBondContact N-O 2.9Å; R118-D144 IonicContact CZ-OD1 2.85Å; R118-D144 IonicContact NH1-OD1 2.82Å; R118-D144 PolarHBondContact NH1-OD1 2.82Å; R118-D144 IonicContact NH2-OD1 3.1Å; R118-D144 PolarHBondContact NH2-OD1 3.18Å; R118-D144 IonicContact NH2-OD2 3.81Å |
| 145 | D | 90.9 | Very high | 92.1 | Very high | 53 Ų | 53 | 47.8 Ų | 47.8 | 28% | 0.283 | 24% | 0.243 | S | C | . | . | S | Bend | trans | -112.7 | -8 | -176.7 | 63.2 | -37.9 | 0 | 0 | 0 | 114.1 | L24 S171 | L24-D145 HydrophobicContact CB-CB 4.14Å; D145-S171 WeakPolarHBondContact O-CB 3.26Å; D145-S171 PolarHBondContact O-N 2.88Å |
| 146 | Y | 91.8 | Very high | 91.8 | Very high | 75 Ų | 75 | 46 Ų | 46 | 29% | 0.294 | 24% | 0.241 | S | C | . | . | E | Extended strand (participates in β ladder) | trans | -135.8 | 158.7 | 179.4 | 71 | -87.5 | 0 | 0 | 0 | 113.3 | N26 Y141 G143 F168 L169 | N26-Y146 PolarHBondContact ND2-O 3.5Å; Y141-Y146 AromaticContact CD1-CE2 3.68Å; Y141-Y146 HydrophobicContact CD1-CE2 3.68Å; Y141-Y146 AromaticContact CE1-CE2 3.67Å; Y141-Y146 HydrophobicContact CE1-CE2 3.67Å; Y141-Y146 AromaticContact CE1-CZ 3.64Å; Y141-Y146 WeakPolarHBondContact CE1-OH 3.48Å; G143-Y146 VanDerWaalsContact CA-O 3.31Å; G143-Y146 WeakPolarHBondContact CA-O 3.39Å; G143-Y146 PolarHBondContact N-O 2.94Å; Y146-F168 AromaticContact CD2-CE2 3.84Å; Y146-F168 HydrophobicContact CD2-CE2 3.84Å; Y146-F168 HydrophobicContact CD2-CZ 4.45Å; Y146-F168 HydrophobicContact CG-CE2 4.27Å; Y146-F168 HydrophobicContact CG-CZ 4.44Å; Y146-L169 CarbonylContact C-O 3.52Å; Y146-L169 WeakPolarHBondContact CA-O 3.42Å; Y146-L169 WeakPolarHBondContact CB-O 3.31Å |
| 147 | T | 93.9 | Very high | 91.1 | Very high | 3 Ų | 3 | 50.3 Ų | 50.3 | 2% | 0.018 | 27% | 0.266 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.1 | 129.1 | 171.8 | -59.6 | 0 | 0 | 0 | 0 | 108.7 | N26 G28 E140 Y141 R142 L169 | N26-T147 PolarHBondContact ND2-OG1 3.16Å; N26-T147 PolarHBondContact OD1-OG1 3.46Å; G28-T147 VanDerWaalsContact O-CB 3.26Å; G28-T147 WeakPolarHBondContact O-CB 3.26Å; G28-T147 WeakPolarHBondContact O-CG2 3.43Å; G28-T147 PolarHBondContact O-OG1 3.32Å; E140-T147 HydrophobicContact CG-CG2 4.04Å; Y141-T147 WeakPolarHBondContact O-CA 3.42Å; R142-T147 HydrophobicContact CG-CG2 3.97Å; T147-L169 PolarHBondContact N-O 3.18Å; T147-L169 PolarHBondContact O-N 2.81Å |
| 148 | A | 94.8 | Very high | 90.5 | Very high | 30 Ų | 30 | 53.8 Ų | 53.8 | 25% | 0.248 | 29% | 0.287 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.5 | 131.1 | 175.3 | 0 | 0 | 0 | 0 | 0 | 109.4 | Y141 H167 F168 | Y141-A148 PolarHBondContact N-O 2.88Å; Y141-A148 PolarHBondContact O-N 3.37Å; A148-H167 WeakPolarHBondContact CA-O 3.5Å; A148-F168 HydrophobicContact CB-CD2 4.05Å |
| 149 | T | 95.3 | Very high | 89.7 | Confident | 14 Ų | 14 | 54.3 Ų | 54.3 | 9% | 0.086 | 30% | 0.296 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.2 | 135.2 | 177.9 | -50.4 | 0 | 0 | 0 | 0 | 109.3 | G139 E140 A166 H167 | G139-T149 CarbonylContact O-C 3.53Å; G139-T149 WeakPolarHBondContact O-CA 3.27Å; E140-T149 HydrophobicContact CB-CG2 4.23Å; T149-A166 CarbonylContact O-C 3.52Å; T149-A166 WeakPolarHBondContact O-CA 3.1Å; T149-H167 PolarHBondContact N-O 3.48Å; T149-H167 PolarHBondContact O-N 3.29Å |
| 150 | L | 95.7 | Very high | 89.1 | Confident | 82 Ų | 82 | 58.8 Ų | 58.8 | 43% | 0.429 | 31% | 0.309 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.6 | 120.1 | 172.2 | -178.1 | 67.6 | 0 | 0 | 0 | 109 | D138 G139 M164 A166 | D138-L150 CarbonylContact C-O 3.57Å; D138-L150 WeakPolarHBondContact CA-O 3.47Å; G139-L150 PolarHBondContact N-O 2.81Å; G139-L150 PolarHBondContact O-N 2.87Å; L150-M164 HydrophobicContact CD1-CG 3.79Å; L150-M164 HydrophobicContact CD1-SD 4.05Å; L150-A166 HydrophobicContact CD1-CB 4.18Å |
| 151 | T | 94.4 | Very high | 88.6 | Confident | 14 Ų | 14 | 59.3 Ų | 59.3 | 9% | 0.086 | 32% | 0.316 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.7 | 127.4 | -179.5 | -68.9 | 0 | 0 | 0 | 0 | 109.6 | Q136 F137 D138 M164 V165 | Q136-T151 HydrophobicContact CG-CG2 3.57Å; F137-T151 CarbonylContact O-C 3.47Å; F137-T151 WeakPolarHBondContact O-CA 3.27Å; D138-T151 WeakPolarHBondContact OD1-CB 2.98Å; D138-T151 WeakPolarHBondContact OD1-CG2 3.31Å; D138-T151 PolarHBondContact OD1-OG1 2.84Å; T151-M164 CarbonylContact O-C 3.55Å; T151-M164 WeakPolarHBondContact O-CA 3.42Å; T151-V165 HydrophobicContact CG2-CB 4.5Å; T151-V165 PolarHBondContact N-O 2.96Å; T151-V165 PolarHBondContact O-N 2.85Å |
| 152 | L | 93.5 | Very high | 88.4 | Confident | 64 Ų | 64 | 57 Ų | 57 | 34% | 0.335 | 31% | 0.31 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.3 | 111.8 | 173 | -67.2 | 171.6 | 0 | 0 | 0 | 108.5 | Q136 F137 V162 M164 | Q136-L152 CarbonylContact C-O 3.55Å; Q136-L152 VanDerWaalsContact CA-O 3.31Å; Q136-L152 WeakPolarHBondContact CA-O 3.46Å; F137-L152 PolarHBondContact N-O 3.17Å; F137-L152 PolarHBondContact O-N 2.85Å; L152-V162 HydrophobicContact CD2-CG2 4.48Å; L152-M164 HydrophobicContact CD2-CB 3.95Å; L152-M164 HydrophobicContact CD2-CG 3.77Å; L152-M164 HydrophobicContact CD2-SD 4.27Å |
| 153 | G | 91.4 | Very high | 88.5 | Confident | 10 Ų | 10 | 57.6 Ų | 57.6 | 10% | 0.103 | 32% | 0.316 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.7 | 132.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | P155 I163 | G153-P155 VanDerWaalsContact C-CD 3.44Å; G153-I163 PolarHBondContact N-O 2.8Å; G153-I163 WeakPolarHBondContact O-CB 3.37Å; G153-I163 PolarHBondContact O-N 2.89Å |
| 154 | N | 88.9 | Confident | 88.7 | Confident | 53 Ų | 53 | 60.6 Ų | 60.6 | 28% | 0.283 | 33% | 0.329 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | 51.3 | 49.4 | 172.4 | -64.8 | 1.2 | 0 | 0 | 0 | 115.4 | L133 T134 W135 D156 | L133-N154 PolarHBondContact O-ND2 3.17Å; T134-N154 WeakPolarHBondContact CA-OD1 3.07Å; W135-N154 VanDerWaalsContact CD1-CA 3.47Å; W135-N154 PolarHBondContact N-OD1 3.39Å; W135-N154 PolarHBondContact O-N 2.83Å; W135-N154 PolarHBondContact O-OD1 2.83Å; N154-D156 PolarHBondContact O-N 3.22Å |
| 155 | P | 84.4 | Confident | 89.1 | Confident | 39 Ų | 39 | 56.8 Ų | 56.8 | 25% | 0.253 | 31% | 0.31 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.4 | 116 | 172.9 | 29.2 | -34.6 | 0 | 0 | 0 | 110.1 | G153 V162 | G153-P155 VanDerWaalsContact C-CD 3.44Å; P155-V162 HydrophobicContact CB-CG2 4.31Å |
| 156 | D | 83.8 | Confident | 89.3 | Confident | 70 Ų | 70 | 55.9 Ų | 55.9 | 37% | 0.374 | 31% | 0.31 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.4 | 107.6 | 169.5 | -177.8 | 7.3 | 0 | 0 | 0 | 109 | N154 I158 G159 E160 S161 | N154-D156 PolarHBondContact O-N 3.22Å; D156-I158 PolarHBondContact O-N 3.47Å; D156-I158 PolarHBondContact OD1-N 2.89Å; D156-G159 VanDerWaalsContact CG-N 3.25Å; D156-G159 PolarHBondContact OD1-N 2.96Å; D156-G159 WeakPolarHBondContact OD2-CA 3.17Å; D156-G159 PolarHBondContact OD2-N 2.83Å; D156-G159 VanDerWaalsContact OD2-N 3.13Å; D156-E160 WeakPolarHBondContact O-CA 3.34Å; D156-E160 PolarHBondContact O-N 2.82Å; D156-E160 VanDerWaalsContact O-N 3.15Å; D156-S161 PolarHBondContact N-O 3.44Å; D156-S161 PolarHBondContact O-N 2.85Å; D156-S161 VanDerWaalsContact O-N 3.1Å |
| 157 | L | 78.8 | Confident | 89.5 | Confident | 164 Ų | 164 | 53 Ų | 53 | 86% | 0.859 | 30% | 0.299 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.6 | -24.6 | 179 | -72.8 | 88.4 | 0 | 0 | 0 | 112.1 | ||
| 158 | I | 81.2 | Confident | 89.6 | Confident | 162 Ų | 162 | 57.2 Ų | 57.2 | 83% | 0.831 | 32% | 0.317 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.3 | -45.1 | -177.1 | -58.8 | 174.1 | 0 | 0 | 0 | 109.7 | D156 E160 | D156-I158 PolarHBondContact O-N 3.47Å; D156-I158 PolarHBondContact OD1-N 2.89Å; I158-E160 PolarHBondContact O-N 3.02Å |
| 159 | G | 76.8 | Confident | 89.6 | Confident | 25 Ų | 25 | 56 Ų | 56 | 26% | 0.258 | 31% | 0.306 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.2 | 5.5 | 176 | 0 | 0 | 0 | 0 | 0 | 114.8 | D156 S161 P188 | D156-G159 VanDerWaalsContact CG-N 3.25Å; D156-G159 PolarHBondContact OD1-N 2.96Å; D156-G159 WeakPolarHBondContact OD2-CA 3.17Å; D156-G159 PolarHBondContact OD2-N 2.83Å; D156-G159 VanDerWaalsContact OD2-N 3.13Å; G159-S161 PolarHBondContact O-N 3.1Å; G159-P188 WeakPolarHBondContact O-CD 3.45Å; G159-P188 WeakPolarHBondContact O-CG 3.34Å |
| 160 | E | 82.3 | Confident | 89.5 | Confident | 120 Ų | 120 | 58.7 Ų | 58.7 | 56% | 0.561 | 32% | 0.318 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 43.7 | 36.1 | -174.1 | -64.1 | -169.4 | -178.5 | 0 | 0 | 113.7 | D156 I158 R186 | D156-E160 WeakPolarHBondContact O-CA 3.34Å; D156-E160 PolarHBondContact O-N 2.82Å; D156-E160 VanDerWaalsContact O-N 3.15Å; I158-E160 PolarHBondContact O-N 3.02Å; E160-R186 IonicContact OE2-NH2 2.67Å |
| 161 | S | 84.1 | Confident | 89.4 | Confident | 34 Ų | 34 | 55 Ų | 55 | 24% | 0.238 | 30% | 0.299 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.7 | 131.4 | -176.4 | 82.6 | 0 | 0 | 0 | 0 | 110.6 | D156 G159 R186 | D156-S161 PolarHBondContact N-O 3.44Å; D156-S161 PolarHBondContact O-N 2.85Å; D156-S161 VanDerWaalsContact O-N 3.1Å; G159-S161 PolarHBondContact O-N 3.1Å; S161-R186 VanDerWaalsContact CA-O 3.22Å; S161-R186 WeakPolarHBondContact CA-O 3.39Å |
| 162 | V | 88.8 | Confident | 89.3 | Confident | 39 Ų | 39 | 58.6 Ų | 58.6 | 24% | 0.236 | 32% | 0.317 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -153 | 141.1 | 177.8 | 64.3 | 0 | 0 | 0 | 0 | 109.9 | L152 P155 H185 R186 | L152-V162 HydrophobicContact CD2-CG2 4.48Å; P155-V162 HydrophobicContact CB-CG2 4.31Å; V162-H185 WeakPolarHBondContact O-CA 3.35Å; V162-R186 HydrophobicContact CG1-CB 4.19Å; V162-R186 PolarHBondContact N-O 2.88Å; V162-R186 PolarHBondContact O-N 3.49Å |
| 163 | I | 91.6 | Very high | 89.1 | Confident | 53 Ų | 53 | 58.8 Ų | 58.8 | 27% | 0.272 | 32% | 0.321 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112 | 120.2 | 166.8 | -55.7 | 174.3 | 0 | 0 | 0 | 106.6 | G153 V165 Y184 H185 | G153-I163 PolarHBondContact N-O 2.8Å; G153-I163 WeakPolarHBondContact O-CB 3.37Å; G153-I163 PolarHBondContact O-N 2.89Å; I163-V165 HydrophobicContact CG2-CG2 4.2Å; I163-Y184 WeakPolarHBondContact CA-O 3.27Å; I163-H185 HydrophobicContact CG1-CB 4.19Å |
| 164 | M | 93.7 | Very high | 88.9 | Confident | 69 Ų | 69 | 63 Ų | 63 | 34% | 0.34 | 34% | 0.338 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.7 | 127.3 | 175 | -177.2 | 176.8 | 69.6 | 0 | 0 | 108.3 | L150 T151 L152 Y184 | L150-M164 HydrophobicContact CD1-CG 3.79Å; L150-M164 HydrophobicContact CD1-SD 4.05Å; T151-M164 CarbonylContact O-C 3.55Å; T151-M164 WeakPolarHBondContact O-CA 3.42Å; L152-M164 HydrophobicContact CD2-CB 3.95Å; L152-M164 HydrophobicContact CD2-CG 3.77Å; L152-M164 HydrophobicContact CD2-SD 4.27Å; M164-Y184 PolarHBondContact N-O 2.98Å; M164-Y184 PolarHBondContact O-N 3.28Å; M164-Y184 VanDerWaalsContact O-O 3.14Å |
| 165 | V | 94.9 | Very high | 89.1 | Confident | 19 Ų | 19 | 66.5 Ų | 66.5 | 12% | 0.115 | 35% | 0.347 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.9 | 123.2 | 176.3 | -174.1 | 0 | 0 | 0 | 0 | 108.1 | T151 I163 H167 E181 L182 V183 | T151-V165 HydrophobicContact CG2-CB 4.5Å; T151-V165 PolarHBondContact N-O 2.96Å; T151-V165 PolarHBondContact O-N 2.85Å; I163-V165 HydrophobicContact CG2-CG2 4.2Å; V165-H167 WeakPolarHBondContact CG1-NE2 3.37Å; V165-E181 HydrophobicContact CG1-CG 4Å; V165-E181 WeakPolarHBondContact CG1-OE1 3.33Å; V165-L182 CarbonylContact C-O 3.57Å; V165-L182 WeakPolarHBondContact CA-O 3.38Å; V165-V183 HydrophobicContact CG1-CG2 3.96Å; V165-V183 HydrophobicContact CG2-CB 4.47Å; V165-V183 HydrophobicContact CG2-CG1 4.17Å; V165-V183 HydrophobicContact CG2-CG2 4.08Å |
| 166 | A | 95.4 | Very high | 89.5 | Confident | 35 Ų | 35 | 67.3 Ų | 67.3 | 29% | 0.289 | 35% | 0.349 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114 | 124.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 109.3 | T149 L150 E181 L182 | T149-A166 CarbonylContact O-C 3.52Å; T149-A166 WeakPolarHBondContact O-CA 3.1Å; L150-A166 HydrophobicContact CD1-CB 4.18Å; A166-E181 CarbonylContact O-C 3.55Å; A166-E181 WeakPolarHBondContact O-CA 3.24Å; A166-L182 PolarHBondContact N-O 2.85Å; A166-L182 PolarHBondContact O-N 2.94Å |
| 167 | H | 95.8 | Very high | 90 | Very high | 14 Ų | 14 | 64.3 Ų | 64.3 | 7% | 0.065 | 33% | 0.333 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.5 | 139.8 | 174.8 | -55.5 | 143.3 | 0 | 0 | 0 | 110 | F30 A148 T149 V165 G180 E181 | F30-H167 HydrophobicContact CB-CB 3.86Å; F30-H167 AromaticContact CD1-CD2 3.82Å; F30-H167 AromaticContact CD1-CE1 3.93Å; F30-H167 AromaticContact CD1-NE2 3.7Å; F30-H167 HydrophobicContact CD2-CB 4.29Å; F30-H167 HydrophobicContact CG-CB 4.11Å; F30-H167 AromaticContact CG-CD2 3.92Å; F30-H167 AromaticContact CG-CG 3.82Å; A148-H167 WeakPolarHBondContact CA-O 3.5Å; T149-H167 PolarHBondContact N-O 3.48Å; T149-H167 PolarHBondContact O-N 3.29Å; V165-H167 WeakPolarHBondContact CG1-NE2 3.37Å; H167-G180 WeakPolarHBondContact CA-O 3.49Å; H167-E181 VanDerWaalsContact CD2-CG 3.44Å; H167-E181 WeakPolarHBondContact CD2-CG 3.32Å; H167-E181 IonicContact CD2-OE1 2.86Å; H167-E181 IonicContact CE1-OE1 3.04Å; H167-E181 IonicContact NE2-OE1 3.83Å; H167-E181 PolarHBondContact NE2-OE1 3.11Å |
| 168 | F | 95.5 | Very high | 90.8 | Very high | 92 Ų | 92 | 60.1 Ų | 60.1 | 40% | 0.404 | 31% | 0.312 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -139 | 123.9 | 170.7 | -174.9 | -99.1 | 0 | 0 | 0 | 109.4 | Y146 A148 Q170 G179 G180 | Y146-F168 AromaticContact CD2-CE2 3.84Å; Y146-F168 HydrophobicContact CD2-CE2 3.84Å; Y146-F168 HydrophobicContact CD2-CZ 4.45Å; Y146-F168 HydrophobicContact CG-CE2 4.27Å; Y146-F168 HydrophobicContact CG-CZ 4.44Å; A148-F168 HydrophobicContact CB-CD2 4.05Å; F168-Q170 HydrophobicContact CE1-CB 3.94Å; F168-Q170 HydrophobicContact CZ-CB 4.38Å; F168-G179 CarbonylContact O-C 3.6Å; F168-G179 WeakPolarHBondContact O-CA 3.13Å; F168-G180 PolarHBondContact N-O 2.81Å; F168-G180 PolarHBondContact O-N 3.07Å |
| 169 | L | 95.3 | Very high | 91.5 | Very high | 3 Ų | 3 | 53.3 Ų | 53.3 | 2% | 0.016 | 28% | 0.281 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.7 | 136.8 | 174.4 | -75.1 | 169.6 | 0 | 0 | 0 | 109.7 | P27 F30 Y146 T147 V177 | P27-L169 HydrophobicContact CB-CB 4.18Å; P27-L169 HydrophobicContact CG-CB 3.98Å; F30-L169 HydrophobicContact CB-CD1 4Å; F30-L169 HydrophobicContact CD2-CD1 4.05Å; F30-L169 HydrophobicContact CD2-CD2 4.15Å; F30-L169 HydrophobicContact CD2-CG 4.01Å; F30-L169 HydrophobicContact CG-CD1 4.47Å; Y146-L169 CarbonylContact C-O 3.52Å; Y146-L169 WeakPolarHBondContact CA-O 3.42Å; Y146-L169 WeakPolarHBondContact CB-O 3.31Å; T147-L169 PolarHBondContact N-O 3.18Å; T147-L169 PolarHBondContact O-N 2.81Å; L169-V177 HydrophobicContact CB-CG1 4.28Å; L169-V177 HydrophobicContact CD2-CG1 3.96Å |
| 170 | Q | 93.9 | Very high | 92.3 | Very high | 72 Ų | 72 | 52.8 Ų | 52.8 | 34% | 0.336 | 28% | 0.276 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.6 | 133.1 | 177 | -172.8 | 174.9 | 5.6 | 0 | 0 | 110.6 | F168 L172 V177 L178 | F168-Q170 HydrophobicContact CE1-CB 3.94Å; F168-Q170 HydrophobicContact CZ-CB 4.38Å; Q170-L172 PolarHBondContact O-N 2.86Å; Q170-V177 WeakPolarHBondContact O-CA 3.21Å; Q170-L178 PolarHBondContact N-O 2.86Å; Q170-L178 PolarHBondContact O-N 3.02Å; Q170-L178 VanDerWaalsContact O-O 3.12Å |
| 171 | S | 93.6 | Very high | 93 | Very high | 3 Ų | 3 | 49 Ų | 49 | 2% | 0.021 | 26% | 0.258 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.6 | 114.4 | 170.5 | -160.9 | 0 | 0 | 0 | 0 | 108.4 | L24 P25 D145 T173 | L24-S171 VanDerWaalsContact CD1-O 3.29Å; L24-S171 WeakPolarHBondContact CD1-O 3.32Å; P25-S171 WeakPolarHBondContact O-CB 3.47Å; P25-S171 PolarHBondContact O-OG 3Å; D145-S171 WeakPolarHBondContact O-CB 3.26Å; D145-S171 PolarHBondContact O-N 2.88Å; S171-T173 PolarHBondContact OG-O 2.78Å |
| 172 | L | 91.1 | Very high | 93.5 | Very high | 90 Ų | 90 | 50.9 Ų | 50.9 | 47% | 0.471 | 27% | 0.265 | S | S | . | . | S | Bend | trans | -92.4 | -29.6 | 176.9 | -69 | 178.1 | 0 | 0 | 0 | 111.8 | Q170 L176 L178 | Q170-L172 PolarHBondContact O-N 2.86Å; L172-L176 PolarHBondContact N-O 2.89Å; L172-L178 HydrophobicContact CD1-CB 4.16Å; L172-L178 HydrophobicContact CD1-CD1 3.48Å; L172-L178 VanDerWaalsContact CD1-CD1 3.48Å; L172-L178 HydrophobicContact CD1-CG 3.82Å |
| 173 | T | 90.5 | Very high | 93.7 | Very high | 68 Ų | 68 | 50.5 Ų | 50.5 | 42% | 0.417 | 26% | 0.263 | S | S | . | . | S | Bend | trans | -143.7 | 168.3 | 173.3 | 64.7 | 0 | 0 | 0 | 0 | 108.5 | S171 R175 L176 | S171-T173 PolarHBondContact OG-O 2.78Å; T173-R175 PolarHBondContact O-N 2.79Å; T173-R175 PolarHBondContact OG1-N 2.83Å; T173-L176 PolarHBondContact N-O 2.87Å; T173-L176 PolarHBondContact O-N 2.78Å; T173-L176 WeakPolarHBondContact OG1-CB 3.37Å; T173-L176 PolarHBondContact OG1-N 2.92Å |
| 174 | H | 87.6 | Confident | 93.7 | Very high | 98 Ų | 98 | 51 Ų | 51 | 45% | 0.454 | 26% | 0.262 | S | S | . | . | S | Bend | trans | -55.5 | -13 | 175.9 | -65.4 | -80.5 | 0 | 0 | 0 | 115.1 | ||
| 175 | R | 91.3 | Very high | 93.6 | Very high | 127 Ų | 127 | 49.5 Ų | 49.5 | 48% | 0.479 | 25% | 0.254 | S | S | . | . | S | Bend | trans | -121.3 | -26.7 | -178.8 | -62.1 | -171.7 | -174.8 | 176.7 | 1.4 | 113.9 | T173 Y201 S202 | T173-R175 PolarHBondContact O-N 2.79Å; T173-R175 PolarHBondContact OG1-N 2.83Å; R175-Y201 HydrophobicContact CB-CE2 4.13Å; R175-Y201 CarbonylContact O-C 3.5Å; R175-Y201 WeakPolarHBondContact O-CA 3.34Å; R175-S202 VanDerWaalsContact CB-O 3.24Å; R175-S202 WeakPolarHBondContact CB-O 2.97Å; R175-S202 VanDerWaalsContact CG-O 3.25Å; R175-S202 WeakPolarHBondContact CG-O 3.3Å; R175-S202 PolarHBondContact O-N 3.32Å |
| 176 | L | 92.8 | Very high | 93.2 | Very high | 56 Ų | 56 | 52.7 Ų | 52.7 | 29% | 0.293 | 26% | 0.264 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.5 | 121.2 | -174.4 | -176 | 69.5 | 0 | 0 | 0 | 110.4 | L172 T173 L178 K200 Y201 | L172-L176 PolarHBondContact N-O 2.89Å; T173-L176 PolarHBondContact N-O 2.87Å; T173-L176 PolarHBondContact O-N 2.78Å; T173-L176 WeakPolarHBondContact OG1-CB 3.37Å; T173-L176 PolarHBondContact OG1-N 2.92Å; L176-L178 HydrophobicContact CD1-CD2 4.12Å; L176-L178 HydrophobicContact CD2-CG 4.45Å; L176-L178 HydrophobicContact CG-CD2 4.4Å; L176-L178 HydrophobicContact CG-CG 4.31Å; L176-K200 WeakPolarHBondContact CA-O 3.4Å; L176-Y201 HydrophobicContact CB-CD2 4.48Å; L176-Y201 HydrophobicContact CD1-CD2 4.2Å |
| 177 | V | 95.1 | Very high | 92.8 | Very high | 8 Ų | 8 | 57.5 Ų | 57.5 | 5% | 0.048 | 27% | 0.274 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.3 | 130.5 | 171.4 | 175 | 0 | 0 | 0 | 0 | 107.7 | P27 L169 Q170 G199 K200 | P27-V177 HydrophobicContact CB-CB 4.25Å; P27-V177 HydrophobicContact CB-CG1 3.4Å; P27-V177 VanDerWaalsContact CB-CG1 3.4Å; P27-V177 HydrophobicContact CB-CG2 3.78Å; P27-V177 HydrophobicContact CG-CG1 4.47Å; L169-V177 HydrophobicContact CB-CG1 4.28Å; L169-V177 HydrophobicContact CD2-CG1 3.96Å; Q170-V177 WeakPolarHBondContact O-CA 3.21Å; V177-G199 CarbonylContact O-C 3.59Å; V177-G199 WeakPolarHBondContact O-CA 3.37Å; V177-K200 HydrophobicContact CB-CB 4.27Å; V177-K200 PolarHBondContact N-O 3.44Å; V177-K200 PolarHBondContact O-N 2.85Å |
| 178 | L | 95.9 | Very high | 92.1 | Very high | 76 Ų | 76 | 61.7 Ų | 61.7 | 40% | 0.398 | 30% | 0.303 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.6 | 157 | 172 | -64.3 | -174.2 | 0 | 0 | 0 | 109.6 | Q170 L172 L176 A198 | Q170-L178 PolarHBondContact N-O 2.86Å; Q170-L178 PolarHBondContact O-N 3.02Å; Q170-L178 VanDerWaalsContact O-O 3.12Å; L172-L178 HydrophobicContact CD1-CB 4.16Å; L172-L178 HydrophobicContact CD1-CD1 3.48Å; L172-L178 VanDerWaalsContact CD1-CD1 3.48Å; L172-L178 HydrophobicContact CD1-CG 3.82Å; L176-L178 HydrophobicContact CD1-CD2 4.12Å; L176-L178 HydrophobicContact CD2-CG 4.45Å; L176-L178 HydrophobicContact CG-CD2 4.4Å; L176-L178 HydrophobicContact CG-CG 4.31Å; L178-A198 CarbonylContact C-O 3.53Å; L178-A198 WeakPolarHBondContact CA-O 3.43Å |
| 179 | G | 95.4 | Very high | 91.3 | Very high | 18 Ų | 18 | 61.8 Ų | 61.8 | 19% | 0.186 | 33% | 0.329 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -175.2 | -166 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | F168 A198 | F168-G179 CarbonylContact O-C 3.6Å; F168-G179 WeakPolarHBondContact O-CA 3.13Å; G179-A198 PolarHBondContact N-O 3.25Å; G179-A198 PolarHBondContact O-N 3.22Å |
| 180 | G | 94.8 | Very high | 90.8 | Very high | 15 Ų | 15 | 66.9 Ų | 66.9 | 16% | 0.155 | 35% | 0.353 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -156.3 | 161.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | H167 F168 T196 | H167-G180 WeakPolarHBondContact CA-O 3.49Å; F168-G180 PolarHBondContact N-O 2.81Å; F168-G180 PolarHBondContact O-N 3.07Å; G180-T196 CarbonylContact C-O 3.6Å; G180-T196 WeakPolarHBondContact CA-O 3.31Å |
| 181 | E | 95.4 | Very high | 90.5 | Very high | 39 Ų | 39 | 69.3 Ų | 69.3 | 18% | 0.182 | 36% | 0.364 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124 | 128.6 | 175.6 | 165.3 | 176.1 | -130.6 | 0 | 0 | 108.3 | F30 V165 A166 H167 V183 L195 T196 | F30-E181 HydrophobicContact CE1-CB 3.98Å; F30-E181 HydrophobicContact CE1-CG 4.47Å; F30-E181 HydrophobicContact CE2-CB 3.98Å; F30-E181 HydrophobicContact CZ-CB 3.55Å; F30-E181 HydrophobicContact CZ-CG 4.47Å; V165-E181 HydrophobicContact CG1-CG 4Å; V165-E181 WeakPolarHBondContact CG1-OE1 3.33Å; A166-E181 CarbonylContact O-C 3.55Å; A166-E181 WeakPolarHBondContact O-CA 3.24Å; H167-E181 VanDerWaalsContact CD2-CG 3.44Å; H167-E181 WeakPolarHBondContact CD2-CG 3.32Å; H167-E181 IonicContact CD2-OE1 2.86Å; H167-E181 IonicContact CE1-OE1 3.04Å; H167-E181 IonicContact NE2-OE1 3.83Å; H167-E181 PolarHBondContact NE2-OE1 3.11Å; E181-V183 HydrophobicContact CG-CG2 3.85Å; E181-L195 CarbonylContact O-C 3.59Å; E181-L195 WeakPolarHBondContact O-CA 3.38Å; E181-T196 PolarHBondContact N-O 2.83Å; E181-T196 PolarHBondContact O-N 2.8Å |
| 182 | L | 94.3 | Very high | 90.2 | Very high | 74 Ų | 74 | 70 Ų | 70 | 39% | 0.387 | 37% | 0.373 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.1 | 110.7 | 171.3 | 178.9 | 66.8 | 0 | 0 | 0 | 108.5 | V165 A166 A193 I194 | V165-L182 CarbonylContact C-O 3.57Å; V165-L182 WeakPolarHBondContact CA-O 3.38Å; A166-L182 PolarHBondContact N-O 2.85Å; A166-L182 PolarHBondContact O-N 2.94Å; L182-A193 HydrophobicContact CD1-CB 4.42Å; L182-I194 WeakPolarHBondContact CA-O 3.43Å |
| 183 | V | 93.8 | Very high | 90.2 | Very high | 31 Ų | 31 | 69 Ų | 69 | 19% | 0.188 | 38% | 0.377 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.3 | 111.2 | 172.4 | -180 | 0 | 0 | 0 | 0 | 108.1 | V165 E181 A193 I194 | V165-V183 HydrophobicContact CG1-CG2 3.96Å; V165-V183 HydrophobicContact CG2-CB 4.47Å; V165-V183 HydrophobicContact CG2-CG1 4.17Å; V165-V183 HydrophobicContact CG2-CG2 4.08Å; E181-V183 HydrophobicContact CG-CG2 3.85Å; V183-A193 CarbonylContact O-C 3.57Å; V183-A193 WeakPolarHBondContact O-CA 3.4Å; V183-I194 HydrophobicContact CB-CB 4.37Å; V183-I194 PolarHBondContact N-O 2.78Å; V183-I194 PolarHBondContact O-N 2.8Å |
| 184 | Y | 92.3 | Very high | 90.2 | Very high | 65 Ų | 65 | 67.3 Ų | 67.3 | 26% | 0.255 | 37% | 0.365 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.2 | 122.4 | 170.4 | -179.4 | -106.1 | 0 | 0 | 0 | 109.1 | I163 M164 R186 A193 | I163-Y184 WeakPolarHBondContact CA-O 3.27Å; M164-Y184 PolarHBondContact N-O 2.98Å; M164-Y184 PolarHBondContact O-N 3.28Å; M164-Y184 VanDerWaalsContact O-O 3.14Å; Y184-R186 HydrophobicContact CE1-CB 3.95Å; Y184-A193 HydrophobicContact CD2-CB 4.37Å |
| 185 | H | 91.1 | Very high | 90.5 | Very high | 37 Ų | 37 | 67.5 Ų | 67.5 | 17% | 0.171 | 37% | 0.369 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124 | 132.3 | 171.2 | 63.9 | -73.8 | 0 | 0 | 0 | 109.5 | V162 I163 G192 | V162-H185 WeakPolarHBondContact O-CA 3.35Å; I163-H185 HydrophobicContact CG1-CB 4.19Å; H185-G192 VanDerWaalsContact CE1-CA 3.48Å; H185-G192 WeakPolarHBondContact CE1-CA 3.39Å; H185-G192 PolarHBondContact N-O 2.85Å; H185-G192 PolarHBondContact ND1-O 2.85Å; H185-G192 VanDerWaalsContact ND1-O 3.1Å; H185-G192 PolarHBondContact O-N 2.87Å |
| 186 | R | 87.3 | Confident | 90.7 | Very high | 85 Ų | 85 | 62.4 Ų | 62.4 | 32% | 0.321 | 35% | 0.352 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.1 | 126.8 | 174.2 | -178.6 | -179.2 | 179.3 | 100.6 | 6.2 | 107.6 | E160 S161 V162 Y184 E191 | E160-R186 IonicContact OE2-NH2 2.67Å; S161-R186 VanDerWaalsContact CA-O 3.22Å; S161-R186 WeakPolarHBondContact CA-O 3.39Å; V162-R186 HydrophobicContact CG1-CB 4.19Å; V162-R186 PolarHBondContact N-O 2.88Å; V162-R186 PolarHBondContact O-N 3.49Å; Y184-R186 HydrophobicContact CE1-CB 3.95Å; R186-E191 HydrophobicContact CG-CG 4.24Å; R186-E191 IonicContact CZ-OE1 3.73Å; R186-E191 VanDerWaalsContact CZ-OE1 3.29Å; R186-E191 IonicContact NH1-OE1 3.29Å; R186-E191 PolarHBondContact NH1-OE1 2.83Å; R186-E191 IonicContact NH2-OE1 3.66Å |
| 187 | R | 86.2 | Confident | 90.8 | Very high | 137 Ų | 137 | 65.1 Ų | 65.1 | 52% | 0.517 | 37% | 0.366 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.2 | 156.9 | 169 | -68.1 | -178.9 | -179.4 | 174.3 | 0.4 | 108.2 | G189 E190 | R187-G189 PolarHBondContact O-N 2.82Å; R187-E190 PolarHBondContact N-O 3.49Å; R187-E190 CarbonylContact O-C 3.56Å; R187-E190 PolarHBondContact O-N 2.96Å |
| 188 | P | 81.6 | Confident | 90.9 | Very high | 102 Ų | 102 | 65 Ų | 65 | 66% | 0.662 | 37% | 0.366 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.1 | 110.8 | 175.2 | -28 | 35.9 | 0 | 0 | 0 | 111.5 | G159 | G159-P188 WeakPolarHBondContact O-CD 3.45Å; G159-P188 WeakPolarHBondContact O-CG 3.34Å |
| 189 | G | 78.5 | Confident | 90.8 | Very high | 93 Ų | 93 | 62.1 Ų | 62.1 | 96% | 0.959 | 36% | 0.355 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 86.6 | -2.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 116.4 | R187 | R187-G189 PolarHBondContact O-N 2.82Š|
| 190 | E | 83.8 | Confident | 90.8 | Very high | 110 Ų | 110 | 63 Ų | 63 | 51% | 0.514 | 35% | 0.353 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.2 | 118.7 | 177.8 | -169 | 177.4 | -168.5 | 0 | 0 | 110.6 | R187 | R187-E190 PolarHBondContact N-O 3.49Å; R187-E190 CarbonylContact O-C 3.56Å; R187-E190 PolarHBondContact O-N 2.96Å |
| 191 | E | 88.6 | Confident | 90.8 | Very high | 123 Ų | 123 | 66.6 Ų | 66.6 | 58% | 0.575 | 36% | 0.363 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -120.4 | 131.2 | 172.9 | -67.4 | -172 | -170.4 | 0 | 0 | 109.2 | R186 | R186-E191 HydrophobicContact CG-CG 4.24Å; R186-E191 IonicContact CZ-OE1 3.73Å; R186-E191 VanDerWaalsContact CZ-OE1 3.29Å; R186-E191 IonicContact NH1-OE1 3.29Å; R186-E191 PolarHBondContact NH1-OE1 2.83Å; R186-E191 IonicContact NH2-OE1 3.66Å |
| 192 | G | 87.4 | Confident | 90.8 | Very high | 19 Ų | 19 | 66.6 Ų | 66.6 | 20% | 0.196 | 37% | 0.368 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.2 | 136.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | H185 | H185-G192 VanDerWaalsContact CE1-CA 3.48Å; H185-G192 WeakPolarHBondContact CE1-CA 3.39Å; H185-G192 PolarHBondContact N-O 2.85Å; H185-G192 PolarHBondContact ND1-O 2.85Å; H185-G192 VanDerWaalsContact ND1-O 3.1Å; H185-G192 PolarHBondContact O-N 2.87Å |
| 193 | A | 90.8 | Very high | 90.7 | Very high | 69 Ų | 69 | 64.3 Ų | 64.3 | 57% | 0.57 | 36% | 0.359 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -118.3 | 129.4 | 169.9 | 0 | 0 | 0 | 0 | 0 | 109 | L182 V183 Y184 | L182-A193 HydrophobicContact CD1-CB 4.42Å; V183-A193 CarbonylContact O-C 3.57Å; V183-A193 WeakPolarHBondContact O-CA 3.4Å; Y184-A193 HydrophobicContact CD2-CB 4.37Å |
| 194 | I | 91.1 | Very high | 90.4 | Very high | 32 Ų | 32 | 68.2 Ų | 68.2 | 16% | 0.164 | 38% | 0.383 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.1 | 120.3 | 175.8 | -60.6 | 172.1 | 0 | 0 | 0 | 106.9 | L182 V183 | L182-I194 WeakPolarHBondContact CA-O 3.43Å; V183-I194 HydrophobicContact CB-CB 4.37Å; V183-I194 PolarHBondContact N-O 2.78Å; V183-I194 PolarHBondContact O-N 2.8Å |
| 195 | L | 93.4 | Very high | 90.4 | Very high | 102 Ų | 102 | 70.8 Ų | 70.8 | 53% | 0.534 | 40% | 0.397 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.7 | 127.5 | 171.7 | -177.9 | 68.7 | 0 | 0 | 0 | 108.7 | E181 G213 | E181-L195 CarbonylContact O-C 3.59Å; E181-L195 WeakPolarHBondContact O-CA 3.38Å; L195-G213 VanDerWaalsContact O-CA 3.3Å; L195-G213 WeakPolarHBondContact O-CA 3.25Å |
| 196 | T | 94.6 | Very high | 90.5 | Very high | 20 Ų | 20 | 73 Ų | 73 | 12% | 0.123 | 40% | 0.404 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.8 | 130.1 | 173.7 | -56 | 0 | 0 | 0 | 0 | 107.9 | G180 E181 N211 | G180-T196 CarbonylContact C-O 3.6Å; G180-T196 WeakPolarHBondContact CA-O 3.31Å; E181-T196 PolarHBondContact N-O 2.83Å; E181-T196 PolarHBondContact O-N 2.8Å; T196-N211 HydrophobicContact CG2-CB 4.07Å |
| 197 | L | 96.4 | Very high | 90.9 | Very high | 112 Ų | 112 | 69.8 Ų | 69.8 | 59% | 0.586 | 39% | 0.394 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -94.6 | 138.4 | 171.7 | -61.6 | 176 | 0 | 0 | 0 | 108.8 | N211 V212 | L197-N211 CarbonylContact O-C 3.49Å; L197-N211 VanDerWaalsContact O-CA 3.27Å; L197-N211 WeakPolarHBondContact O-CA 3.25Å; L197-V212 PolarHBondContact N-O 2.91Å; L197-V212 PolarHBondContact O-N 2.78Å |
| 198 | A | 95.5 | Very high | 91.4 | Very high | 5 Ų | 5 | 64.7 Ų | 64.7 | 4% | 0.041 | 38% | 0.381 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.8 | 140.8 | -179.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | F30 L33 L178 G179 L210 N211 | F30-A198 HydrophobicContact CD2-CB 4.4Å; F30-A198 HydrophobicContact CE2-CB 3.45Å; F30-A198 VanDerWaalsContact CE2-CB 3.45Å; F30-A198 HydrophobicContact CZ-CB 3.97Å; L33-A198 HydrophobicContact CD2-CB 3.92Å; L178-A198 CarbonylContact C-O 3.53Å; L178-A198 WeakPolarHBondContact CA-O 3.43Å; G179-A198 PolarHBondContact N-O 3.25Å; G179-A198 PolarHBondContact O-N 3.22Å; A198-L210 CarbonylContact C-O 3.52Å; A198-L210 WeakPolarHBondContact CA-O 3.48Å; A198-N211 VanDerWaalsContact CB-OD1 3.3Å; A198-N211 WeakPolarHBondContact CB-OD1 3.27Å |
| 199 | G | 95.4 | Very high | 92.1 | Very high | 16 Ų | 16 | 60.2 Ų | 60.2 | 17% | 0.165 | 35% | 0.352 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.4 | 138.4 | 174.3 | 0 | 0 | 0 | 0 | 0 | 110.9 | V177 T209 L210 | V177-G199 CarbonylContact O-C 3.59Å; V177-G199 WeakPolarHBondContact O-CA 3.37Å; G199-T209 CarbonylContact O-C 3.51Å; G199-T209 VanDerWaalsContact O-CA 3.22Å; G199-T209 WeakPolarHBondContact O-CA 3.49Å; G199-L210 PolarHBondContact N-O 2.78Å; G199-L210 PolarHBondContact O-N 2.92Å |
| 200 | K | 95.4 | Very high | 92.9 | Very high | 36 Ų | 36 | 59.9 Ų | 59.9 | 16% | 0.157 | 33% | 0.328 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130 | 130.6 | 172.2 | 167.7 | 175.7 | 72.6 | -177.4 | 0 | 109.9 | P27 L33 L176 V177 V207 A208 T209 | P27-K200 PolarHBondContact O-NZ 2.67Å; L33-K200 HydrophobicContact CD1-CB 3.63Å; L33-K200 HydrophobicContact CD1-CD 4.05Å; L33-K200 HydrophobicContact CD1-CG 4.43Å; L33-K200 HydrophobicContact CG-CB 4.38Å; L176-K200 WeakPolarHBondContact CA-O 3.4Å; V177-K200 HydrophobicContact CB-CB 4.27Å; V177-K200 PolarHBondContact N-O 3.44Å; V177-K200 PolarHBondContact O-N 2.85Å; K200-V207 HydrophobicContact CD-CG1 4.23Å; K200-V207 HydrophobicContact CG-CG1 4.04Å; K200-A208 CarbonylContact C-O 3.46Å; K200-A208 WeakPolarHBondContact CA-O 3.5Å; K200-T209 HydrophobicContact CB-CG2 3.89Å; K200-T209 HydrophobicContact CD-CG2 4.26Å; K200-T209 HydrophobicContact CG-CG2 3.87Å |
| 201 | Y | 95.1 | Very high | 93.4 | Very high | 91 Ų | 91 | 55.5 Ų | 55.5 | 36% | 0.357 | 31% | 0.308 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.5 | 113.5 | 172.5 | -171.8 | -90.9 | 0 | 0 | 0 | 109.8 | R175 L176 A203 W206 V207 A208 | R175-Y201 HydrophobicContact CB-CE2 4.13Å; R175-Y201 CarbonylContact O-C 3.5Å; R175-Y201 WeakPolarHBondContact O-CA 3.34Å; L176-Y201 HydrophobicContact CB-CD2 4.48Å; L176-Y201 HydrophobicContact CD1-CD2 4.2Å; Y201-A203 HydrophobicContact CE1-CB 4.24Å; Y201-W206 HydrophobicContact CD1-CE3 4.47Å; Y201-W206 AromaticContact CD1-CH2 3.27Å; Y201-W206 HydrophobicContact CD1-CH2 3.27Å; Y201-W206 HydrophobicContact CD1-CZ2 4.1Å; Y201-W206 AromaticContact CD1-CZ3 3.5Å; Y201-W206 HydrophobicContact CD1-CZ3 3.5Å; Y201-W206 VanDerWaalsContact CD1-CZ3 3.5Å; Y201-W206 AromaticContact CE1-CH2 3.4Å; Y201-W206 HydrophobicContact CE1-CH2 3.4Å; Y201-W206 VanDerWaalsContact CE1-CH2 3.4Å; Y201-W206 AromaticContact CE1-CZ2 3.81Å; Y201-W206 HydrophobicContact CE1-CZ2 3.81Å; Y201-W206 HydrophobicContact CE1-CZ3 4.09Å; Y201-W206 HydrophobicContact CG-CH2 4.44Å; Y201-V207 WeakPolarHBondContact O-CA 3.14Å; Y201-A208 PolarHBondContact N-O 3.48Å; Y201-A208 PolarHBondContact O-N 3.25Å |
| 202 | S | 93.8 | Very high | 93.7 | Very high | 40 Ų | 40 | 53 Ų | 53 | 28% | 0.28 | 30% | 0.3 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.4 | 114.1 | 179.8 | -62 | 0 | 0 | 0 | 0 | 110.6 | R175 | R175-S202 VanDerWaalsContact CB-O 3.24Å; R175-S202 WeakPolarHBondContact CB-O 2.97Å; R175-S202 VanDerWaalsContact CG-O 3.25Å; R175-S202 WeakPolarHBondContact CG-O 3.3Å; R175-S202 PolarHBondContact O-N 3.32Å |
| 203 | A | 92.2 | Very high | 93.9 | Very high | 25 Ų | 25 | 53 Ų | 53 | 21% | 0.207 | 30% | 0.3 | C | S | . | . | trans | -101 | -179.3 | 167.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | Y201 H205 W206 | Y201-A203 HydrophobicContact CE1-CB 4.24Å; A203-H205 PolarHBondContact O-N 2.86Å; A203-W206 CarbonylContact C-O 3.58Å; A203-W206 WeakPolarHBondContact CA-O 3.35Å; A203-W206 HydrophobicContact CB-CD2 3.7Å; A203-W206 VanDerWaalsContact CB-CE2 3.41Å; A203-W206 HydrophobicContact CB-CE3 4.35Å; A203-W206 HydrophobicContact CB-CG 3.98Å; A203-W206 HydrophobicContact CB-CZ2 3.86Å; A203-W206 WeakPolarHBondContact CB-O 3.4Å; A203-W206 PolarHBondContact N-O 3.16Å | ||
| 204 | V | 88.9 | Confident | 93.7 | Very high | 113 Ų | 113 | 53.4 Ų | 53.4 | 69% | 0.685 | 30% | 0.299 | S | S | * | . | S | Bend | trans | -65 | -38.8 | -176.3 | -177.4 | 0 | 0 | 0 | 0 | 112.4 | ||
| 205 | H | 91.6 | Very high | 93.3 | Very high | 120 Ų | 120 | 53 Ų | 53 | 56% | 0.556 | 30% | 0.303 | S | S | * | . | S | Bend | trans | -117.6 | -7.3 | -175.1 | -61.2 | -63.3 | 0 | 0 | 0 | 113.9 | A203 R224 | A203-H205 PolarHBondContact O-N 2.86Å; H205-R224 PolarHBondContact O-N 2.78Å |
| 206 | W | 93.8 | Very high | 93.2 | Very high | 83 Ų | 83 | 49 Ų | 49 | 31% | 0.314 | 29% | 0.286 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.2 | 153.6 | -176.2 | 61.5 | -93.5 | 0 | 0 | 0 | 112 | Y201 A203 A208 Y221 Y222 H223 | Y201-W206 HydrophobicContact CD1-CE3 4.47Å; Y201-W206 AromaticContact CD1-CH2 3.27Å; Y201-W206 HydrophobicContact CD1-CH2 3.27Å; Y201-W206 HydrophobicContact CD1-CZ2 4.1Å; Y201-W206 AromaticContact CD1-CZ3 3.5Å; Y201-W206 HydrophobicContact CD1-CZ3 3.5Å; Y201-W206 VanDerWaalsContact CD1-CZ3 3.5Å; Y201-W206 AromaticContact CE1-CH2 3.4Å; Y201-W206 HydrophobicContact CE1-CH2 3.4Å; Y201-W206 VanDerWaalsContact CE1-CH2 3.4Å; Y201-W206 AromaticContact CE1-CZ2 3.81Å; Y201-W206 HydrophobicContact CE1-CZ2 3.81Å; Y201-W206 HydrophobicContact CE1-CZ3 4.09Å; Y201-W206 HydrophobicContact CG-CH2 4.44Å; A203-W206 CarbonylContact C-O 3.58Å; A203-W206 WeakPolarHBondContact CA-O 3.35Å; A203-W206 HydrophobicContact CB-CD2 3.7Å; A203-W206 VanDerWaalsContact CB-CE2 3.41Å; A203-W206 HydrophobicContact CB-CE3 4.35Å; A203-W206 HydrophobicContact CB-CG 3.98Å; A203-W206 HydrophobicContact CB-CZ2 3.86Å; A203-W206 WeakPolarHBondContact CB-O 3.4Å; A203-W206 PolarHBondContact N-O 3.16Å; W206-A208 HydrophobicContact CE3-CB 4.14Å; W206-A208 HydrophobicContact CZ3-CB 3.73Å; W206-Y221 HydrophobicContact CB-CE2 3.98Å; W206-Y221 WeakPolarHBondContact CB-OH 3.36Å; W206-Y221 AromaticContact CD2-CE2 3.92Å; W206-Y221 HydrophobicContact CD2-CE2 3.92Å; W206-Y221 HydrophobicContact CE3-CD2 4.27Å; W206-Y221 AromaticContact CE3-CE2 3.59Å; W206-Y221 HydrophobicContact CE3-CE2 3.59Å; W206-Y221 HydrophobicContact CG-CE2 4.12Å; W206-Y221 HydrophobicContact CZ3-CE2 4.32Å; W206-Y222 CarbonylContact C-O 3.51Å; W206-Y222 WeakPolarHBondContact CA-O 3.35Å; W206-Y222 VanDerWaalsContact CB-O 3.25Å; W206-Y222 WeakPolarHBondContact CB-O 3.35Å; W206-H223 HydrophobicContact CB-CB 4.29Å |
| 207 | V | 95.3 | Very high | 93.2 | Very high | 18 Ų | 18 | 49.4 Ų | 49.4 | 11% | 0.109 | 29% | 0.291 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.7 | 127.4 | 177.9 | -178.2 | 0 | 0 | 0 | 0 | 107.5 | L36 K200 Y201 T209 Y222 | L36-V207 HydrophobicContact CD1-CG2 4.09Å; K200-V207 HydrophobicContact CD-CG1 4.23Å; K200-V207 HydrophobicContact CG-CG1 4.04Å; Y201-V207 WeakPolarHBondContact O-CA 3.14Å; V207-T209 HydrophobicContact CG1-CG2 4.09Å; V207-Y222 HydrophobicContact CG2-CD1 4.46Å; V207-Y222 PolarHBondContact N-O 2.87Å; V207-Y222 PolarHBondContact O-N 3.47Å |
| 208 | A | 96.1 | Very high | 93.1 | Very high | 30 Ų | 30 | 45.5 Ų | 45.5 | 25% | 0.248 | 27% | 0.27 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.2 | 135.2 | 173.1 | 0 | 0 | 0 | 0 | 0 | 109.3 | K200 Y201 W206 S220 Y221 | K200-A208 CarbonylContact C-O 3.46Å; K200-A208 WeakPolarHBondContact CA-O 3.5Å; Y201-A208 PolarHBondContact N-O 3.48Å; Y201-A208 PolarHBondContact O-N 3.25Å; W206-A208 HydrophobicContact CE3-CB 4.14Å; W206-A208 HydrophobicContact CZ3-CB 3.73Å; A208-S220 CarbonylContact C-O 3.51Å; A208-S220 WeakPolarHBondContact CA-O 3.43Å; A208-Y221 HydrophobicContact CB-CD2 4.15Å |
| 209 | T | 96 | Very high | 93.1 | Very high | 7 Ų | 7 | 46.7 Ų | 46.7 | 4% | 0.043 | 28% | 0.28 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.3 | 148.6 | 176 | 69.9 | 0 | 0 | 0 | 0 | 110.7 | L33 H34 G199 K200 V207 A219 S220 | L33-T209 HydrophobicContact CG-CG2 4.04Å; L33-T209 VanDerWaalsContact O-CG2 3.27Å; L33-T209 WeakPolarHBondContact O-CG2 3.13Å; H34-T209 PolarHBondContact CE1-OG1 2.86Å; H34-T209 PolarHBondContact ND1-OG1 3.02Å; G199-T209 CarbonylContact O-C 3.51Å; G199-T209 VanDerWaalsContact O-CA 3.22Å; G199-T209 WeakPolarHBondContact O-CA 3.49Å; K200-T209 HydrophobicContact CB-CG2 3.89Å; K200-T209 HydrophobicContact CD-CG2 4.26Å; K200-T209 HydrophobicContact CG-CG2 3.87Å; V207-T209 HydrophobicContact CG1-CG2 4.09Å; T209-A219 CarbonylContact O-C 3.59Å; T209-A219 WeakPolarHBondContact O-CA 3.36Å; T209-S220 PolarHBondContact N-O 2.81Å; T209-S220 PolarHBondContact O-N 2.87Å; T209-S220 PolarHBondContact OG1-OG 2.88Å |
| 210 | L | 95.9 | Very high | 93.2 | Very high | 87 Ų | 87 | 46.3 Ų | 46.3 | 46% | 0.455 | 28% | 0.275 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -146 | 122.1 | -176.4 | 176.7 | 66 | 0 | 0 | 0 | 109.4 | A198 G199 V212 H218 A219 | A198-L210 CarbonylContact C-O 3.52Å; A198-L210 WeakPolarHBondContact CA-O 3.48Å; G199-L210 PolarHBondContact N-O 2.78Å; G199-L210 PolarHBondContact O-N 2.92Å; L210-V212 HydrophobicContact CD1-CG2 3.74Å; L210-V212 HydrophobicContact CD2-CG2 4.13Å; L210-V212 HydrophobicContact CG-CG2 3.81Å; L210-H218 CarbonylContact C-O 3.47Å; L210-H218 WeakPolarHBondContact CA-O 3.45Å; L210-A219 HydrophobicContact CD1-CB 3.85Å |
| 211 | N | 94.8 | Very high | 93.2 | Very high | 18 Ų | 18 | 48.7 Ų | 48.7 | 10% | 0.096 | 28% | 0.283 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.3 | 126.4 | 171 | -72.8 | 16.4 | 0 | 0 | 0 | 108.4 | L33 H34 T196 L197 A198 A217 H218 | L33-N211 WeakPolarHBondContact CD2-OD1 3.35Å; H34-N211 PolarHBondContact NE2-ND2 2.94Å; H34-N211 PolarHBondContact NE2-OD1 2.92Å; T196-N211 HydrophobicContact CG2-CB 4.07Å; L197-N211 CarbonylContact O-C 3.49Å; L197-N211 VanDerWaalsContact O-CA 3.27Å; L197-N211 WeakPolarHBondContact O-CA 3.25Å; A198-N211 VanDerWaalsContact CB-OD1 3.3Å; A198-N211 WeakPolarHBondContact CB-OD1 3.27Å; N211-A217 CarbonylContact O-C 3.6Å; N211-A217 VanDerWaalsContact O-CA 3.27Å; N211-A217 WeakPolarHBondContact O-CA 3.44Å; N211-H218 HydrophobicContact CB-CB 4.38Å; N211-H218 PolarHBondContact N-O 2.82Å; N211-H218 PolarHBondContact O-N 2.88Å |
| 212 | V | 95.1 | Very high | 93.3 | Very high | 69 Ų | 69 | 45.7 Ų | 45.7 | 42% | 0.418 | 27% | 0.271 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.2 | 122.2 | 179.1 | 180 | 0 | 0 | 0 | 0 | 108.6 | L197 L210 A217 | L197-V212 PolarHBondContact N-O 2.91Å; L197-V212 PolarHBondContact O-N 2.78Å; L210-V212 HydrophobicContact CD1-CG2 3.74Å; L210-V212 HydrophobicContact CD2-CG2 4.13Å; L210-V212 HydrophobicContact CG-CG2 3.81Å; V212-A217 HydrophobicContact CG2-CB 4.1Å |
| 213 | G | 91.8 | Very high | 93.4 | Very high | 19 Ų | 19 | 46.5 Ų | 46.5 | 20% | 0.196 | 27% | 0.271 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.3 | -178.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | L195 G215 G216 | L195-G213 VanDerWaalsContact O-CA 3.3Å; L195-G213 WeakPolarHBondContact O-CA 3.25Å; G213-G215 PolarHBondContact O-N 2.83Å; G213-G216 PolarHBondContact N-O 2.78Å; G213-G216 PolarHBondContact O-N 2.87Å; G213-G216 VanDerWaalsContact O-O 3.1Å |
| 214 | S | 86.1 | Confident | 93.5 | Very high | 79 Ų | 79 | 50.6 Ų | 50.6 | 55% | 0.552 | 28% | 0.281 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.3 | -19.7 | 177.9 | 61.4 | 0 | 0 | 0 | 0 | 113.6 | ||
| 215 | G | 83.1 | Confident | 93.5 | Very high | 24 Ų | 24 | 48.2 Ų | 48.2 | 25% | 0.247 | 27% | 0.273 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -83.5 | -19.5 | 177.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | G213 T239 | G213-G215 PolarHBondContact O-N 2.83Å; G215-T239 PolarHBondContact O-N 2.8Å; G215-T239 VanDerWaalsContact O-N 3.13Å |
| 216 | G | 91.3 | Very high | 93.4 | Very high | 17 Ų | 17 | 47.1 Ų | 47.1 | 18% | 0.175 | 27% | 0.271 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 155.9 | -176.4 | -172.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | G213 A237 | G213-G216 PolarHBondContact N-O 2.78Å; G213-G216 PolarHBondContact O-N 2.87Å; G213-G216 VanDerWaalsContact O-O 3.1Å; G216-A237 CarbonylContact C-O 3.51Å; G216-A237 WeakPolarHBondContact CA-O 3.37Å |
| 217 | A | 93.6 | Very high | 93.1 | Very high | 28 Ų | 28 | 50.4 Ų | 50.4 | 23% | 0.231 | 29% | 0.29 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.6 | 136.9 | 174 | 0 | 0 | 0 | 0 | 0 | 110.1 | N211 V212 A237 | N211-A217 CarbonylContact O-C 3.6Å; N211-A217 VanDerWaalsContact O-CA 3.27Å; N211-A217 WeakPolarHBondContact O-CA 3.44Å; V212-A217 HydrophobicContact CG2-CB 4.1Å; A217-A237 HydrophobicContact CB-CB 4.46Å; A217-A237 PolarHBondContact N-O 2.81Å; A217-A237 PolarHBondContact O-N 2.85Å |
| 218 | H | 94.9 | Very high | 92.9 | Very high | 31 Ų | 31 | 53.7 Ų | 53.7 | 14% | 0.144 | 30% | 0.304 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130 | 113.4 | 176.4 | -178.7 | -140 | 0 | 0 | 0 | 109 | H34 L210 N211 E234 F235 | H34-H218 AromaticContact CD2-CE1 3.81Å; H34-H218 AromaticContact CD2-ND1 3.53Å; H34-H218 AromaticContact CE1-CE1 3.62Å; H34-H218 AromaticContact CE1-CG 3.9Å; H34-H218 AromaticContact CE1-ND1 3.25Å; H34-H218 PolarHBondContact CE1-ND1 3.14Å; H34-H218 AromaticContact CG-CE1 3.45Å; H34-H218 VanDerWaalsContact CG-CE1 3.45Å; H34-H218 AromaticContact CG-ND1 3.64Å; H34-H218 AromaticContact ND1-CE1 3.34Å; H34-H218 PolarHBondContact ND1-CE1 2.64Å; H34-H218 VanDerWaalsContact ND1-CE1 3.34Å; H34-H218 AromaticContact ND1-ND1 3.48Å; H34-H218 PolarHBondContact ND1-ND1 2.95Å; H34-H218 AromaticContact NE2-CE1 3.94Å; H34-H218 AromaticContact NE2-ND1 3.32Å; H34-H218 PolarHBondContact NE2-ND1 2.86Å; L210-H218 CarbonylContact C-O 3.47Å; L210-H218 WeakPolarHBondContact CA-O 3.45Å; N211-H218 HydrophobicContact CB-CB 4.38Å; N211-H218 PolarHBondContact N-O 2.82Å; N211-H218 PolarHBondContact O-N 2.88Å; H218-E234 IonicContact CD2-OE1 3.6Å; H218-E234 IonicContact CE1-OE1 3.75Å; H218-E234 PolarHBondContact CE1-OE1 2.93Å; H218-E234 VanDerWaalsContact CE1-OE1 3.25Å; H218-E234 VanDerWaalsContact NE2-CG 3.34Å; H218-E234 WeakPolarHBondContact NE2-CG 3.3Å; H218-E234 IonicContact NE2-OE1 3.87Å; H218-E234 PolarHBondContact NE2-OE1 2.79Å; H218-F235 CarbonylContact C-O 3.56Å; H218-F235 WeakPolarHBondContact CA-O 3.43Å; H218-F235 PolarHBondContact CD2-O 2.78Å |
| 219 | A | 95.9 | Very high | 92.8 | Very high | 29 Ų | 29 | 54.5 Ų | 54.5 | 24% | 0.24 | 31% | 0.306 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115 | 138.1 | 178.8 | 0 | 0 | 0 | 0 | 0 | 109.5 | T209 L210 F235 | T209-A219 CarbonylContact O-C 3.59Å; T209-A219 WeakPolarHBondContact O-CA 3.36Å; L210-A219 HydrophobicContact CD1-CB 3.85Å; A219-F235 HydrophobicContact CB-CB 4.38Å; A219-F235 HydrophobicContact CB-CD1 4.48Å; A219-F235 PolarHBondContact N-O 2.82Å; A219-F235 PolarHBondContact O-N 2.85Å |
| 220 | S | 96.1 | Very high | 92.8 | Very high | 8 Ų | 8 | 56.1 Ų | 56.1 | 6% | 0.056 | 31% | 0.313 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.3 | 142.5 | 173.3 | 80.2 | 0 | 0 | 0 | 0 | 112.1 | H34 A208 T209 V233 | H34-S220 WeakPolarHBondContact ND1-CB 3.42Å; H34-S220 PolarHBondContact ND1-OG 2.73Å; A208-S220 CarbonylContact C-O 3.51Å; A208-S220 WeakPolarHBondContact CA-O 3.43Å; T209-S220 PolarHBondContact N-O 2.81Å; T209-S220 PolarHBondContact O-N 2.87Å; T209-S220 PolarHBondContact OG1-OG 2.88Å; S220-V233 CarbonylContact C-O 3.56Å; S220-V233 VanDerWaalsContact CA-O 3.29Å; S220-V233 WeakPolarHBondContact CA-O 3.27Å |
| 221 | Y | 96.6 | Very high | 92.8 | Very high | 87 Ų | 87 | 53.6 Ų | 53.6 | 34% | 0.341 | 30% | 0.301 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.5 | 113.8 | 179.7 | 179.4 | -99.2 | 0 | 0 | 0 | 109.1 | W206 A208 H223 G232 V233 | W206-Y221 HydrophobicContact CB-CE2 3.98Å; W206-Y221 WeakPolarHBondContact CB-OH 3.36Å; W206-Y221 AromaticContact CD2-CE2 3.92Å; W206-Y221 HydrophobicContact CD2-CE2 3.92Å; W206-Y221 HydrophobicContact CE3-CD2 4.27Å; W206-Y221 AromaticContact CE3-CE2 3.59Å; W206-Y221 HydrophobicContact CE3-CE2 3.59Å; W206-Y221 HydrophobicContact CG-CE2 4.12Å; W206-Y221 HydrophobicContact CZ3-CE2 4.32Å; A208-Y221 HydrophobicContact CB-CD2 4.15Å; Y221-H223 HydrophobicContact CD1-CB 4.42Å; Y221-H223 HydrophobicContact CE1-CB 3.64Å; Y221-H223 AromaticContact CZ-ND1 3.99Å; Y221-H223 PolarHBondContact OH-ND1 2.81Å; Y221-H223 VanDerWaalsContact OH-ND1 3.09Å; Y221-G232 CarbonylContact O-C 3.54Å; Y221-G232 WeakPolarHBondContact O-CA 3.36Å; Y221-V233 PolarHBondContact N-O 2.82Å; Y221-V233 PolarHBondContact O-N 3.22Å |
| 222 | Y | 96.6 | Very high | 92.9 | Very high | 27 Ų | 27 | 52.7 Ų | 52.7 | 11% | 0.106 | 30% | 0.297 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.9 | 134.6 | 174.9 | 172.1 | -97.8 | 0 | 0 | 0 | 109.6 | L36 V40 W206 V207 R224 Q230 | L36-Y222 HydrophobicContact CB-CD1 4.44Å; L36-Y222 HydrophobicContact CB-CD2 4.34Å; L36-Y222 HydrophobicContact CB-CG 4.13Å; L36-Y222 VanDerWaalsContact O-CD2 3.28Å; L36-Y222 WeakPolarHBondContact O-CD2 3.48Å; V40-Y222 HydrophobicContact CG2-CD2 3.71Å; V40-Y222 HydrophobicContact CG2-CE2 3.64Å; W206-Y222 CarbonylContact C-O 3.51Å; W206-Y222 WeakPolarHBondContact CA-O 3.35Å; W206-Y222 VanDerWaalsContact CB-O 3.25Å; W206-Y222 WeakPolarHBondContact CB-O 3.35Å; V207-Y222 HydrophobicContact CG2-CD1 4.46Å; V207-Y222 PolarHBondContact N-O 2.87Å; V207-Y222 PolarHBondContact O-N 3.47Å; Y222-R224 HydrophobicContact CE1-CB 4.15Å; Y222-Q230 HydrophobicContact CE2-CB 4.07Å; Y222-Q230 PolarHBondContact OH-OE1 2.81Å |
| 223 | H | 95.4 | Very high | 92.9 | Very high | 58 Ų | 58 | 50.9 Ų | 50.9 | 27% | 0.269 | 29% | 0.285 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.3 | 123.9 | 176.8 | -170.5 | 98 | 0 | 0 | 0 | 111.1 | W206 Y221 A225 V231 | W206-H223 HydrophobicContact CB-CB 4.29Å; Y221-H223 HydrophobicContact CD1-CB 4.42Å; Y221-H223 HydrophobicContact CE1-CB 3.64Å; Y221-H223 AromaticContact CZ-ND1 3.99Å; Y221-H223 PolarHBondContact OH-ND1 2.81Å; Y221-H223 VanDerWaalsContact OH-ND1 3.09Å; H223-A225 PolarHBondContact CD2-N 2.89Å; H223-A225 PolarHBondContact O-N 2.8Å; H223-V231 PolarHBondContact N-O 2.82Å; H223-V231 PolarHBondContact O-N 2.78Å |
| 224 | R | 94 | Very high | 93.1 | Very high | 110 Ų | 110 | 51.4 Ų | 51.4 | 42% | 0.415 | 28% | 0.283 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.6 | 95.2 | 173.2 | -175.6 | 172.1 | -176.7 | -172.3 | -0.1 | 109.2 | H205 Y222 N226 Q230 | H205-R224 PolarHBondContact O-N 2.78Å; Y222-R224 HydrophobicContact CE1-CB 4.15Å; R224-N226 WeakPolarHBondContact CG-O 3.36Å; R224-Q230 HydrophobicContact CG-CG 4.26Å |
| 225 | A | 89.5 | Confident | 93.6 | Very high | 63 Ų | 63 | 51.5 Ų | 51.5 | 52% | 0.521 | 27% | 0.273 | S | S | . | . | trans | -70.8 | -39.2 | -179.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | H223 V229 | H223-A225 PolarHBondContact CD2-N 2.89Å; H223-A225 PolarHBondContact O-N 2.8Å; A225-V229 HydrophobicContact CB-CB 4.5Å; A225-V229 HydrophobicContact CB-CG1 4.4Å; A225-V229 PolarHBondContact N-O 2.71Å; A225-V229 VanDerWaalsContact N-O 3.16Å | ||
| 226 | N | 89.9 | Confident | 94.1 | Very high | 97 Ų | 97 | 55 Ų | 55 | 52% | 0.519 | 28% | 0.283 | S | S | . | . | S | Bend | trans | -151.1 | 177.4 | 176.6 | -159.6 | -0.8 | 0 | 0 | 0 | 110.5 | R224 Q228 V229 | R224-N226 WeakPolarHBondContact CG-O 3.36Å; N226-Q228 PolarHBondContact O-N 3.03Å; N226-V229 PolarHBondContact N-O 2.83Å; N226-V229 VanDerWaalsContact N-O 3.15Å; N226-V229 PolarHBondContact O-N 3.2Å; N226-V229 VanDerWaalsContact O-O 3.04Å |
| 227 | E | 86.8 | Confident | 94.2 | Very high | 152 Ų | 152 | 55.1 Ų | 55.1 | 71% | 0.71 | 28% | 0.282 | S | S | * | . | S | Bend | trans | -62.1 | -29 | 174.2 | -65.1 | -166.6 | 158.7 | 0 | 0 | 112.9 | ||
| 228 | Q | 91 | Very high | 94.1 | Very high | 88 Ų | 88 | 56.1 Ų | 56.1 | 41% | 0.411 | 28% | 0.284 | S | S | . | . | S | Bend | trans | -91.1 | -24.5 | -180 | -65 | 177.3 | -15.8 | 0 | 0 | 113.4 | N226 L252 T253 | N226-Q228 PolarHBondContact O-N 3.03Å; Q228-L252 CarbonylContact O-C 3.56Å; Q228-L252 WeakPolarHBondContact O-CA 3.33Å; Q228-T253 WeakPolarHBondContact CB-O 3.36Å; Q228-T253 PolarHBondContact O-N 2.93Å |
| 229 | V | 94.2 | Very high | 93.7 | Very high | 47 Ų | 47 | 59.1 Ų | 59.1 | 29% | 0.285 | 31% | 0.305 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.6 | 124 | -168.4 | -177.5 | 0 | 0 | 0 | 0 | 110.7 | A225 N226 V231 L252 | A225-V229 HydrophobicContact CB-CB 4.5Å; A225-V229 HydrophobicContact CB-CG1 4.4Å; A225-V229 PolarHBondContact N-O 2.71Å; A225-V229 VanDerWaalsContact N-O 3.16Å; N226-V229 PolarHBondContact N-O 2.83Å; N226-V229 VanDerWaalsContact N-O 3.15Å; N226-V229 PolarHBondContact O-N 3.2Å; N226-V229 VanDerWaalsContact O-O 3.04Å; V229-V231 HydrophobicContact CG1-CG2 4.36Å; V229-L252 HydrophobicContact CG2-CD1 3.59Å |
| 230 | Q | 95.6 | Very high | 93.2 | Very high | 41 Ų | 41 | 66.1 Ų | 66.1 | 19% | 0.192 | 33% | 0.325 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.5 | 143.6 | 173.3 | -53.8 | 176.1 | 18.6 | 0 | 0 | 108.9 | V40 Y222 R224 Y250 H251 | V40-Q230 HydrophobicContact CG2-CB 4.36Å; Y222-Q230 HydrophobicContact CE2-CB 4.07Å; Y222-Q230 PolarHBondContact OH-OE1 2.81Å; R224-Q230 HydrophobicContact CG-CG 4.26Å; Q230-Y250 CarbonylContact O-C 3.53Å; Q230-Y250 WeakPolarHBondContact O-CA 3.46Å; Q230-H251 HydrophobicContact CB-CB 4.28Å; Q230-H251 PolarHBondContact N-O 2.84Å; Q230-H251 PolarHBondContact O-N 3.1Å |
| 231 | V | 96.5 | Very high | 92.8 | Very high | 33 Ų | 33 | 71.3 Ų | 71.3 | 20% | 0.2 | 35% | 0.351 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.9 | 140.2 | -177.7 | -179.4 | 0 | 0 | 0 | 0 | 108.3 | H223 V229 F248 | H223-V231 PolarHBondContact N-O 2.82Å; H223-V231 PolarHBondContact O-N 2.78Å; V229-V231 HydrophobicContact CG1-CG2 4.36Å; V231-F248 HydrophobicContact CG1-CD2 4.39Å; V231-F248 HydrophobicContact CG1-CE2 3.47Å; V231-F248 VanDerWaalsContact CG1-CE2 3.47Å; V231-F248 HydrophobicContact CG1-CZ 3.68Å |
| 232 | G | 96.4 | Very high | 92.4 | Very high | 0 Ų | 0 | 75.3 Ų | 75.3 | 0% | 0 | 37% | 0.373 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.8 | 137.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 109.5 | Y221 G249 | Y221-G232 CarbonylContact O-C 3.54Å; Y221-G232 WeakPolarHBondContact O-CA 3.36Å; G232-G249 PolarHBondContact N-O 2.84Å; G232-G249 PolarHBondContact O-N 2.81Å; G232-G249 VanDerWaalsContact O-O 3.12Å |
| 233 | V | 96.6 | Very high | 92.1 | Very high | 30 Ų | 30 | 78.8 Ų | 78.8 | 18% | 0.182 | 39% | 0.393 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.7 | 129 | 173.8 | -174.6 | 0 | 0 | 0 | 0 | 107.8 | C37 S220 Y221 F246 S247 F248 | C37-V233 PolarHBondContact SG-N 3.19Å; C37-V233 PolarHBondContact SG-O 2.98Å; C37-V233 VanDerWaalsContact SG-O 3.39Å; S220-V233 CarbonylContact C-O 3.56Å; S220-V233 VanDerWaalsContact CA-O 3.29Å; S220-V233 WeakPolarHBondContact CA-O 3.27Å; Y221-V233 PolarHBondContact N-O 2.82Å; Y221-V233 PolarHBondContact O-N 3.22Å; V233-F246 HydrophobicContact CG1-CD2 4.32Å; V233-F246 HydrophobicContact CG1-CE1 4.26Å; V233-F246 HydrophobicContact CG1-CE2 3.33Å; V233-F246 HydrophobicContact CG1-CZ 3.3Å; V233-S247 WeakPolarHBondContact CA-O 3.03Å; V233-F248 HydrophobicContact CG2-CD2 3.86Å; V233-F248 HydrophobicContact CG2-CE2 4.32Å |
| 234 | E | 95.8 | Very high | 92 | Very high | 31 Ų | 31 | 80.3 Ų | 80.3 | 15% | 0.145 | 41% | 0.407 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.2 | 131.8 | -178.9 | -171.8 | 167.7 | -159.2 | 0 | 0 | 108.9 | F41 H218 S247 | F41-E234 HydrophobicContact CE2-CB 3.92Å; F41-E234 WeakPolarHBondContact CE2-OE2 3.07Å; F41-E234 HydrophobicContact CZ-CB 3.75Å; H218-E234 IonicContact CD2-OE1 3.6Å; H218-E234 IonicContact CE1-OE1 3.75Å; H218-E234 PolarHBondContact CE1-OE1 2.93Å; H218-E234 VanDerWaalsContact CE1-OE1 3.25Å; H218-E234 VanDerWaalsContact NE2-CG 3.34Å; H218-E234 WeakPolarHBondContact NE2-CG 3.3Å; H218-E234 IonicContact NE2-OE1 3.87Å; H218-E234 PolarHBondContact NE2-OE1 2.79Å; E234-S247 PolarHBondContact N-O 2.79Å; E234-S247 PolarHBondContact O-N 3.48Å |
| 235 | F | 95.6 | Very high | 92 | Very high | 81 Ų | 81 | 76.9 Ų | 76.9 | 36% | 0.355 | 40% | 0.398 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.8 | 118.7 | 175.3 | 173.9 | -103.1 | 0 | 0 | 0 | 108.2 | H218 A219 A237 T244 T245 F246 | H218-F235 CarbonylContact C-O 3.56Å; H218-F235 WeakPolarHBondContact CA-O 3.43Å; H218-F235 PolarHBondContact CD2-O 2.78Å; A219-F235 HydrophobicContact CB-CB 4.38Å; A219-F235 HydrophobicContact CB-CD1 4.48Å; A219-F235 PolarHBondContact N-O 2.82Å; A219-F235 PolarHBondContact O-N 2.85Å; F235-A237 HydrophobicContact CE1-CB 3.81Å; F235-A237 HydrophobicContact CZ-CB 3.89Å; F235-T244 HydrophobicContact CZ-CG2 4.47Å; F235-T245 WeakPolarHBondContact CA-O 3.47Å; F235-F246 HydrophobicContact CB-CD2 4.33Å; F235-F246 HydrophobicContact CD2-CB 4.44Å; F235-F246 HydrophobicContact CD2-CD2 4.24Å |
| 236 | E | 94.4 | Very high | 92.3 | Very high | 97 Ų | 97 | 78.8 Ų | 78.8 | 45% | 0.453 | 40% | 0.395 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.4 | 125.9 | 178.4 | -171.3 | -179 | 175 | 0 | 0 | 108.8 | T244 T245 | E236-T244 CarbonylContact O-C 3.55Å; E236-T244 WeakPolarHBondContact O-CA 3.47Å; E236-T245 PolarHBondContact N-O 2.93Å; E236-T245 PolarHBondContact O-N 2.78Å; E236-T245 PolarHBondContact O-OG1 2.82Å |
| 237 | A | 93.7 | Very high | 92.5 | Very high | 19 Ų | 19 | 75 Ų | 75 | 16% | 0.157 | 38% | 0.377 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.7 | 116.5 | 178.5 | 0 | 0 | 0 | 0 | 0 | 108.5 | G216 A217 F235 T244 | G216-A237 CarbonylContact C-O 3.51Å; G216-A237 WeakPolarHBondContact CA-O 3.37Å; A217-A237 HydrophobicContact CB-CB 4.46Å; A217-A237 PolarHBondContact N-O 2.81Å; A217-A237 PolarHBondContact O-N 2.85Å; F235-A237 HydrophobicContact CE1-CB 3.81Å; F235-A237 HydrophobicContact CZ-CB 3.89Å; A237-T244 HydrophobicContact CB-CG2 3.96Å |
| 238 | N | 90.6 | Very high | 93 | Very high | 49 Ų | 49 | 71.7 Ų | 71.7 | 26% | 0.262 | 36% | 0.36 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102 | 114.3 | 179.1 | -171.6 | -39.3 | 0 | 0 | 0 | 109.8 | R240 L241 Q242 D243 | N238-R240 VanDerWaalsContact C-N 3.3Å; N238-R240 PolarHBondContact O-N 2.92Å; N238-R240 WeakPolarHBondContact OD1-CB 3.44Å; N238-R240 PolarHBondContact OD1-N 2.83Å; N238-L241 HydrophobicContact CB-CB 4.33Å; N238-L241 PolarHBondContact OD1-N 2.76Å; N238-L241 VanDerWaalsContact OD1-N 3.13Å; N238-Q242 VanDerWaalsContact O-CA 3.28Å; N238-Q242 WeakPolarHBondContact O-CA 3.36Å; N238-Q242 PolarHBondContact O-N 2.99Å; N238-D243 PolarHBondContact N-O 3.22Å; N238-D243 PolarHBondContact O-N 2.79Å |
| 239 | T | 87.3 | Confident | 93.2 | Very high | 94 Ų | 94 | 67.5 Ų | 67.5 | 58% | 0.577 | 34% | 0.34 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70.2 | -29.3 | -177.2 | -53.8 | 0 | 0 | 0 | 0 | 112.3 | G215 | G215-T239 PolarHBondContact O-N 2.8Å; G215-T239 VanDerWaalsContact O-N 3.13Å |
| 240 | R | 84 | Confident | 93.3 | Very high | 176 Ų | 176 | 69.4 Ų | 69.4 | 66% | 0.664 | 34% | 0.343 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.2 | -44.4 | -178.6 | -63.1 | -177.8 | 178.2 | -168.5 | -2 | 112 | N238 | N238-R240 VanDerWaalsContact C-N 3.3Å; N238-R240 PolarHBondContact O-N 2.92Å; N238-R240 WeakPolarHBondContact OD1-CB 3.44Å; N238-R240 PolarHBondContact OD1-N 2.83Å |
| 241 | L | 87.3 | Confident | 93.3 | Very high | 117 Ų | 117 | 68.4 Ų | 68.4 | 61% | 0.613 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -84.5 | -13.8 | 178.7 | -64.2 | 176.9 | 0 | 0 | 0 | 112.7 | N238 D243 | N238-L241 HydrophobicContact CB-CB 4.33Å; N238-L241 PolarHBondContact OD1-N 2.76Å; N238-L241 VanDerWaalsContact OD1-N 3.13Å; L241-D243 HydrophobicContact CB-CB 4.22Å; L241-D243 PolarHBondContact O-N 2.57Å |
| 242 | Q | 88.8 | Confident | 93.2 | Very high | 172 Ų | 172 | 69.2 Ų | 69.2 | 80% | 0.804 | 34% | 0.341 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.3 | 27.4 | -170.9 | -58.3 | -175.7 | -25.7 | 0 | 0 | 113 | N238 | N238-Q242 VanDerWaalsContact O-CA 3.28Å; N238-Q242 WeakPolarHBondContact O-CA 3.36Å; N238-Q242 PolarHBondContact O-N 2.99Å |
| 243 | D | 90.8 | Very high | 93.1 | Very high | 99 Ų | 99 | 71.1 Ų | 71.1 | 53% | 0.529 | 35% | 0.353 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.8 | 139.8 | 178.7 | -78.1 | -23.3 | 0 | 0 | 0 | 110.1 | N238 L241 | N238-D243 PolarHBondContact N-O 3.22Å; N238-D243 PolarHBondContact O-N 2.79Å; L241-D243 HydrophobicContact CB-CB 4.22Å; L241-D243 PolarHBondContact O-N 2.57Å |
| 244 | T | 93.4 | Very high | 92.9 | Very high | 90 Ų | 90 | 72.4 Ų | 72.4 | 55% | 0.552 | 36% | 0.358 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -127.9 | 130.5 | 173.4 | 57.8 | 0 | 0 | 0 | 0 | 108.9 | F235 E236 A237 | F235-T244 HydrophobicContact CZ-CG2 4.47Å; E236-T244 CarbonylContact O-C 3.55Å; E236-T244 WeakPolarHBondContact O-CA 3.47Å; A237-T244 HydrophobicContact CB-CG2 3.96Å |
| 245 | T | 93.3 | Very high | 92.5 | Very high | 38 Ų | 38 | 74.7 Ų | 74.7 | 23% | 0.233 | 38% | 0.376 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.4 | 136.3 | 178.9 | 55.6 | 0 | 0 | 0 | 0 | 109.2 | F235 E236 | F235-T245 WeakPolarHBondContact CA-O 3.47Å; E236-T245 PolarHBondContact N-O 2.93Å; E236-T245 PolarHBondContact O-N 2.78Å; E236-T245 PolarHBondContact O-OG1 2.82Å |
| 246 | F | 95.4 | Very high | 92.1 | Very high | 103 Ų | 103 | 80 Ų | 80 | 45% | 0.452 | 40% | 0.402 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.2 | 114.8 | 178.1 | 178.8 | -89.1 | 0 | 0 | 0 | 108.7 | V233 F235 F248 D266 S267 | V233-F246 HydrophobicContact CG1-CD2 4.32Å; V233-F246 HydrophobicContact CG1-CE1 4.26Å; V233-F246 HydrophobicContact CG1-CE2 3.33Å; V233-F246 HydrophobicContact CG1-CZ 3.3Å; F235-F246 HydrophobicContact CB-CD2 4.33Å; F235-F246 HydrophobicContact CD2-CB 4.44Å; F235-F246 HydrophobicContact CD2-CD2 4.24Å; F246-F248 HydrophobicContact CE1-CB 4.47Å; F246-D266 VanDerWaalsContact C-OD1 3.28Å; F246-D266 CarbonylContact O-C 3.58Å; F246-D266 WeakPolarHBondContact O-CA 3.18Å; F246-S267 PolarHBondContact N-OG 2.83Å; F246-S267 PolarHBondContact O-N 2.79Å |
| 247 | S | 95.5 | Very high | 91.8 | Very high | 19 Ų | 19 | 77 Ų | 77 | 13% | 0.133 | 39% | 0.393 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117 | 128.7 | -175.8 | -77.6 | 0 | 0 | 0 | 0 | 110.7 | V233 E234 D266 | V233-S247 WeakPolarHBondContact CA-O 3.03Å; E234-S247 PolarHBondContact N-O 2.79Å; E234-S247 PolarHBondContact O-N 3.48Å; S247-D266 VanDerWaalsContact OG-CG 3.26Å; S247-D266 PolarHBondContact OG-OD1 2.76Å |
| 248 | F | 96.8 | Very high | 91.6 | Very high | 82 Ų | 82 | 79.7 Ų | 79.7 | 36% | 0.36 | 41% | 0.405 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112 | 126.1 | 174.3 | 176.2 | -89 | 0 | 0 | 0 | 109.5 | V231 V233 F246 Y250 L264 V265 | V231-F248 HydrophobicContact CG1-CD2 4.39Å; V231-F248 HydrophobicContact CG1-CE2 3.47Å; V231-F248 VanDerWaalsContact CG1-CE2 3.47Å; V231-F248 HydrophobicContact CG1-CZ 3.68Å; V233-F248 HydrophobicContact CG2-CD2 3.86Å; V233-F248 HydrophobicContact CG2-CE2 4.32Å; F246-F248 HydrophobicContact CE1-CB 4.47Å; F248-Y250 HydrophobicContact CE1-CD1 4.24Å; F248-L264 CarbonylContact O-C 3.54Å; F248-L264 WeakPolarHBondContact O-CA 3.39Å; F248-V265 PolarHBondContact N-O 3.4Å; F248-V265 PolarHBondContact O-N 2.83Å |
| 249 | G | 95.8 | Very high | 91.7 | Very high | 0 Ų | 0 | 79.8 Ų | 79.8 | 0% | 0 | 41% | 0.405 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.9 | 150.1 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | F41 G232 G263 | F41-G249 VanDerWaalsContact CE1-N 3.32Å; G232-G249 PolarHBondContact N-O 2.84Å; G232-G249 PolarHBondContact O-N 2.81Å; G232-G249 VanDerWaalsContact O-O 3.12Å; G249-G263 CarbonylContact C-O 3.59Å; G249-G263 WeakPolarHBondContact CA-O 3.45Å |
| 250 | Y | 95.6 | Very high | 92.1 | Very high | 86 Ų | 86 | 76.7 Ų | 76.7 | 34% | 0.337 | 39% | 0.386 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.5 | 146.9 | 169.9 | 69.9 | -86 | 0 | 0 | 0 | 111.2 | Q230 F248 F261 R262 G263 | Q230-Y250 CarbonylContact O-C 3.53Å; Q230-Y250 WeakPolarHBondContact O-CA 3.46Å; F248-Y250 HydrophobicContact CE1-CD1 4.24Å; Y250-F261 HydrophobicContact CD2-CD1 4.48Å; Y250-F261 HydrophobicContact CE1-CE1 4.47Å; Y250-F261 AromaticContact CE2-CD1 3.57Å; Y250-F261 HydrophobicContact CE2-CD1 3.57Å; Y250-F261 AromaticContact CE2-CE1 3.58Å; Y250-F261 HydrophobicContact CE2-CE1 3.58Å; Y250-F261 AromaticContact CZ-CD1 3.98Å; Y250-F261 AromaticContact CZ-CE1 3.47Å; Y250-F261 VanDerWaalsContact CZ-CE1 3.47Å; Y250-F261 WeakPolarHBondContact OH-CE1 3.19Å; Y250-R262 CarbonylContact O-C 3.57Å; Y250-R262 VanDerWaalsContact O-CA 3.31Å; Y250-R262 WeakPolarHBondContact O-CA 3.02Å; Y250-G263 PolarHBondContact N-O 2.88Å; Y250-G263 PolarHBondContact O-N 2.79Å |
| 251 | H | 95.6 | Very high | 92.7 | Very high | 21 Ų | 21 | 70.7 Ų | 70.7 | 10% | 0.097 | 37% | 0.365 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.9 | 114.5 | -179.5 | 173.9 | -137.6 | 0 | 0 | 0 | 108.6 | V40 Q230 V260 R262 | V40-H251 HydrophobicContact CB-CB 4.4Å; V40-H251 HydrophobicContact CG1-CB 3.83Å; Q230-H251 HydrophobicContact CB-CB 4.28Å; Q230-H251 PolarHBondContact N-O 2.84Å; Q230-H251 PolarHBondContact O-N 3.1Å; H251-V260 WeakPolarHBondContact NE2-CG1 3.37Å; H251-R262 HydrophobicContact CB-CG 4.32Å; H251-R262 VanDerWaalsContact CD2-CG 3.5Å; H251-R262 WeakPolarHBondContact CD2-CG 3.39Å; H251-R262 PolarHBondContact CD2-NE 3.04Å |
| 252 | L | 94.9 | Very high | 93.1 | Very high | 50 Ų | 50 | 68.1 Ų | 68.1 | 26% | 0.262 | 35% | 0.346 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.9 | 114.1 | -178.5 | -180 | 69.8 | 0 | 0 | 0 | 109.1 | Q228 V229 L254 V260 F261 | Q228-L252 CarbonylContact O-C 3.56Å; Q228-L252 WeakPolarHBondContact O-CA 3.33Å; V229-L252 HydrophobicContact CG2-CD1 3.59Å; L252-L254 HydrophobicContact CD2-CD1 3.64Å; L252-L254 HydrophobicContact CG-CD1 3.63Å; L252-L254 HydrophobicContact CG-CG 4.39Å; L252-V260 WeakPolarHBondContact O-CA 3.27Å; L252-F261 HydrophobicContact CB-CB 4.39Å; L252-F261 PolarHBondContact N-O 2.96Å; L252-F261 PolarHBondContact O-N 3.47Å |
| 253 | T | 93.9 | Very high | 93.4 | Very high | 39 Ų | 39 | 60 Ų | 60 | 24% | 0.239 | 31% | 0.309 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.2 | 122.7 | 173.3 | -59.8 | 0 | 0 | 0 | 0 | 109.1 | Q228 P255 V260 | Q228-T253 WeakPolarHBondContact CB-O 3.36Å; Q228-T253 PolarHBondContact O-N 2.93Å; T253-P255 HydrophobicContact CG2-CG 4.41Å; T253-P255 WeakPolarHBondContact O-CD 3.37Å; T253-V260 HydrophobicContact CG2-CG2 4.25Å |
| 254 | L | 91.9 | Very high | 93.7 | Very high | 57 Ų | 57 | 56.4 Ų | 56.4 | 30% | 0.298 | 29% | 0.29 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.1 | 93.4 | 173.4 | -66.7 | 100.3 | 0 | 0 | 0 | 110.2 | L252 Q256 A257 N258 M259 | L252-L254 HydrophobicContact CD2-CD1 3.64Å; L252-L254 HydrophobicContact CG-CD1 3.63Å; L252-L254 HydrophobicContact CG-CG 4.39Å; L254-Q256 VanDerWaalsContact C-N 3.33Å; L254-Q256 PolarHBondContact O-N 3.13Å; L254-A257 HydrophobicContact CB-CB 4.26Å; L254-A257 CarbonylContact O-C 3.54Å; L254-A257 PolarHBondContact O-N 2.95Å; L254-N258 PolarHBondContact O-N 2.79Å; L254-N258 VanDerWaalsContact O-N 3.1Å; L254-M259 HydrophobicContact CD1-CE 3.77Å; L254-M259 PolarHBondContact N-O 3.21Å; L254-M259 PolarHBondContact O-N 3.26Å; L254-M259 VanDerWaalsContact O-N 3.15Å |
| 255 | P | 88.2 | Confident | 93.8 | Very high | 79 Ų | 79 | 55.6 Ų | 55.6 | 51% | 0.513 | 28% | 0.284 | S | S | . | . | G | 310 helix | trans | -60.9 | -39.8 | -178.7 | -23.7 | 33.7 | 0 | 0 | 0 | 113.1 | T253 A257 N258 | T253-P255 HydrophobicContact CG2-CG 4.41Å; T253-P255 WeakPolarHBondContact O-CD 3.37Å; P255-A257 PolarHBondContact O-N 3.38Å; P255-N258 PolarHBondContact O-N 3.13Å; P255-N258 PolarHBondContact O-OD1 2.85Å |
| 256 | Q | 87.1 | Confident | 93.8 | Very high | 193 Ų | 193 | 54.9 Ų | 54.9 | 90% | 0.902 | 28% | 0.279 | S | S | * | . | G | 310 helix | trans | -60.4 | -31.5 | -179.6 | -66.8 | 179 | -16.7 | 0 | 0 | 112.8 | L254 | L254-Q256 VanDerWaalsContact C-N 3.33Å; L254-Q256 PolarHBondContact O-N 3.13Å |
| 257 | A | 87.4 | Confident | 93.7 | Very high | 33 Ų | 33 | 52.8 Ų | 52.8 | 27% | 0.273 | 28% | 0.277 | S | S | . | . | G | 310 helix | trans | -100.6 | 4.5 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | L254 P255 M259 K277 | L254-A257 HydrophobicContact CB-CB 4.26Å; L254-A257 CarbonylContact O-C 3.54Å; L254-A257 PolarHBondContact O-N 2.95Å; P255-A257 PolarHBondContact O-N 3.38Å; A257-M259 HydrophobicContact CB-CB 4.01Å; A257-M259 PolarHBondContact O-N 3.24Å; A257-M259 VanDerWaalsContact O-N 3.15Å; A257-K277 WeakPolarHBondContact O-CD 3.37Å; A257-K277 WeakPolarHBondContact O-CE 3.48Å; A257-K277 PolarHBondContact O-NZ 2.9Å |
| 258 | N | 90.9 | Very high | 93.5 | Very high | 77 Ų | 77 | 55.6 Ų | 55.6 | 41% | 0.412 | 29% | 0.291 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 47.8 | 41.3 | -174.2 | -66.2 | -49.1 | 0 | 0 | 0 | 112.9 | L254 P255 K278 | L254-N258 PolarHBondContact O-N 2.79Å; L254-N258 VanDerWaalsContact O-N 3.1Å; P255-N258 PolarHBondContact O-N 3.13Å; P255-N258 PolarHBondContact O-OD1 2.85Å; N258-K278 HydrophobicContact CB-CB 4.26Å; N258-K278 PolarHBondContact O-N 3.42Å |
| 259 | M | 93 | Very high | 93.2 | Very high | 51 Ų | 51 | 60 Ų | 60 | 25% | 0.251 | 31% | 0.305 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.1 | 139.9 | -167.4 | -170 | 173.8 | 86 | 0 | 0 | 110.3 | L254 A257 L275 E276 K277 | L254-M259 HydrophobicContact CD1-CE 3.77Å; L254-M259 PolarHBondContact N-O 3.21Å; L254-M259 PolarHBondContact O-N 3.26Å; L254-M259 VanDerWaalsContact O-N 3.15Å; A257-M259 HydrophobicContact CB-CB 4.01Å; A257-M259 PolarHBondContact O-N 3.24Å; A257-M259 VanDerWaalsContact O-N 3.15Å; M259-L275 HydrophobicContact CE-CD1 4.1Å; M259-L275 HydrophobicContact CG-CD1 3.44Å; M259-L275 VanDerWaalsContact CG-CD1 3.44Å; M259-L275 HydrophobicContact CG-CG 4.49Å; M259-L275 HydrophobicContact SD-CD1 3.54Å; M259-L275 VanDerWaalsContact SD-CD1 3.54Å; M259-E276 CarbonylContact C-O 3.55Å; M259-E276 VanDerWaalsContact CA-O 3.31Å; M259-E276 WeakPolarHBondContact CA-O 3.32Å; M259-K277 HydrophobicContact CB-CD 4.2Å; M259-K277 HydrophobicContact CG-CD 4.44Å |
| 260 | V | 94.7 | Very high | 93.1 | Very high | 29 Ų | 29 | 61.8 Ų | 61.8 | 18% | 0.176 | 32% | 0.317 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.5 | 128.1 | 175.8 | 176.3 | 0 | 0 | 0 | 0 | 107.6 | H251 L252 T253 E276 | H251-V260 WeakPolarHBondContact NE2-CG1 3.37Å; L252-V260 WeakPolarHBondContact O-CA 3.27Å; T253-V260 HydrophobicContact CG2-CG2 4.25Å; V260-E276 HydrophobicContact CB-CB 4.29Å; V260-E276 PolarHBondContact N-O 2.87Å; V260-E276 PolarHBondContact O-N 2.88Å |
| 261 | F | 95.7 | Very high | 93.1 | Very high | 50 Ų | 50 | 60.7 Ų | 60.7 | 22% | 0.219 | 32% | 0.319 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.9 | 132.5 | 177.3 | -177.2 | -82.1 | 0 | 0 | 0 | 109.3 | Y250 L252 A273 V274 L275 | Y250-F261 HydrophobicContact CD2-CD1 4.48Å; Y250-F261 HydrophobicContact CE1-CE1 4.47Å; Y250-F261 AromaticContact CE2-CD1 3.57Å; Y250-F261 HydrophobicContact CE2-CD1 3.57Å; Y250-F261 AromaticContact CE2-CE1 3.58Å; Y250-F261 HydrophobicContact CE2-CE1 3.58Å; Y250-F261 AromaticContact CZ-CD1 3.98Å; Y250-F261 AromaticContact CZ-CE1 3.47Å; Y250-F261 VanDerWaalsContact CZ-CE1 3.47Å; Y250-F261 WeakPolarHBondContact OH-CE1 3.19Å; L252-F261 HydrophobicContact CB-CB 4.39Å; L252-F261 PolarHBondContact N-O 2.96Å; L252-F261 PolarHBondContact O-N 3.47Å; F261-A273 HydrophobicContact CE1-CB 4.4Å; F261-A273 HydrophobicContact CE2-CB 3.99Å; F261-A273 HydrophobicContact CZ-CB 3.55Å; F261-V274 CarbonylContact C-O 3.6Å; F261-V274 WeakPolarHBondContact CA-O 3.33Å; F261-L275 HydrophobicContact CB-CD1 4.3Å; F261-L275 HydrophobicContact CD2-CB 4.22Å; F261-L275 HydrophobicContact CD2-CD1 3.98Å |
| 262 | R | 96.3 | Very high | 93 | Very high | 62 Ų | 62 | 59.9 Ų | 59.9 | 23% | 0.234 | 32% | 0.316 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.6 | 130.9 | 174.9 | -66.4 | -178.9 | -170.8 | -177.1 | 5.7 | 109.4 | D39 P42 Y250 H251 A273 V274 | D39-R262 PolarHBondContact O-NH1 3.39Å; P42-R262 HydrophobicContact CB-CB 3.8Å; P42-R262 HydrophobicContact CG-CB 4.43Å; Y250-R262 CarbonylContact O-C 3.57Å; Y250-R262 VanDerWaalsContact O-CA 3.31Å; Y250-R262 WeakPolarHBondContact O-CA 3.02Å; H251-R262 HydrophobicContact CB-CG 4.32Å; H251-R262 VanDerWaalsContact CD2-CG 3.5Å; H251-R262 WeakPolarHBondContact CD2-CG 3.39Å; H251-R262 PolarHBondContact CD2-NE 3.04Å; R262-A273 CarbonylContact O-C 3.59Å; R262-A273 VanDerWaalsContact O-CA 3.25Å; R262-A273 WeakPolarHBondContact O-CA 3.48Å; R262-V274 PolarHBondContact N-O 2.81Å; R262-V274 PolarHBondContact O-N 2.81Å |
| 263 | G | 95.9 | Very high | 93.1 | Very high | 2 Ų | 2 | 58.9 Ų | 58.9 | 2% | 0.021 | 32% | 0.315 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.4 | 150.8 | 176.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | G249 Y250 G272 | G249-G263 CarbonylContact C-O 3.59Å; G249-G263 WeakPolarHBondContact CA-O 3.45Å; Y250-G263 PolarHBondContact N-O 2.88Å; Y250-G263 PolarHBondContact O-N 2.79Å; G263-G272 CarbonylContact C-O 3.57Å; G263-G272 WeakPolarHBondContact CA-O 3.38Å |
| 264 | L | 95.8 | Very high | 93.2 | Very high | 24 Ų | 24 | 57.1 Ų | 57.1 | 13% | 0.126 | 31% | 0.305 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -137.4 | 138.9 | 175.7 | 165.4 | 69.1 | 0 | 0 | 0 | 109.6 | F41 P42 F248 V271 G272 | F41-L264 HydrophobicContact CD1-CB 4.42Å; F41-L264 HydrophobicContact CD1-CD1 3.48Å; F41-L264 VanDerWaalsContact CD1-CD1 3.48Å; F41-L264 HydrophobicContact CD1-CG 4.42Å; F41-L264 HydrophobicContact CE1-CD1 3.6Å; P42-L264 HydrophobicContact CG-CB 3.59Å; F248-L264 CarbonylContact O-C 3.54Å; F248-L264 WeakPolarHBondContact O-CA 3.39Å; L264-V271 WeakPolarHBondContact O-CA 3.44Å; L264-G272 PolarHBondContact N-O 2.99Å; L264-G272 PolarHBondContact O-N 2.79Å |
| 265 | V | 95.7 | Very high | 93.3 | Very high | 72 Ų | 72 | 57 Ų | 57 | 44% | 0.436 | 30% | 0.304 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.8 | 126.7 | 166.2 | -178.3 | 0 | 0 | 0 | 0 | 107.7 | F248 C270 V271 | F248-V265 PolarHBondContact N-O 3.4Å; F248-V265 PolarHBondContact O-N 2.83Å; V265-C270 WeakPolarHBondContact CA-O 3.46Å; V265-V271 HydrophobicContact CG1-CG2 4.46Å; V265-V271 HydrophobicContact CG2-CG1 4.38Å; V265-V271 HydrophobicContact CG2-CG2 4.41Å |
| 266 | D | 93.6 | Very high | 93.7 | Very high | 24 Ų | 24 | 56.2 Ų | 56.2 | 13% | 0.128 | 29% | 0.293 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.3 | 155.6 | -179.6 | -178 | 35.9 | 0 | 0 | 0 | 111.3 | F246 S247 N268 W269 C270 | F246-D266 VanDerWaalsContact C-OD1 3.28Å; F246-D266 CarbonylContact O-C 3.58Å; F246-D266 WeakPolarHBondContact O-CA 3.18Å; S247-D266 VanDerWaalsContact OG-CG 3.26Å; S247-D266 PolarHBondContact OG-OD1 2.76Å; D266-N268 PolarHBondContact O-N 2.82Å; D266-N268 VanDerWaalsContact O-N 3.11Å; D266-N268 PolarHBondContact OD2-ND2 2.98Å; D266-W269 PolarHBondContact O-N 2.95Å; D266-C270 HydrophobicContact CB-CB 4.28Å; D266-C270 PolarHBondContact N-O 2.95Å |
| 267 | S | 93.3 | Very high | 94 | Very high | 58 Ų | 58 | 50.6 Ų | 50.6 | 41% | 0.406 | 27% | 0.266 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.9 | -18 | 179.9 | 58.3 | 0 | 0 | 0 | 0 | 113.7 | F246 W269 | F246-S267 PolarHBondContact N-OG 2.83Å; F246-S267 PolarHBondContact O-N 2.79Å; S267-W269 PolarHBondContact O-N 3.2Å |
| 268 | N | 90.9 | Very high | 94.3 | Very high | 78 Ų | 78 | 55 Ų | 55 | 42% | 0.417 | 28% | 0.279 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -78.2 | 13.8 | 173.2 | -65.4 | -52.7 | 0 | 0 | 0 | 114.1 | D266 C270 | D266-N268 PolarHBondContact O-N 2.82Å; D266-N268 VanDerWaalsContact O-N 3.11Å; D266-N268 PolarHBondContact OD2-ND2 2.98Å; N268-C270 PolarHBondContact O-N 3.29Å |
| 269 | W | 91.8 | Very high | 94.2 | Very high | 176 Ų | 176 | 55 Ų | 55 | 67% | 0.667 | 28% | 0.278 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 59.1 | 30 | -175.1 | -58.4 | 85.7 | 0 | 0 | 0 | 113.3 | D266 S267 H294 W295 | D266-W269 PolarHBondContact O-N 2.95Å; S267-W269 PolarHBondContact O-N 3.2Å; W269-H294 HydrophobicContact CB-CB 4.16Å; W269-H294 PolarHBondContact O-N 2.84Å; W269-W295 HydrophobicContact CB-CB 4.5Å |
| 270 | C | 92.5 | Very high | 93.9 | Very high | 36 Ų | 36 | 56.8 Ų | 56.8 | 24% | 0.243 | 29% | 0.293 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.6 | 127.2 | 170.5 | -66.8 | 0 | 0 | 0 | 0 | 108.9 | V265 D266 N268 L292 N293 | V265-C270 WeakPolarHBondContact CA-O 3.46Å; D266-C270 HydrophobicContact CB-CB 4.28Å; D266-C270 PolarHBondContact N-O 2.95Å; N268-C270 PolarHBondContact O-N 3.29Å; C270-L292 CarbonylContact C-O 3.41Å; C270-L292 WeakPolarHBondContact CA-O 3.28Å; C270-N293 PolarHBondContact SG-ND2 3.11Å |
| 271 | V | 95.2 | Very high | 93.4 | Very high | 63 Ų | 63 | 61.8 Ų | 61.8 | 38% | 0.382 | 33% | 0.326 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.6 | 131.4 | 171.6 | -178 | 0 | 0 | 0 | 0 | 108 | L264 V265 F291 L292 | L264-V271 WeakPolarHBondContact O-CA 3.44Å; V265-V271 HydrophobicContact CG1-CG2 4.46Å; V265-V271 HydrophobicContact CG2-CG1 4.38Å; V265-V271 HydrophobicContact CG2-CG2 4.41Å; V271-F291 CarbonylContact O-C 3.59Å; V271-F291 WeakPolarHBondContact O-CA 3.46Å; V271-L292 PolarHBondContact N-O 3.32Å; V271-L292 PolarHBondContact O-N 2.79Å |
| 272 | G | 95 | Very high | 93 | Very high | 4 Ų | 4 | 65 Ų | 65 | 4% | 0.041 | 35% | 0.345 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.6 | 145.6 | -178 | 0 | 0 | 0 | 0 | 0 | 111.6 | G263 L264 A290 F291 | G263-G272 CarbonylContact C-O 3.57Å; G263-G272 WeakPolarHBondContact CA-O 3.38Å; L264-G272 PolarHBondContact N-O 2.99Å; L264-G272 PolarHBondContact O-N 2.79Å; G272-A290 CarbonylContact C-O 3.5Å; G272-A290 WeakPolarHBondContact CA-O 3.32Å; G272-F291 VanDerWaalsContact CA-CD1 3.45Å |
| 273 | A | 95.7 | Very high | 92.6 | Very high | 29 Ų | 29 | 65.9 Ų | 65.9 | 24% | 0.24 | 36% | 0.359 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -143.9 | 143.2 | 172 | 0 | 0 | 0 | 0 | 0 | 110.8 | F261 R262 G289 A290 | F261-A273 HydrophobicContact CE1-CB 4.4Å; F261-A273 HydrophobicContact CE2-CB 3.99Å; F261-A273 HydrophobicContact CZ-CB 3.55Å; R262-A273 CarbonylContact O-C 3.59Å; R262-A273 VanDerWaalsContact O-CA 3.25Å; R262-A273 WeakPolarHBondContact O-CA 3.48Å; A273-G289 CarbonylContact O-C 3.55Å; A273-G289 VanDerWaalsContact O-CA 3.26Å; A273-G289 WeakPolarHBondContact O-CA 3Å; A273-A290 PolarHBondContact N-O 2.69Å; A273-A290 PolarHBondContact O-N 3.43Å |
| 274 | V | 96.2 | Very high | 92.5 | Very high | 3 Ų | 3 | 67.1 Ų | 67.1 | 2% | 0.018 | 37% | 0.366 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.5 | 128.8 | 171.4 | 172.9 | 0 | 0 | 0 | 0 | 109 | P42 A43 M45 F261 R262 E276 L288 F291 | P42-V274 HydrophobicContact CB-CB 3.83Å; P42-V274 HydrophobicContact CB-CG2 3.58Å; A43-V274 WeakPolarHBondContact O-CG2 3.37Å; M45-V274 HydrophobicContact CE-CB 4.29Å; M45-V274 HydrophobicContact CE-CG1 3.47Å; M45-V274 VanDerWaalsContact CE-CG1 3.47Å; M45-V274 HydrophobicContact CE-CG2 3.73Å; M45-V274 HydrophobicContact CG-CG2 4.3Å; M45-V274 HydrophobicContact SD-CG1 4.28Å; M45-V274 HydrophobicContact SD-CG2 4.15Å; F261-V274 CarbonylContact C-O 3.6Å; F261-V274 WeakPolarHBondContact CA-O 3.33Å; R262-V274 PolarHBondContact N-O 2.81Å; R262-V274 PolarHBondContact O-N 2.81Å; V274-E276 HydrophobicContact CG1-CG 4.13Å; V274-L288 CarbonylContact C-O 3.51Å; V274-L288 VanDerWaalsContact CA-O 3.3Å; V274-L288 WeakPolarHBondContact CA-O 3.24Å; V274-F291 HydrophobicContact CG2-CE2 4.09Å; V274-F291 HydrophobicContact CG2-CZ 4.01Å |
| 275 | L | 95.6 | Very high | 92.4 | Very high | 53 Ų | 53 | 67.6 Ų | 67.6 | 28% | 0.277 | 37% | 0.37 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115 | 114.8 | 177 | 176.1 | 68.8 | 0 | 0 | 0 | 109.2 | M259 F261 A287 L288 | M259-L275 HydrophobicContact CE-CD1 4.1Å; M259-L275 HydrophobicContact CG-CD1 3.44Å; M259-L275 VanDerWaalsContact CG-CD1 3.44Å; M259-L275 HydrophobicContact CG-CG 4.49Å; M259-L275 HydrophobicContact SD-CD1 3.54Å; M259-L275 VanDerWaalsContact SD-CD1 3.54Å; F261-L275 HydrophobicContact CB-CD1 4.3Å; F261-L275 HydrophobicContact CD2-CB 4.22Å; F261-L275 HydrophobicContact CD2-CD1 3.98Å; L275-A287 CarbonylContact O-C 3.53Å; L275-A287 VanDerWaalsContact O-CA 3.29Å; L275-A287 WeakPolarHBondContact O-CA 3.34Å; L275-L288 PolarHBondContact N-O 3.01Å; L275-L288 PolarHBondContact O-N 3.17Å |
| 276 | E | 95 | Very high | 92.3 | Very high | 63 Ų | 63 | 66.6 Ų | 66.6 | 29% | 0.294 | 36% | 0.362 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.1 | 131.5 | 173.5 | -61.6 | -179.5 | 175 | 0 | 0 | 110.2 | M259 V260 V274 L286 A287 | M259-E276 CarbonylContact C-O 3.55Å; M259-E276 VanDerWaalsContact CA-O 3.31Å; M259-E276 WeakPolarHBondContact CA-O 3.32Å; V260-E276 HydrophobicContact CB-CB 4.29Å; V260-E276 PolarHBondContact N-O 2.87Å; V260-E276 PolarHBondContact O-N 2.88Å; V274-E276 HydrophobicContact CG1-CG 4.13Å; E276-L286 CarbonylContact C-O 3.58Å; E276-L286 WeakPolarHBondContact CA-O 3.18Å; E276-A287 HydrophobicContact CG-CB 3.86Å |
| 277 | K | 94.3 | Very high | 92.3 | Very high | 76 Ų | 76 | 65.8 Ų | 65.8 | 33% | 0.33 | 36% | 0.359 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.7 | 119.8 | -179.7 | 177.1 | 68.5 | 175.8 | -163.4 | 0 | 109.2 | A257 M259 M279 T285 L286 | A257-K277 WeakPolarHBondContact O-CD 3.37Å; A257-K277 WeakPolarHBondContact O-CE 3.48Å; A257-K277 PolarHBondContact O-NZ 2.9Å; M259-K277 HydrophobicContact CB-CD 4.2Å; M259-K277 HydrophobicContact CG-CD 4.44Å; K277-M279 HydrophobicContact CG-CG 4.29Å; K277-T285 WeakPolarHBondContact O-CA 3.33Å; K277-L286 PolarHBondContact N-O 2.8Å; K277-L286 PolarHBondContact O-N 2.78Å |
| 278 | K | 92.5 | Very high | 92.4 | Very high | 125 Ų | 125 | 67 Ų | 67 | 54% | 0.543 | 36% | 0.36 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.4 | 137.4 | 169.8 | -59 | -177.5 | 177.9 | -178.5 | 0 | 108.7 | N258 P280 T285 | N258-K278 HydrophobicContact CB-CB 4.26Å; N258-K278 PolarHBondContact O-N 3.42Å; K278-P280 VanDerWaalsContact O-CD 3.27Å; K278-P280 WeakPolarHBondContact O-CD 3.37Å; K278-T285 HydrophobicContact CG-CG2 4.03Å |
| 279 | M | 90.4 | Very high | 92.6 | Very high | 78 Ų | 78 | 63.5 Ų | 63.5 | 38% | 0.384 | 34% | 0.343 | S | S | . | . | trans | -117.2 | 78.5 | -175.3 | -64.8 | -172.8 | -72.2 | 0 | 0 | 112.4 | K277 L282 V284 L286 | K277-M279 HydrophobicContact CG-CG 4.29Å; M279-L282 CarbonylContact C-O 3.55Å; M279-L282 CarbonylContact O-C 3.54Å; M279-L282 PolarHBondContact O-N 2.98Å; M279-L282 VanDerWaalsContact O-N 3.08Å; M279-V284 HydrophobicContact CE-CB 4.18Å; M279-V284 HydrophobicContact CE-CG1 3.7Å; M279-V284 PolarHBondContact N-O 2.84Å; M279-L286 HydrophobicContact CE-CB 4.19Å | ||
| 280 | P | 86.2 | Confident | 92.7 | Very high | 87 Ų | 87 | 57 Ų | 57 | 57% | 0.565 | 33% | 0.327 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.9 | 144.2 | 171.2 | -18.5 | 30.8 | 0 | 0 | 0 | 111.3 | K278 | K278-P280 VanDerWaalsContact O-CD 3.27Å; K278-P280 WeakPolarHBondContact O-CD 3.37Å |
| 281 | P | 84.1 | Confident | 92.7 | Very high | 134 Ų | 134 | 56.2 Ų | 56.2 | 87% | 0.87 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | cis | -86.5 | -2.9 | 6.4 | 35 | -36.5 | 0 | 0 | 0 | 114.9 | ||
| 282 | L | 87.5 | Confident | 92.6 | Very high | 117 Ų | 117 | 56.2 Ų | 56.2 | 61% | 0.613 | 32% | 0.317 | S | S | * | . | S | Bend | trans | -76.9 | 140.5 | -179.5 | -64.3 | 166.7 | 0 | 0 | 0 | 109.7 | M279 V284 | M279-L282 CarbonylContact C-O 3.55Å; M279-L282 CarbonylContact O-C 3.54Å; M279-L282 PolarHBondContact O-N 2.98Å; M279-L282 VanDerWaalsContact O-N 3.08Å; L282-V284 HydrophobicContact CB-CB 4.44Å; L282-V284 HydrophobicContact CB-CG2 4.06Å; L282-V284 PolarHBondContact O-N 3.23Å |
| 283 | P | 88.1 | Confident | 92.5 | Very high | 82 Ų | 82 | 57.2 Ų | 57.2 | 53% | 0.532 | 32% | 0.321 | S | S | . | . | S | Bend | trans | -77.7 | 47.8 | 175.7 | 35.1 | -37.3 | 0 | 0 | 0 | 111.2 | G308 | P283-G308 WeakPolarHBondContact CB-O 3.08Å; P283-G308 WeakPolarHBondContact CG-O 3.37Å; P283-G308 PolarHBondContact O-N 2.85Å |
| 284 | V | 92.6 | Very high | 92.2 | Very high | 27 Ų | 27 | 60.4 Ų | 60.4 | 16% | 0.164 | 33% | 0.331 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.1 | 129.8 | -177.2 | -177.5 | 0 | 0 | 0 | 0 | 109.6 | M279 L282 I305 T306 V307 | M279-V284 HydrophobicContact CE-CB 4.18Å; M279-V284 HydrophobicContact CE-CG1 3.7Å; M279-V284 PolarHBondContact N-O 2.84Å; L282-V284 HydrophobicContact CB-CB 4.44Å; L282-V284 HydrophobicContact CB-CG2 4.06Å; L282-V284 PolarHBondContact O-N 3.23Å; V284-I305 HydrophobicContact CG1-CG2 3.84Å; V284-T306 WeakPolarHBondContact CA-O 3.31Å; V284-V307 HydrophobicContact CG2-CG1 4.45Å; V284-V307 HydrophobicContact CG2-CG2 4.31Å |
| 285 | T | 93.4 | Very high | 91.8 | Very high | 35 Ų | 35 | 69.8 Ų | 69.8 | 22% | 0.215 | 37% | 0.366 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.4 | 122.6 | 171.4 | -53.4 | 0 | 0 | 0 | 0 | 108.9 | K277 K278 T306 | K277-T285 WeakPolarHBondContact O-CA 3.33Å; K278-T285 HydrophobicContact CG-CG2 4.03Å; T285-T306 PolarHBondContact N-O 2.94Å; T285-T306 PolarHBondContact O-N 3.1Å |
| 286 | L | 93.8 | Very high | 91.6 | Very high | 50 Ų | 50 | 74.8 Ų | 74.8 | 26% | 0.262 | 38% | 0.381 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98 | 128.4 | 173.1 | 179.8 | 71.4 | 0 | 0 | 0 | 108.8 | E276 K277 M279 L288 I305 | E276-L286 CarbonylContact C-O 3.58Å; E276-L286 WeakPolarHBondContact CA-O 3.18Å; K277-L286 PolarHBondContact N-O 2.8Å; K277-L286 PolarHBondContact O-N 2.78Å; M279-L286 HydrophobicContact CE-CB 4.19Å; L286-L288 HydrophobicContact CD2-CD1 4.34Å; L286-L288 HydrophobicContact CD2-CG 4.38Å; L286-L288 HydrophobicContact CG-CG 4.38Å; L286-I305 HydrophobicContact CD1-CG1 3.86Å |
| 287 | A | 94.8 | Very high | 91.3 | Very high | 8 Ų | 8 | 78.5 Ų | 78.5 | 7% | 0.066 | 40% | 0.403 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.9 | 134.2 | 170.6 | 0 | 0 | 0 | 0 | 0 | 109.8 | M45 L275 E276 F303 S304 | M45-A287 HydrophobicContact CE-CB 4.14Å; L275-A287 CarbonylContact O-C 3.53Å; L275-A287 VanDerWaalsContact O-CA 3.29Å; L275-A287 WeakPolarHBondContact O-CA 3.34Å; E276-A287 HydrophobicContact CG-CB 3.86Å; A287-F303 CarbonylContact O-C 3.59Å; A287-F303 VanDerWaalsContact O-CA 3.24Å; A287-F303 WeakPolarHBondContact O-CA 3.22Å; A287-S304 PolarHBondContact N-O 2.94Å; A287-S304 PolarHBondContact O-N 2.8Å |
| 288 | L | 94.7 | Very high | 91 | Very high | 82 Ų | 82 | 81.2 Ų | 81.2 | 43% | 0.429 | 41% | 0.411 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.7 | 127.2 | 176.2 | -65.3 | 169 | 0 | 0 | 0 | 108.1 | V274 L275 L286 F303 | V274-L288 CarbonylContact C-O 3.51Å; V274-L288 VanDerWaalsContact CA-O 3.3Å; V274-L288 WeakPolarHBondContact CA-O 3.24Å; L275-L288 PolarHBondContact N-O 3.01Å; L275-L288 PolarHBondContact O-N 3.17Å; L286-L288 HydrophobicContact CD2-CD1 4.34Å; L286-L288 HydrophobicContact CD2-CG 4.38Å; L286-L288 HydrophobicContact CG-CG 4.38Å; L288-F303 HydrophobicContact CD2-CB 3.7Å |
| 289 | G | 94.8 | Very high | 90.8 | Very high | 6 Ų | 6 | 81 Ų | 81 | 6% | 0.062 | 41% | 0.41 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.8 | 142.7 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | M45 A273 C301 G302 | M45-G289 WeakPolarHBondContact SD-CA 3.49Å; M45-G289 PolarHBondContact SD-N 2.92Å; A273-G289 CarbonylContact O-C 3.55Å; A273-G289 VanDerWaalsContact O-CA 3.26Å; A273-G289 WeakPolarHBondContact O-CA 3Å; G289-C301 VanDerWaalsContact O-CA 3.27Å; G289-C301 WeakPolarHBondContact O-CA 3.4Å; G289-C301 WeakPolarHBondContact O-CB 3.25Å; G289-G302 PolarHBondContact N-O 3.32Å; G289-G302 PolarHBondContact O-N 3.19Å |
| 290 | A | 94.1 | Very high | 90.7 | Very high | 40 Ų | 40 | 80.2 Ų | 80.2 | 33% | 0.331 | 41% | 0.406 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -141.1 | 130.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 109.4 | G272 A273 F299 | G272-A290 CarbonylContact C-O 3.5Å; G272-A290 WeakPolarHBondContact CA-O 3.32Å; A273-A290 PolarHBondContact N-O 2.69Å; A273-A290 PolarHBondContact O-N 3.43Å; A290-F299 HydrophobicContact CB-CE2 3.98Å; A290-F299 HydrophobicContact CB-CZ 4.16Å |
| 291 | F | 93.1 | Very high | 91 | Very high | 19 Ų | 19 | 79.5 Ų | 79.5 | 8% | 0.083 | 40% | 0.402 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.3 | 124.3 | -179.4 | -66.4 | -93.4 | 0 | 0 | 0 | 109.2 | P42 A43 Q44 M45 V271 G272 V274 F299 H300 | P42-F291 HydrophobicContact CB-CZ 4.16Å; P42-F291 HydrophobicContact CG-CE1 4.25Å; P42-F291 HydrophobicContact CG-CZ 4.32Å; A43-F291 WeakPolarHBondContact O-CZ 3.35Å; Q44-F291 HydrophobicContact CB-CE2 4.4Å; Q44-F291 HydrophobicContact CB-CZ 4.29Å; Q44-F291 HydrophobicContact CG-CD1 4.08Å; Q44-F291 HydrophobicContact CG-CE1 3.76Å; Q44-F291 HydrophobicContact CG-CE2 4.41Å; Q44-F291 HydrophobicContact CG-CZ 3.96Å; M45-F291 HydrophobicContact CG-CE2 4.3Å; V271-F291 CarbonylContact O-C 3.59Å; V271-F291 WeakPolarHBondContact O-CA 3.46Å; G272-F291 VanDerWaalsContact CA-CD1 3.45Å; V274-F291 HydrophobicContact CG2-CE2 4.09Å; V274-F291 HydrophobicContact CG2-CZ 4.01Å; F291-F299 WeakPolarHBondContact O-CA 3.35Å; F291-H300 PolarHBondContact N-O 2.89Å; F291-H300 PolarHBondContact O-N 3.43Å |
| 292 | L | 92.8 | Very high | 91.4 | Very high | 63 Ų | 63 | 73.5 Ų | 73.5 | 33% | 0.33 | 36% | 0.364 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.9 | 121.5 | -178.5 | -177.6 | 65.3 | 0 | 0 | 0 | 109.2 | C270 V271 H294 F299 | C270-L292 CarbonylContact C-O 3.41Å; C270-L292 WeakPolarHBondContact CA-O 3.28Å; V271-L292 PolarHBondContact N-O 3.32Å; V271-L292 PolarHBondContact O-N 2.79Å; L292-H294 WeakPolarHBondContact CD2-CE1 3.48Å; L292-F299 HydrophobicContact CB-CD2 4.24Å; L292-F299 HydrophobicContact CD1-CB 3.91Å; L292-F299 HydrophobicContact CD1-CD2 4.05Å; L292-F299 HydrophobicContact CD1-CG 4.47Å |
| 293 | N | 92.4 | Very high | 91.7 | Very high | 25 Ų | 25 | 72 Ų | 72 | 13% | 0.134 | 35% | 0.353 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.4 | 109 | 167.2 | -176.2 | -45.8 | 0 | 0 | 0 | 108.4 | C270 W295 R296 N297 R298 | C270-N293 PolarHBondContact SG-ND2 3.11Å; N293-W295 PolarHBondContact OD1-N 2.86Å; N293-R296 HydrophobicContact CB-CB 4.46Å; N293-R296 PolarHBondContact OD1-N 3.01Å; N293-N297 WeakPolarHBondContact O-CA 3.44Å; N293-N297 PolarHBondContact O-N 3.01Å; N293-R298 PolarHBondContact N-O 3.06Å; N293-R298 PolarHBondContact O-N 3.1Å |
| 294 | H | 90.6 | Very high | 91.9 | Very high | 96 Ų | 96 | 68.8 Ų | 68.8 | 44% | 0.444 | 33% | 0.332 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.7 | -33.7 | -178.2 | -73.3 | -79.6 | 0 | 0 | 0 | 112.9 | W269 L292 N297 | W269-H294 HydrophobicContact CB-CB 4.16Å; W269-H294 PolarHBondContact O-N 2.84Å; L292-H294 WeakPolarHBondContact CD2-CE1 3.48Å; H294-N297 PolarHBondContact O-OD1 2.83Å |
| 295 | W | 87.9 | Confident | 92 | Very high | 199 Ų | 199 | 70.2 Ų | 70.2 | 75% | 0.754 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.8 | -42.9 | -179.4 | -175 | -98.3 | 0 | 0 | 0 | 112.1 | W269 N293 | W269-W295 HydrophobicContact CB-CB 4.5Å; N293-W295 PolarHBondContact OD1-N 2.86Å |
| 296 | R | 89.5 | Confident | 92 | Very high | 159 Ų | 159 | 71 Ų | 71 | 60% | 0.6 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -92.1 | -2.4 | -178.1 | -63.2 | -178.3 | 173.7 | -176.5 | 1.2 | 113.2 | N293 R298 | N293-R296 HydrophobicContact CB-CB 4.46Å; N293-R296 PolarHBondContact OD1-N 3.01Å; R296-R298 HydrophobicContact CB-CG 4.48Å; R296-R298 PolarHBondContact O-N 3.02Å |
| 297 | N | 89.6 | Confident | 91.9 | Very high | 141 Ų | 141 | 70.9 Ų | 70.9 | 75% | 0.754 | 35% | 0.345 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 47.4 | 42.7 | -173.3 | -69.5 | -41.2 | 0 | 0 | 0 | 113.1 | N293 H294 | N293-N297 WeakPolarHBondContact O-CA 3.44Å; N293-N297 PolarHBondContact O-N 3.01Å; H294-N297 PolarHBondContact O-OD1 2.83Å |
| 298 | R | 88.3 | Confident | 91.3 | Very high | 132 Ų | 132 | 73.9 Ų | 73.9 | 50% | 0.498 | 38% | 0.376 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.7 | 125.1 | 178.3 | -77 | -165.8 | -101.1 | 178.2 | -8.9 | 110.3 | N293 R296 | N293-R298 PolarHBondContact N-O 3.06Å; N293-R298 PolarHBondContact O-N 3.1Å; R296-R298 HydrophobicContact CB-CG 4.48Å; R296-R298 PolarHBondContact O-N 3.02Å |
| 299 | F | 88.6 | Confident | 91.1 | Very high | 120 Ų | 120 | 73.5 Ų | 73.5 | 53% | 0.526 | 37% | 0.373 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.6 | 129.9 | 176.4 | 176.8 | -104 | 0 | 0 | 0 | 109.4 | A290 F291 L292 C301 | A290-F299 HydrophobicContact CB-CE2 3.98Å; A290-F299 HydrophobicContact CB-CZ 4.16Å; F291-F299 WeakPolarHBondContact O-CA 3.35Å; L292-F299 HydrophobicContact CB-CD2 4.24Å; L292-F299 HydrophobicContact CD1-CB 3.91Å; L292-F299 HydrophobicContact CD1-CD2 4.05Å; L292-F299 HydrophobicContact CD1-CG 4.47Å; F299-C301 HydrophobicContact CE1-CB 3.67Å; F299-C301 HydrophobicContact CZ-CB 3.71Å |
| 300 | H | 88.8 | Confident | 91 | Very high | 63 Ų | 63 | 77 Ų | 77 | 29% | 0.292 | 39% | 0.39 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -126 | 131.6 | 174 | -51 | 84.8 | 0 | 0 | 0 | 107.7 | F291 | F291-H300 PolarHBondContact N-O 2.89Å; F291-H300 PolarHBondContact O-N 3.43Å |
| 301 | C | 91.8 | Very high | 90.8 | Very high | 72 Ų | 72 | 79.1 Ų | 79.1 | 49% | 0.486 | 39% | 0.393 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.2 | 154.6 | 171.6 | 64.8 | 0 | 0 | 0 | 0 | 110.2 | G47 G289 F299 | G47-C301 PolarHBondContact N-O 3.15Å; G47-C301 VanDerWaalsContact N-O 3.16Å; G289-C301 VanDerWaalsContact O-CA 3.27Å; G289-C301 WeakPolarHBondContact O-CA 3.4Å; G289-C301 WeakPolarHBondContact O-CB 3.25Å; F299-C301 HydrophobicContact CE1-CB 3.67Å; F299-C301 HydrophobicContact CZ-CB 3.71Å |
| 302 | G | 91.8 | Very high | 90.6 | Very high | 7 Ų | 7 | 82.6 Ų | 82.6 | 7% | 0.072 | 41% | 0.411 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -149.7 | 158.1 | 175 | 0 | 0 | 0 | 0 | 0 | 111 | G47 G289 | G47-G302 CarbonylContact O-C 3.53Å; G47-G302 WeakPolarHBondContact O-CA 3.48Å; G289-G302 PolarHBondContact N-O 3.32Å; G289-G302 PolarHBondContact O-N 3.19Å |
| 303 | F | 93.2 | Very high | 90.5 | Very high | 87 Ų | 87 | 83.8 Ų | 83.8 | 38% | 0.382 | 42% | 0.416 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.4 | 142.9 | 168.4 | 67.3 | -90.8 | 0 | 0 | 0 | 109.9 | G47 V48 K49 A287 L288 I305 | G47-F303 PolarHBondContact O-N 3.44Å; V48-F303 WeakPolarHBondContact CA-O 3.49Å; V48-F303 HydrophobicContact CB-CE1 4.17Å; V48-F303 HydrophobicContact CB-CE2 4.15Å; V48-F303 HydrophobicContact CB-CZ 3.87Å; V48-F303 HydrophobicContact CG1-CD2 3.95Å; V48-F303 HydrophobicContact CG1-CE1 4.18Å; V48-F303 HydrophobicContact CG1-CE2 3.28Å; V48-F303 HydrophobicContact CG1-CZ 3.41Å; V48-F303 VanDerWaalsContact CG1-CZ 3.41Å; V48-F303 HydrophobicContact CG2-CD1 3.99Å; V48-F303 HydrophobicContact CG2-CE1 3.23Å; V48-F303 HydrophobicContact CG2-CE2 4.01Å; V48-F303 HydrophobicContact CG2-CZ 3.23Å; K49-F303 PolarHBondContact N-O 2.95Å; A287-F303 CarbonylContact O-C 3.59Å; A287-F303 VanDerWaalsContact O-CA 3.24Å; A287-F303 WeakPolarHBondContact O-CA 3.22Å; L288-F303 HydrophobicContact CD2-CB 3.7Å; F303-I305 HydrophobicContact CD2-CG1 4.45Å; F303-I305 HydrophobicContact CE2-CD1 4.44Å |
| 304 | S | 92.9 | Very high | 90.4 | Very high | 14 Ų | 14 | 87.7 Ų | 87.7 | 10% | 0.098 | 44% | 0.435 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.1 | 137.8 | 175.1 | -173.7 | 0 | 0 | 0 | 0 | 110.6 | K49 A287 | K49-S304 CarbonylContact O-C 3.59Å; K49-S304 WeakPolarHBondContact O-CA 3.17Å; K49-S304 WeakPolarHBondContact O-CB 3.35Å; K49-S304 PolarHBondContact O-OG 2.93Å; A287-S304 PolarHBondContact N-O 2.94Å; A287-S304 PolarHBondContact O-N 2.8Å |
| 305 | I | 94.3 | Very high | 90.4 | Very high | 56 Ų | 56 | 87.1 Ų | 87.1 | 29% | 0.287 | 43% | 0.434 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -116.3 | 119.7 | 172.6 | -58.3 | 173.6 | 0 | 0 | 0 | 106 | K49 L50 V51 V284 L286 F303 V307 | K49-I305 PolarHBondContact O-N 2.66Å; L50-I305 CarbonylContact C-O 3.55Å; L50-I305 WeakPolarHBondContact CA-O 3.22Å; L50-I305 HydrophobicContact CD1-CB 3.94Å; L50-I305 HydrophobicContact CD1-CG2 4.04Å; V51-I305 PolarHBondContact N-O 3.38Å; V284-I305 HydrophobicContact CG1-CG2 3.84Å; L286-I305 HydrophobicContact CD1-CG1 3.86Å; F303-I305 HydrophobicContact CD2-CG1 4.45Å; F303-I305 HydrophobicContact CE2-CD1 4.44Å; I305-V307 HydrophobicContact CG2-CG2 4.23Å |
| 306 | T | 93.3 | Very high | 90.6 | Very high | 53 Ų | 53 | 78.5 Ų | 78.5 | 33% | 0.325 | 41% | 0.41 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.5 | 122.1 | 173.6 | -57.4 | 0 | 0 | 0 | 0 | 108.8 | V51 V284 T285 | V51-T306 HydrophobicContact CB-CG2 4.17Å; V51-T306 HydrophobicContact CG1-CG2 4.32Å; V51-T306 CarbonylContact O-C 3.42Å; V51-T306 VanDerWaalsContact O-CA 3.31Å; V51-T306 WeakPolarHBondContact O-CA 3.49Å; V284-T306 WeakPolarHBondContact CA-O 3.31Å; T285-T306 PolarHBondContact N-O 2.94Å; T285-T306 PolarHBondContact O-N 3.1Å |
| 307 | V | 92.7 | Very high | 90.6 | Very high | 47 Ų | 47 | 71.8 Ų | 71.8 | 29% | 0.285 | 39% | 0.394 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.2 | 124 | 174.7 | -171.8 | 0 | 0 | 0 | 0 | 107.1 | L50 V51 V52 N53 V284 I305 | L50-V307 HydrophobicContact CD1-CG2 4.44Å; V51-V307 PolarHBondContact O-N 3.21Å; V52-V307 CarbonylContact C-O 3.59Å; V52-V307 WeakPolarHBondContact CA-O 3.41Å; N53-V307 PolarHBondContact N-O 3.13Å; V284-V307 HydrophobicContact CG2-CG1 4.45Å; V284-V307 HydrophobicContact CG2-CG2 4.31Å; I305-V307 HydrophobicContact CG2-CG2 4.23Å |
| 308 | G | 82.4 | Confident | 90.7 | Very high | 70 Ų | 70 | 65.5 Ų | 65.5 | 72% | 0.722 | 36% | 0.361 | S | S | * | . | trans | -119.4 | 0 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.6 | P283 | P283-G308 WeakPolarHBondContact CB-O 3.08Å; P283-G308 WeakPolarHBondContact CG-O 3.37Å; P283-G308 PolarHBondContact O-N 2.85Å |
Retrieved 308 of 308 residues in 72.9 ms
(Link to these results)