| 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 | 84.1 | Confident | 93.7 | Very high | 156 Ų | 156 | 94.2 Ų | 94.2 | 77% | 0.768 | 48% | 0.481 | S | S | * | . | 0 | 125.9 | 0 | -112.4 | 59.1 | 135.5 | 0 | 0 | 109.7 | Q4 H31 | M1-Q4 PolarHBondContact O-NE2 3.1Å; M1-H31 HydrophobicContact CB-CB 4.43Å; M1-H31 VanDerWaalsContact CB-CD2 3.41Å; M1-H31 WeakPolarHBondContact CB-CD2 3.47Å; M1-H31 HydrophobicContact CE-CB 4.42Å; M1-H31 HydrophobicContact CG-CB 4.01Å; M1-H31 WeakPolarHBondContact CG-CD2 3.44Å; M1-H31 WeakPolarHBondContact CG-NE2 3.18Å | |||
| 2 | F | 92.9 | Very high | 93.9 | Very high | 177 Ų | 177 | 96.1 Ų | 96.1 | 78% | 0.776 | 49% | 0.486 | S | S | * | . | trans | -84.4 | -32.5 | -176.1 | -66.9 | -69 | 0 | 0 | 0 | 112.9 | Q4 L17 | F2-Q4 WeakPolarHBondContact O-CG 3.44Å; F2-Q4 PolarHBondContact O-N 3.18Å; F2-Q4 PolarHBondContact O-NE2 3.48Å; F2-Q4 VanDerWaalsContact O-NE2 3.13Å; F2-L17 HydrophobicContact CB-CD2 4.17Å | ||
| 3 | L | 97.1 | Very high | 94 | Very high | 66 Ų | 66 | 99.8 Ų | 99.8 | 35% | 0.346 | 49% | 0.491 | S | S | . | . | trans | -64.8 | 121.7 | -177.8 | -165 | 66.7 | 0 | 0 | 0 | 111.4 | Y15 L17 A30 H31 | L3-Y15 HydrophobicContact CD1-CD1 4.45Å; L3-Y15 HydrophobicContact CD2-CD1 4.14Å; L3-Y15 HydrophobicContact CG-CD1 4.14Å; L3-L17 HydrophobicContact CD1-CD2 4.33Å; L3-A30 HydrophobicContact CB-CB 4.05Å; L3-A30 HydrophobicContact CD2-CB 3.8Å; L3-A30 HydrophobicContact CG-CB 3.7Å; L3-A30 WeakPolarHBondContact O-CB 3.41Å; L3-A30 PolarHBondContact O-N 3.34Å; L3-H31 WeakPolarHBondContact CB-NE2 3.03Å | ||
| 4 | Q | 97.1 | Very high | 94.1 | Very high | 11 Ų | 11 | 96.4 Ų | 96.4 | 5% | 0.051 | 48% | 0.478 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.5 | 168.4 | 174.8 | -48.5 | -59.6 | -44.4 | 0 | 0 | 110.1 | M1 F2 Y15 T16 K19 T27 S28 | M1-Q4 PolarHBondContact O-NE2 3.1Å; F2-Q4 WeakPolarHBondContact O-CG 3.44Å; F2-Q4 PolarHBondContact O-N 3.18Å; F2-Q4 PolarHBondContact O-NE2 3.48Å; F2-Q4 VanDerWaalsContact O-NE2 3.13Å; Q4-Y15 WeakPolarHBondContact O-CA 3.5Å; Q4-T16 CarbonylContact C-O 3.53Å; Q4-T16 WeakPolarHBondContact CA-O 3.37Å; Q4-T16 HydrophobicContact CB-CG2 4.22Å; Q4-T16 WeakPolarHBondContact CB-O 3.32Å; Q4-T16 PolarHBondContact N-O 3.13Å; Q4-T16 PolarHBondContact O-N 2.92Å; Q4-T16 VanDerWaalsContact O-O 3.06Å; Q4-K19 HydrophobicContact CG-CD 4.42Å; Q4-T27 VanDerWaalsContact CB-OG1 3.3Å; Q4-T27 WeakPolarHBondContact CB-OG1 3.32Å; Q4-T27 WeakPolarHBondContact CG-OG1 3.43Å; Q4-S28 CarbonylContact C-O 3.39Å; Q4-S28 WeakPolarHBondContact CA-O 3.33Å; Q4-S28 WeakPolarHBondContact CB-O 3.44Å; Q4-S28 VanDerWaalsContact OE1-C 3.25Å; Q4-S28 PolarHBondContact OE1-O 2.92Å |
| 5 | F | 96.8 | Very high | 94.3 | Very high | 29 Ų | 29 | 98.4 Ų | 98.4 | 13% | 0.127 | 48% | 0.479 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -146.6 | 160.3 | 170.1 | 78.7 | -79.6 | 0 | 0 | 0 | 111.8 | L7 R13 V14 Y15 S28 S29 A30 | F5-L7 HydrophobicContact CD2-CD2 4.4Å; F5-L7 HydrophobicContact CE2-CD2 4.03Å; F5-L7 HydrophobicContact CE2-CG 4.35Å; F5-R13 HydrophobicContact CB-CB 4.32Å; F5-R13 HydrophobicContact CD2-CB 3.87Å; F5-R13 HydrophobicContact CD2-CG 3.54Å; F5-R13 HydrophobicContact CE2-CG 3.82Å; F5-R13 HydrophobicContact CG-CB 4.33Å; F5-R13 HydrophobicContact CG-CG 4.28Å; F5-V14 WeakPolarHBondContact CA-O 3.21Å; F5-Y15 HydrophobicContact CB-CD1 3.87Å; F5-Y15 HydrophobicContact CB-CE1 4.08Å; F5-S28 VanDerWaalsContact CD1-O 3.31Å; F5-S28 WeakPolarHBondContact CD1-O 3.48Å; F5-S28 PolarHBondContact N-O 2.92Å; F5-S28 PolarHBondContact O-N 2.92Å; F5-S29 WeakPolarHBondContact CE1-O 3.43Å; F5-A30 HydrophobicContact CD1-CB 4.26Å |
| 6 | Y | 96.3 | Very high | 94.4 | Very high | 60 Ų | 60 | 94.2 Ų | 94.2 | 24% | 0.235 | 46% | 0.461 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.5 | 167.1 | 162.4 | 63.4 | -85 | 0 | 0 | 0 | 109.1 | R13 V14 T16 D21 T27 | Y6-R13 WeakPolarHBondContact O-CA 3.4Å; Y6-V14 HydrophobicContact CD1-CB 4.27Å; Y6-V14 HydrophobicContact CD2-CB 4.42Å; Y6-V14 HydrophobicContact CE1-CB 3.77Å; Y6-V14 HydrophobicContact CE1-CG1 3.73Å; Y6-V14 HydrophobicContact CE2-CB 3.94Å; Y6-V14 HydrophobicContact CE2-CG1 4.42Å; Y6-V14 HydrophobicContact CE2-CG2 4.16Å; Y6-V14 PolarHBondContact N-O 3.38Å; Y6-V14 VanDerWaalsContact N-O 3.13Å; Y6-V14 PolarHBondContact O-N 2.76Å; Y6-V14 WeakPolarHBondContact OH-CG1 3.44Å; Y6-T16 HydrophobicContact CD1-CG2 4.35Å; Y6-D21 HydrophobicContact CD1-CB 3.99Å; Y6-D21 HydrophobicContact CD2-CB 4.37Å; Y6-D21 HydrophobicContact CE1-CB 4.44Å; Y6-D21 HydrophobicContact CG-CB 3.95Å; Y6-T27 HydrophobicContact CD1-CG2 4.43Å |
| 7 | L | 95.1 | Very high | 94.5 | Very high | 108 Ų | 108 | 96.1 Ų | 96.1 | 57% | 0.565 | 47% | 0.473 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -95.9 | 129.8 | 177 | -64.2 | 175.8 | 0 | 0 | 0 | 109.4 | F5 E12 R13 | F5-L7 HydrophobicContact CD2-CD2 4.4Å; F5-L7 HydrophobicContact CE2-CD2 4.03Å; F5-L7 HydrophobicContact CE2-CG 4.35Å; L7-E12 WeakPolarHBondContact CA-O 3.41Å; L7-R13 HydrophobicContact CD2-CG 4.02Å |
| 8 | N | 91.4 | Very high | 94.5 | Very high | 46 Ų | 46 | 98.8 Ų | 98.8 | 25% | 0.246 | 48% | 0.482 | C | S | . | . | trans | -77 | 177.6 | 170.1 | 69.9 | 4.3 | 0 | 0 | 0 | 110.7 | N10 G11 E12 V14 | N8-N10 PolarHBondContact O-N 3.05Å; N8-N10 WeakPolarHBondContact OD1-CA 3.49Å; N8-N10 WeakPolarHBondContact OD1-CB 3.37Å; N8-N10 PolarHBondContact OD1-N 2.78Å; N8-N10 VanDerWaalsContact OD1-N 3.1Å; N8-G11 PolarHBondContact O-N 3.46Å; N8-G11 PolarHBondContact OD1-N 2.99Å; N8-E12 PolarHBondContact N-O 3.48Å; N8-E12 PolarHBondContact ND2-OE2 2.81Å; N8-E12 WeakPolarHBondContact OD1-CA 3.46Å; N8-E12 WeakPolarHBondContact OD1-CB 3.31Å; N8-E12 PolarHBondContact OD1-N 3.26Å; N8-E12 PolarHBondContact OD1-O 3.48Å; N8-V14 HydrophobicContact CB-CG2 4.05Å | ||
| 9 | E | 92.8 | Very high | 94.5 | Very high | 202 Ų | 202 | 100.4 Ų | 100.4 | 94% | 0.944 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.6 | -26.4 | 178.2 | -62.3 | 178.7 | 176.4 | 0 | 0 | 112.9 | G11 | E9-G11 VanDerWaalsContact C-N 3.28Å; E9-G11 PolarHBondContact O-N 2.92Å |
| 10 | N | 94.4 | Very high | 94.6 | Very high | 129 Ų | 129 | 98.9 Ų | 98.9 | 69% | 0.69 | 48% | 0.483 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.5 | -3 | 176.4 | -58.7 | -24.2 | 0 | 0 | 0 | 113.1 | N8 E12 | N8-N10 PolarHBondContact O-N 3.05Å; N8-N10 WeakPolarHBondContact OD1-CA 3.49Å; N8-N10 WeakPolarHBondContact OD1-CB 3.37Å; N8-N10 PolarHBondContact OD1-N 2.78Å; N8-N10 VanDerWaalsContact OD1-N 3.1Å; N10-E12 VanDerWaalsContact C-N 3.33Å; N10-E12 HydrophobicContact CB-CG 4.11Å |
| 11 | G | 93 | Very high | 94.4 | Very high | 52 Ų | 52 | 95.3 Ų | 95.3 | 54% | 0.536 | 47% | 0.466 | S | S | . | . | S | Bend | trans | 77.6 | 13.3 | -176.6 | 0 | 0 | 0 | 0 | 0 | 114.8 | N8 E9 | N8-G11 PolarHBondContact O-N 3.46Å; N8-G11 PolarHBondContact OD1-N 2.99Å; E9-G11 VanDerWaalsContact C-N 3.28Å; E9-G11 PolarHBondContact O-N 2.92Å |
| 12 | E | 95.8 | Very high | 94.7 | Very high | 117 Ų | 117 | 95.1 Ų | 95.1 | 55% | 0.547 | 47% | 0.467 | S | S | . | . | P | Polyproline II helix | trans | -88.9 | 151.5 | 177.6 | -52.7 | 170 | 140.3 | 0 | 0 | 111.2 | L7 N8 N10 V14 | L7-E12 WeakPolarHBondContact CA-O 3.41Å; N8-E12 PolarHBondContact N-O 3.48Å; N8-E12 PolarHBondContact ND2-OE2 2.81Å; N8-E12 WeakPolarHBondContact OD1-CA 3.46Å; N8-E12 WeakPolarHBondContact OD1-CB 3.31Å; N8-E12 PolarHBondContact OD1-N 3.26Å; N8-E12 PolarHBondContact OD1-O 3.48Å; N10-E12 VanDerWaalsContact C-N 3.33Å; N10-E12 HydrophobicContact CB-CG 4.11Å; E12-V14 PolarHBondContact O-N 2.75Å |
| 13 | R | 95.3 | Very high | 94.6 | Very high | 145 Ų | 145 | 93.8 Ų | 93.8 | 55% | 0.547 | 47% | 0.468 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.2 | 119.1 | 179.2 | -62 | -173.7 | 178.7 | 167.8 | 0 | 110.9 | F5 Y6 L7 Y15 | F5-R13 HydrophobicContact CB-CB 4.32Å; F5-R13 HydrophobicContact CD2-CB 3.87Å; F5-R13 HydrophobicContact CD2-CG 3.54Å; F5-R13 HydrophobicContact CE2-CG 3.82Å; F5-R13 HydrophobicContact CG-CB 4.33Å; F5-R13 HydrophobicContact CG-CG 4.28Å; Y6-R13 WeakPolarHBondContact O-CA 3.4Å; L7-R13 HydrophobicContact CD2-CG 4.02Å; R13-Y15 HydrophobicContact CB-CE2 4.36Å |
| 14 | V | 95.7 | Very high | 94.4 | Very high | 51 Ų | 51 | 93.4 Ų | 93.4 | 31% | 0.309 | 48% | 0.479 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.9 | 116.2 | 168.6 | -176.5 | 0 | 0 | 0 | 0 | 109 | F5 Y6 N8 E12 | F5-V14 WeakPolarHBondContact CA-O 3.21Å; Y6-V14 HydrophobicContact CD1-CB 4.27Å; Y6-V14 HydrophobicContact CD2-CB 4.42Å; Y6-V14 HydrophobicContact CE1-CB 3.77Å; Y6-V14 HydrophobicContact CE1-CG1 3.73Å; Y6-V14 HydrophobicContact CE2-CB 3.94Å; Y6-V14 HydrophobicContact CE2-CG1 4.42Å; Y6-V14 HydrophobicContact CE2-CG2 4.16Å; Y6-V14 PolarHBondContact N-O 3.38Å; Y6-V14 VanDerWaalsContact N-O 3.13Å; Y6-V14 PolarHBondContact O-N 2.76Å; Y6-V14 WeakPolarHBondContact OH-CG1 3.44Å; N8-V14 HydrophobicContact CB-CG2 4.05Å; E12-V14 PolarHBondContact O-N 2.75Å |
| 15 | Y | 96.7 | Very high | 94.2 | Very high | 127 Ų | 127 | 98.6 Ų | 98.6 | 50% | 0.498 | 50% | 0.503 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.8 | 144 | -176.3 | -65.4 | -73.2 | 0 | 0 | 0 | 112.4 | L3 Q4 F5 R13 A30 | L3-Y15 HydrophobicContact CD1-CD1 4.45Å; L3-Y15 HydrophobicContact CD2-CD1 4.14Å; L3-Y15 HydrophobicContact CG-CD1 4.14Å; Q4-Y15 WeakPolarHBondContact O-CA 3.5Å; F5-Y15 HydrophobicContact CB-CD1 3.87Å; F5-Y15 HydrophobicContact CB-CE1 4.08Å; R13-Y15 HydrophobicContact CB-CE2 4.36Å; Y15-A30 HydrophobicContact CD1-CB 3.97Å; Y15-A30 HydrophobicContact CE1-CB 3.77Å |
| 16 | T | 95.8 | Very high | 94.1 | Very high | 31 Ų | 31 | 102.7 Ų | 102.7 | 19% | 0.19 | 53% | 0.533 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -155.5 | 160.4 | -179.9 | -176.9 | 0 | 0 | 0 | 0 | 111 | Q4 Y6 K18 T27 | Q4-T16 CarbonylContact C-O 3.53Å; Q4-T16 WeakPolarHBondContact CA-O 3.37Å; Q4-T16 HydrophobicContact CB-CG2 4.22Å; Q4-T16 WeakPolarHBondContact CB-O 3.32Å; Q4-T16 PolarHBondContact N-O 3.13Å; Q4-T16 PolarHBondContact O-N 2.92Å; Q4-T16 VanDerWaalsContact O-O 3.06Å; Y6-T16 HydrophobicContact CD1-CG2 4.35Å; T16-K18 WeakPolarHBondContact OG1-CB 3.41Å; T16-K18 PolarHBondContact OG1-N 2.87Å; T16-K18 VanDerWaalsContact OG1-N 3.08Å; T16-T27 HydrophobicContact CG2-CG2 3.9Å |
| 17 | L | 96.1 | Very high | 94.1 | Very high | 127 Ų | 127 | 100.7 Ų | 100.7 | 67% | 0.665 | 53% | 0.527 | S | S | * | . | S | Bend | trans | -95.9 | -9.6 | 168.8 | -60.9 | 178.1 | 0 | 0 | 0 | 112.1 | F2 L3 | F2-L17 HydrophobicContact CB-CD2 4.17Å; L3-L17 HydrophobicContact CD1-CD2 4.33Å |
| 18 | K | 95.4 | Very high | 94.2 | Very high | 145 Ų | 145 | 98.8 Ų | 98.8 | 63% | 0.63 | 52% | 0.523 | S | S | * | . | trans | -74.3 | 147.7 | 178.5 | -62.6 | -178.9 | 178.4 | 179.9 | 0 | 110.6 | T16 V20 T27 | T16-K18 WeakPolarHBondContact OG1-CB 3.41Å; T16-K18 PolarHBondContact OG1-N 2.87Å; T16-K18 VanDerWaalsContact OG1-N 3.08Å; K18-V20 VanDerWaalsContact C-N 3.31Å; K18-T27 PolarHBondContact O-OG1 2.89Å | ||
| 19 | K | 94.5 | Very high | 94.4 | Very high | 128 Ų | 128 | 99.4 Ų | 99.4 | 56% | 0.557 | 53% | 0.53 | S | S | * | . | S | Bend | trans | -82.2 | -10.6 | 177.4 | -64.9 | -61.3 | -176.1 | 178.5 | 0 | 114.1 | Q4 T27 | Q4-K19 HydrophobicContact CG-CD 4.42Å; K19-T27 WeakPolarHBondContact CA-OG1 3.3Å; K19-T27 PolarHBondContact O-N 3.32Å; K19-T27 PolarHBondContact O-OG1 3.17Å |
| 20 | V | 95.3 | Very high | 94.6 | Very high | 70 Ų | 70 | 90.7 Ų | 90.7 | 42% | 0.424 | 49% | 0.493 | S | S | . | . | B | Isolated β-bridge | trans | -134.4 | 141.3 | -176.4 | -171.6 | 0 | 0 | 0 | 0 | 107.9 | K18 G24 Q25 | K18-V20 VanDerWaalsContact C-N 3.31Å; V20-G24 WeakPolarHBondContact CG1-O 3.48Å; V20-Q25 CarbonylContact C-O 3.55Å; V20-Q25 VanDerWaalsContact CA-O 3.32Å; V20-Q25 WeakPolarHBondContact CA-O 3.15Å |
| 21 | D | 91.8 | Very high | 94.6 | Very high | 25 Ų | 25 | 87.8 Ų | 87.8 | 13% | 0.134 | 48% | 0.475 | C | S | . | . | trans | -77.4 | -172.3 | 175.1 | 80.6 | -3.7 | 0 | 0 | 0 | 111.9 | Y6 L23 G24 Q25 T27 | Y6-D21 HydrophobicContact CD1-CB 3.99Å; Y6-D21 HydrophobicContact CD2-CB 4.37Å; Y6-D21 HydrophobicContact CE1-CB 4.44Å; Y6-D21 HydrophobicContact CG-CB 3.95Å; D21-L23 VanDerWaalsContact C-N 3.27Å; D21-L23 PolarHBondContact O-N 2.9Å; D21-L23 VanDerWaalsContact OD1-C 3.27Å; D21-L23 VanDerWaalsContact OD1-CA 3.31Å; D21-L23 WeakPolarHBondContact OD1-CA 3.31Å; D21-L23 PolarHBondContact OD1-N 3.08Å; D21-G24 PolarHBondContact OD1-N 3.3Å; D21-Q25 PolarHBondContact N-O 3.5Å; D21-Q25 PolarHBondContact OD1-N 3.22Å; D21-T27 HydrophobicContact CB-CG2 4.33Å | ||
| 22 | L | 89.3 | Confident | 94.8 | Very high | 152 Ų | 152 | 91 Ų | 91 | 80% | 0.796 | 49% | 0.487 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.9 | -20.3 | 179.1 | -61.7 | 173.9 | 0 | 0 | 0 | 113.5 | ||
| 23 | L | 90.4 | Very high | 94.6 | Very high | 149 Ų | 149 | 90.2 Ų | 90.2 | 78% | 0.78 | 50% | 0.5 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -98.4 | 0.8 | -178.5 | -68.6 | 167.8 | 0 | 0 | 0 | 112.9 | D21 | D21-L23 VanDerWaalsContact C-N 3.27Å; D21-L23 PolarHBondContact O-N 2.9Å; D21-L23 VanDerWaalsContact OD1-C 3.27Å; D21-L23 VanDerWaalsContact OD1-CA 3.31Å; D21-L23 WeakPolarHBondContact OD1-CA 3.31Å; D21-L23 PolarHBondContact OD1-N 3.08Å |
| 24 | G | 92.8 | Very high | 94.6 | Very high | 57 Ų | 57 | 92.6 Ų | 92.6 | 59% | 0.588 | 51% | 0.509 | S | S | * | . | S | Bend | trans | 89 | 4.4 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | V20 D21 | V20-G24 WeakPolarHBondContact CG1-O 3.48Å; D21-G24 PolarHBondContact OD1-N 3.3Å |
| 25 | Q | 93 | Very high | 94.6 | Very high | 120 Ų | 120 | 98.4 Ų | 98.4 | 56% | 0.561 | 53% | 0.53 | S | S | * | . | P | Polyproline II helix | trans | -82.2 | 145.2 | 179.1 | -55.3 | -170.5 | 7.5 | 0 | 0 | 111.9 | V20 D21 | V20-Q25 CarbonylContact C-O 3.55Å; V20-Q25 VanDerWaalsContact CA-O 3.32Å; V20-Q25 WeakPolarHBondContact CA-O 3.15Å; D21-Q25 PolarHBondContact N-O 3.5Å; D21-Q25 PolarHBondContact OD1-N 3.22Å |
| 26 | P | 96 | Very high | 94.5 | Very high | 115 Ų | 115 | 94.2 Ų | 94.2 | 75% | 0.747 | 52% | 0.52 | S | S | * | . | B | Isolated β-bridge | trans | -67.2 | 135.6 | 178.5 | 27.9 | -34.4 | 0 | 0 | 0 | 111.5 | ||
| 27 | T | 96.1 | Very high | 94.5 | Very high | 19 Ų | 19 | 98.3 Ų | 98.3 | 12% | 0.117 | 55% | 0.547 | C | S | . | . | P | Polyproline II helix | trans | -81.3 | 153.2 | 176.7 | 58.3 | 0 | 0 | 0 | 0 | 111.7 | Q4 Y6 T16 K18 K19 D21 | Q4-T27 VanDerWaalsContact CB-OG1 3.3Å; Q4-T27 WeakPolarHBondContact CB-OG1 3.32Å; Q4-T27 WeakPolarHBondContact CG-OG1 3.43Å; Y6-T27 HydrophobicContact CD1-CG2 4.43Å; T16-T27 HydrophobicContact CG2-CG2 3.9Å; K18-T27 PolarHBondContact O-OG1 2.89Å; K19-T27 WeakPolarHBondContact CA-OG1 3.3Å; K19-T27 PolarHBondContact O-N 3.32Å; K19-T27 PolarHBondContact O-OG1 3.17Å; D21-T27 HydrophobicContact CB-CG2 4.33Å |
| 28 | S | 95.9 | Very high | 94.5 | Very high | 67 Ų | 67 | 97.5 Ų | 97.5 | 47% | 0.469 | 54% | 0.543 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.7 | 149.6 | -180 | -71.1 | 0 | 0 | 0 | 0 | 111.9 | Q4 F5 A30 | Q4-S28 CarbonylContact C-O 3.39Å; Q4-S28 WeakPolarHBondContact CA-O 3.33Å; Q4-S28 WeakPolarHBondContact CB-O 3.44Å; Q4-S28 VanDerWaalsContact OE1-C 3.25Å; Q4-S28 PolarHBondContact OE1-O 2.92Å; F5-S28 VanDerWaalsContact CD1-O 3.31Å; F5-S28 WeakPolarHBondContact CD1-O 3.48Å; F5-S28 PolarHBondContact N-O 2.92Å; F5-S28 PolarHBondContact O-N 2.92Å; S28-A30 PolarHBondContact O-N 2.85Å |
| 29 | S | 96.3 | Very high | 94.5 | Very high | 59 Ų | 59 | 92.6 Ų | 92.6 | 41% | 0.413 | 52% | 0.524 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -62.7 | 127.5 | 175.7 | 171 | 0 | 0 | 0 | 0 | 110.8 | F5 H31 | F5-S29 WeakPolarHBondContact CE1-O 3.43Å; S29-H31 PolarHBondContact O-N 2.77Å; S29-H31 PolarHBondContact OG-N 3.28Å; S29-H31 PolarHBondContact OG-O 2.79Å |
| 30 | A | 96.8 | Very high | 94.6 | Very high | 19 Ų | 19 | 94.1 Ų | 94.1 | 16% | 0.157 | 53% | 0.531 | C | S | . | . | S | Bend | trans | -68.7 | -11.2 | 176.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | L3 F5 Y15 S28 | L3-A30 HydrophobicContact CB-CB 4.05Å; L3-A30 HydrophobicContact CD2-CB 3.8Å; L3-A30 HydrophobicContact CG-CB 3.7Å; L3-A30 WeakPolarHBondContact O-CB 3.41Å; L3-A30 PolarHBondContact O-N 3.34Å; F5-A30 HydrophobicContact CD1-CB 4.26Å; Y15-A30 HydrophobicContact CD1-CB 3.97Å; Y15-A30 HydrophobicContact CE1-CB 3.77Å; S28-A30 PolarHBondContact O-N 2.85Å |
| 31 | H | 95.4 | Very high | 94.6 | Very high | 69 Ų | 69 | 97.8 Ų | 97.8 | 32% | 0.319 | 54% | 0.541 | S | S | . | . | S | Bend | trans | -106.8 | 141.4 | -175.3 | -55.4 | -94.6 | 0 | 0 | 0 | 111.2 | M1 L3 S29 | M1-H31 HydrophobicContact CB-CB 4.43Å; M1-H31 VanDerWaalsContact CB-CD2 3.41Å; M1-H31 WeakPolarHBondContact CB-CD2 3.47Å; M1-H31 HydrophobicContact CE-CB 4.42Å; M1-H31 HydrophobicContact CG-CB 4.01Å; M1-H31 WeakPolarHBondContact CG-CD2 3.44Å; M1-H31 WeakPolarHBondContact CG-NE2 3.18Å; L3-H31 WeakPolarHBondContact CB-NE2 3.03Å; S29-H31 PolarHBondContact O-N 2.77Å; S29-H31 PolarHBondContact OG-N 3.28Å; S29-H31 PolarHBondContact OG-O 2.79Å |
| 32 | P | 95.5 | Very high | 94.8 | Very high | 120 Ų | 120 | 99.2 Ų | 99.2 | 78% | 0.779 | 55% | 0.553 | S | S | * | * | P | Polyproline II helix | trans | -67.1 | 161.1 | 178.3 | 30 | -35.8 | 0 | 0 | 0 | 111.6 | ||
| 33 | A | 93.6 | Very high | 95.2 | Very high | 100 Ų | 100 | 100.7 Ų | 100.7 | 83% | 0.826 | 55% | 0.548 | S | S | * | . | P | Polyproline II helix | trans | -59.9 | 142.7 | 169.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | F35 | A33-F35 PolarHBondContact O-N 3.22Š|
| 34 | R | 94.4 | Very high | 95.5 | Very high | 195 Ų | 195 | 98.5 Ų | 98.5 | 74% | 0.736 | 53% | 0.534 | S | S | * | . | P | Polyproline II helix | trans | -61.1 | 132.5 | 178.9 | -174.2 | -174.3 | 63.9 | 77.4 | -6.9 | 110.6 | S36 | R34-S36 PolarHBondContact NH1-OG 3.17Š|
| 35 | F | 95.2 | Very high | 95.7 | Very high | 172 Ų | 172 | 101.5 Ų | 101.5 | 75% | 0.754 | 53% | 0.527 | S | S | * | . | P | Polyproline II helix | trans | -70.7 | 136.7 | 169.1 | 179.2 | -104.5 | 0 | 0 | 0 | 111.2 | A33 P37 | A33-F35 PolarHBondContact O-N 3.22Å; F35-P37 HydrophobicContact CE1-CG 4.07Å |
| 36 | S | 94.1 | Very high | 95.9 | Very high | 40 Ų | 40 | 99.2 Ų | 99.2 | 28% | 0.28 | 52% | 0.521 | S | S | . | . | trans | -134.1 | 124.9 | 174.6 | -155.5 | 0 | 0 | 0 | 0 | 108.6 | R34 D38 D39 | R34-S36 PolarHBondContact NH1-OG 3.17Å; S36-D38 VanDerWaalsContact C-N 3.29Å; S36-D38 PolarHBondContact O-N 2.99Å; S36-D39 WeakPolarHBondContact O-CB 3.41Å; S36-D39 PolarHBondContact O-N 3.04Å | ||
| 37 | P | 95.9 | Very high | 95.9 | Very high | 116 Ų | 116 | 97.3 Ų | 97.3 | 75% | 0.753 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.3 | -38.1 | 179.3 | -25.8 | 34.3 | 0 | 0 | 0 | 113.7 | F35 | F35-P37 HydrophobicContact CE1-CG 4.07Š|
| 38 | D | 96 | Very high | 96 | Very high | 111 Ų | 111 | 100.9 Ų | 100.9 | 59% | 0.594 | 53% | 0.525 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.7 | -25 | -176.8 | -180 | 52.4 | 0 | 0 | 0 | 114.4 | S36 K40 | S36-D38 VanDerWaalsContact C-N 3.29Å; S36-D38 PolarHBondContact O-N 2.99Å; D38-K40 PolarHBondContact O-N 3.24Å; D38-K40 WeakPolarHBondContact OD2-CE 3.47Å; D38-K40 VanDerWaalsContact OD2-CG 3.28Å; D38-K40 WeakPolarHBondContact OD2-CG 3.3Å |
| 39 | D | 95.5 | Very high | 96 | Very high | 42 Ų | 42 | 101.9 Ų | 101.9 | 23% | 0.225 | 52% | 0.521 | C | S | . | . | trans | 4.5 | 76.2 | -176.8 | -177.7 | 24.6 | 0 | 0 | 0 | 117 | S36 F41 S42 R45 | S36-D39 WeakPolarHBondContact O-CB 3.41Å; S36-D39 PolarHBondContact O-N 3.04Å; D39-F41 PolarHBondContact O-N 2.81Å; D39-S42 VanDerWaalsContact O-CB 3.24Å; D39-S42 WeakPolarHBondContact O-CB 3.44Å; D39-S42 PolarHBondContact O-N 3.26Å; D39-S42 PolarHBondContact O-OG 3.28Å; D39-S42 VanDerWaalsContact O-OG 3.06Å; D39-S42 PolarHBondContact OD1-N 2.9Å; D39-S42 WeakPolarHBondContact OD2-CA 3.41Å; D39-S42 WeakPolarHBondContact OD2-CB 3.39Å; D39-R45 IonicContact OD1-NH1 3.65Å; D39-R45 IonicContact OD2-CZ 3.06Å; D39-R45 IonicContact OD2-NH1 2.62Å; D39-R45 PolarHBondContact OD2-NH1 3.46Å; D39-R45 IonicContact OD2-NH2 2.69Å; D39-R45 PolarHBondContact OD2-NH2 3.16Å | ||
| 40 | K | 96.6 | Very high | 96 | Very high | 160 Ų | 160 | 105.5 Ų | 105.5 | 70% | 0.696 | 53% | 0.529 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.3 | -21.4 | -176.8 | -58.6 | -174.9 | -177.6 | -176.7 | 0 | 113.7 | D38 | D38-K40 PolarHBondContact O-N 3.24Å; D38-K40 WeakPolarHBondContact OD2-CE 3.47Å; D38-K40 VanDerWaalsContact OD2-CG 3.28Å; D38-K40 WeakPolarHBondContact OD2-CG 3.3Å |
| 41 | F | 96.6 | Very high | 96 | Very high | 147 Ų | 147 | 113.7 Ų | 113.7 | 65% | 0.645 | 56% | 0.556 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -100.7 | 11.2 | -178.9 | -60.4 | -74.5 | 0 | 0 | 0 | 113.4 | D39 R43 H44 R45 | D39-F41 PolarHBondContact O-N 2.81Å; F41-R43 VanDerWaalsContact C-N 3.32Å; F41-R43 PolarHBondContact O-N 3.2Å; F41-H44 AromaticContact CD1-ND1 3.82Å; F41-H44 WeakPolarHBondContact O-CB 3.49Å; F41-H44 PolarHBondContact O-N 3.42Å; F41-R45 PolarHBondContact O-N 3.23Å |
| 42 | S | 96.2 | Very high | 96.1 | Very high | 54 Ų | 54 | 116.7 Ų | 116.7 | 38% | 0.378 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -50.2 | -47.7 | 177.1 | 55.7 | 0 | 0 | 0 | 0 | 112.9 | D39 H44 R45 V46 | D39-S42 VanDerWaalsContact O-CB 3.24Å; D39-S42 WeakPolarHBondContact O-CB 3.44Å; D39-S42 PolarHBondContact O-N 3.26Å; D39-S42 PolarHBondContact O-OG 3.28Å; D39-S42 VanDerWaalsContact O-OG 3.06Å; D39-S42 PolarHBondContact OD1-N 2.9Å; D39-S42 WeakPolarHBondContact OD2-CA 3.41Å; D39-S42 WeakPolarHBondContact OD2-CB 3.39Å; S42-H44 VanDerWaalsContact C-N 3.33Å; S42-H44 PolarHBondContact O-N 3.34Å; S42-R45 PolarHBondContact O-N 3.07Å; S42-V46 WeakPolarHBondContact O-CG2 3.48Å; S42-V46 PolarHBondContact O-N 3.34Å |
| 43 | R | 96.8 | Very high | 96.1 | Very high | 183 Ų | 183 | 112.1 Ų | 112.1 | 69% | 0.691 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -55.9 | -45.8 | 176.4 | -171 | -179.6 | 80.3 | 152.3 | 1.3 | 112.1 | F41 V46 T47 | F41-R43 VanDerWaalsContact C-N 3.32Å; F41-R43 PolarHBondContact O-N 3.2Å; R43-V46 PolarHBondContact O-N 2.92Å; R43-T47 WeakPolarHBondContact O-CB 3.4Å; R43-T47 PolarHBondContact O-N 3.48Å; R43-T47 PolarHBondContact O-OG1 3.3Å |
| 44 | H | 97.6 | Very high | 96.1 | Very high | 104 Ų | 104 | 112.7 Ų | 112.7 | 48% | 0.481 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -65.8 | -43.9 | -178.6 | -59.1 | 89.4 | 0 | 0 | 0 | 111.1 | F41 S42 V46 T47 L48 | F41-H44 AromaticContact CD1-ND1 3.82Å; F41-H44 WeakPolarHBondContact O-CB 3.49Å; F41-H44 PolarHBondContact O-N 3.42Å; S42-H44 VanDerWaalsContact C-N 3.33Å; S42-H44 PolarHBondContact O-N 3.34Å; H44-V46 PolarHBondContact O-N 3.17Å; H44-T47 PolarHBondContact O-N 3.13Å; H44-L48 WeakPolarHBondContact O-CB 3.24Å; H44-L48 PolarHBondContact O-N 3Å |
| 45 | R | 96.4 | Very high | 96 | Very high | 120 Ų | 120 | 105.2 Ų | 105.2 | 45% | 0.453 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.6 | -46.1 | 176.1 | -177.3 | -179.2 | 61.8 | -119.9 | -5.6 | 111.6 | D39 F41 S42 L48 K49 | D39-R45 IonicContact OD1-NH1 3.65Å; D39-R45 IonicContact OD2-CZ 3.06Å; D39-R45 IonicContact OD2-NH1 2.62Å; D39-R45 PolarHBondContact OD2-NH1 3.46Å; D39-R45 IonicContact OD2-NH2 2.69Å; D39-R45 PolarHBondContact OD2-NH2 3.16Å; F41-R45 PolarHBondContact O-N 3.23Å; S42-R45 PolarHBondContact O-N 3.07Å; R45-L48 PolarHBondContact O-N 3.41Å; R45-K49 WeakPolarHBondContact O-CG 3.49Å; R45-K49 PolarHBondContact O-N 3Å |
| 46 | V | 96 | Very high | 95.8 | Very high | 72 Ų | 72 | 104.6 Ų | 104.6 | 44% | 0.436 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -65.2 | -44.7 | -179.8 | 173.3 | 0 | 0 | 0 | 0 | 111.2 | S42 R43 H44 L48 K49 K50 | S42-V46 WeakPolarHBondContact O-CG2 3.48Å; S42-V46 PolarHBondContact O-N 3.34Å; R43-V46 PolarHBondContact O-N 2.92Å; H44-V46 PolarHBondContact O-N 3.17Å; V46-L48 VanDerWaalsContact C-N 3.32Å; V46-L48 PolarHBondContact O-N 3.44Å; V46-K49 PolarHBondContact O-N 3.41Å; V46-K50 PolarHBondContact O-N 3.42Å |
| 47 | T | 97.4 | Very high | 95.7 | Very high | 74 Ų | 74 | 108.9 Ų | 108.9 | 45% | 0.454 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -60.2 | -41.9 | 177.2 | -60.5 | 0 | 0 | 0 | 0 | 112.1 | R43 H44 K50 R51 | R43-T47 WeakPolarHBondContact O-CB 3.4Å; R43-T47 PolarHBondContact O-N 3.48Å; R43-T47 PolarHBondContact O-OG1 3.3Å; H44-T47 PolarHBondContact O-N 3.13Å; T47-K50 PolarHBondContact O-N 3.38Å; T47-R51 PolarHBondContact O-N 2.99Å |
| 48 | L | 97.4 | Very high | 95.5 | Very high | 95 Ų | 95 | 107.4 Ų | 107.4 | 50% | 0.497 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.8 | -46.3 | 177.5 | -165.6 | 151.3 | 0 | 0 | 0 | 111 | H44 R45 V46 K50 R51 F52 | H44-L48 WeakPolarHBondContact O-CB 3.24Å; H44-L48 PolarHBondContact O-N 3Å; R45-L48 PolarHBondContact O-N 3.41Å; V46-L48 VanDerWaalsContact C-N 3.32Å; V46-L48 PolarHBondContact O-N 3.44Å; L48-K50 VanDerWaalsContact C-N 3.29Å; L48-K50 PolarHBondContact O-N 3Å; L48-R51 WeakPolarHBondContact O-CB 3.48Å; L48-R51 PolarHBondContact O-N 3.47Å; L48-R51 VanDerWaalsContact O-N 3.16Å; L48-F52 HydrophobicContact CD2-CD2 3.6Å; L48-F52 HydrophobicContact CD2-CE2 3.7Å; L48-F52 HydrophobicContact CG-CD2 4.11Å; L48-F52 HydrophobicContact CG-CE2 3.94Å; L48-F52 VanDerWaalsContact O-CD2 3.3Å; L48-F52 WeakPolarHBondContact O-CD2 3.28Å; L48-F52 PolarHBondContact O-N 2.62Å |
| 49 | K | 96.6 | Very high | 95.1 | Very high | 88 Ų | 88 | 107.2 Ų | 107.2 | 38% | 0.383 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -56.3 | -43.4 | 174.3 | -75.8 | -175.2 | 174.3 | -166.9 | 0 | 112.2 | R45 V46 R51 F52 G53 L54 L55 | R45-K49 WeakPolarHBondContact O-CG 3.49Å; R45-K49 PolarHBondContact O-N 3Å; V46-K49 PolarHBondContact O-N 3.41Å; K49-R51 VanDerWaalsContact C-N 3.35Å; K49-R51 PolarHBondContact O-N 2.69Å; K49-F52 PolarHBondContact O-N 3.43Å; K49-G53 PolarHBondContact O-N 3.03Å; K49-L54 HydrophobicContact CB-CB 4.25Å; K49-L54 HydrophobicContact CG-CB 4.38Å; K49-L54 PolarHBondContact O-N 3.28Å; K49-L55 HydrophobicContact CB-CD2 3.69Å; K49-L55 HydrophobicContact CB-CG 4.17Å; K49-L55 HydrophobicContact CD-CD2 4.26Å |
| 50 | K | 96.7 | Very high | 94.7 | Very high | 134 Ų | 134 | 110.4 Ų | 110.4 | 58% | 0.583 | 54% | 0.536 | S | S | * | . | H | α-helix | trans | -60.5 | -42.9 | 177.7 | -169.3 | 177.2 | -179.7 | 179.8 | 0 | 112 | V46 T47 L48 F52 G53 L55 Q58 | V46-K50 PolarHBondContact O-N 3.42Å; T47-K50 PolarHBondContact O-N 3.38Å; L48-K50 VanDerWaalsContact C-N 3.29Å; L48-K50 PolarHBondContact O-N 3Å; K50-F52 VanDerWaalsContact C-N 3.31Å; K50-F52 PolarHBondContact O-N 2.98Å; K50-G53 PolarHBondContact O-N 3.03Å; K50-L55 HydrophobicContact CB-CD1 3.74Å; K50-L55 HydrophobicContact CB-CG 4.44Å; K50-L55 HydrophobicContact CG-CD1 3.98Å; K50-Q58 PolarHBondContact O-NE2 3.4Å |
| 51 | R | 97 | Very high | 94.2 | Very high | 191 Ų | 191 | 113.6 Ų | 113.6 | 72% | 0.721 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -61.2 | -38.4 | 180 | -172.9 | -176.8 | -62.3 | 175.2 | -0.6 | 112.4 | T47 L48 K49 | T47-R51 PolarHBondContact O-N 2.99Å; L48-R51 WeakPolarHBondContact O-CB 3.48Å; L48-R51 PolarHBondContact O-N 3.47Å; L48-R51 VanDerWaalsContact O-N 3.16Å; K49-R51 VanDerWaalsContact C-N 3.35Å; K49-R51 PolarHBondContact O-N 2.69Å |
| 52 | F | 96.6 | Very high | 93.7 | Very high | 133 Ų | 133 | 111.7 Ų | 111.7 | 58% | 0.583 | 55% | 0.546 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.4 | 9.2 | -179.4 | -68.3 | -74 | 0 | 0 | 0 | 114.1 | L48 K49 K50 L54 | L48-F52 HydrophobicContact CD2-CD2 3.6Å; L48-F52 HydrophobicContact CD2-CE2 3.7Å; L48-F52 HydrophobicContact CG-CD2 4.11Å; L48-F52 HydrophobicContact CG-CE2 3.94Å; L48-F52 VanDerWaalsContact O-CD2 3.3Å; L48-F52 WeakPolarHBondContact O-CD2 3.28Å; L48-F52 PolarHBondContact O-N 2.62Å; K49-F52 PolarHBondContact O-N 3.43Å; K50-F52 VanDerWaalsContact C-N 3.31Å; K50-F52 PolarHBondContact O-N 2.98Å; F52-L54 HydrophobicContact CB-CD1 3.99Å; F52-L54 HydrophobicContact CB-CG 3.87Å; F52-L54 PolarHBondContact O-N 3.37Å |
| 53 | G | 94.6 | Very high | 93.1 | Very high | 23 Ų | 23 | 117.2 Ų | 117.2 | 24% | 0.237 | 57% | 0.57 | C | S | . | * | T | Hydrogen-bonded Turn | trans | 69.7 | 18.7 | 178.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | K49 K50 Q58 Q59 | K49-G53 PolarHBondContact O-N 3.03Å; K50-G53 PolarHBondContact O-N 3.03Å; G53-Q58 VanDerWaalsContact C-OE1 3.27Å; G53-Q58 VanDerWaalsContact CA-OE1 3.24Å; G53-Q59 PolarHBondContact O-NE2 3.35Å |
| 54 | L | 94.1 | Very high | 92 | Very high | 112 Ų | 112 | 119.6 Ų | 119.6 | 59% | 0.586 | 60% | 0.595 | S | S | * | * | trans | -89.4 | 0.1 | -172.4 | -59.8 | 176.9 | 0 | 0 | 0 | 113.6 | K49 F52 | K49-L54 HydrophobicContact CB-CB 4.25Å; K49-L54 HydrophobicContact CG-CB 4.38Å; K49-L54 PolarHBondContact O-N 3.28Å; F52-L54 HydrophobicContact CB-CD1 3.99Å; F52-L54 HydrophobicContact CB-CG 3.87Å; F52-L54 PolarHBondContact O-N 3.37Å | ||
| 55 | L | 93.4 | Very high | 91.7 | Very high | 38 Ų | 38 | 120.4 Ų | 120.4 | 20% | 0.199 | 60% | 0.601 | C | S | . | * | S | Bend | trans | -76.6 | 139.9 | 174.9 | -61 | 175.8 | 0 | 0 | 0 | 109.9 | K49 K50 T57 Q58 Q59 | K49-L55 HydrophobicContact CB-CD2 3.69Å; K49-L55 HydrophobicContact CB-CG 4.17Å; K49-L55 HydrophobicContact CD-CD2 4.26Å; K50-L55 HydrophobicContact CB-CD1 3.74Å; K50-L55 HydrophobicContact CB-CG 4.44Å; K50-L55 HydrophobicContact CG-CD1 3.98Å; L55-T57 PolarHBondContact O-N 3.28Å; L55-T57 VanDerWaalsContact O-N 3.17Å; L55-Q58 HydrophobicContact CB-CG 4.05Å; L55-Q58 VanDerWaalsContact CB-OE1 3.31Å; L55-Q58 VanDerWaalsContact N-OE1 3.16Å; L55-Q58 WeakPolarHBondContact O-CB 2.91Å; L55-Q58 PolarHBondContact O-N 3.06Å; L55-Q59 PolarHBondContact O-N 3.37Å |
| 56 | L | 90.3 | Very high | 91.5 | Very high | 160 Ų | 160 | 120.4 Ų | 120.4 | 84% | 0.838 | 61% | 0.609 | S | S | * | * | G | 310 helix | trans | -57.8 | -30.8 | 175.5 | -67.1 | 173.2 | 0 | 0 | 0 | 112.4 | Q58 Q59 | L56-Q58 PolarHBondContact O-N 2.98Å; L56-Q59 PolarHBondContact O-N 3.35Å |
| 57 | T | 91.9 | Very high | 91.2 | Very high | 130 Ų | 130 | 123.1 Ų | 123.1 | 80% | 0.798 | 62% | 0.618 | S | S | * | * | G | 310 helix | trans | -70.2 | -13.6 | 175.6 | 53.3 | 0 | 0 | 0 | 0 | 114 | L55 | L55-T57 PolarHBondContact O-N 3.28Å; L55-T57 VanDerWaalsContact O-N 3.17Å |
| 58 | Q | 92.3 | Very high | 90.8 | Very high | 84 Ų | 84 | 126 Ų | 126 | 39% | 0.393 | 63% | 0.628 | S | S | . | * | G | 310 helix | trans | -95 | -12.4 | 174.8 | -63.5 | 173.8 | -67.8 | 0 | 0 | 112.2 | K50 G53 L55 L56 | K50-Q58 PolarHBondContact O-NE2 3.4Å; G53-Q58 VanDerWaalsContact C-OE1 3.27Å; G53-Q58 VanDerWaalsContact CA-OE1 3.24Å; L55-Q58 HydrophobicContact CB-CG 4.05Å; L55-Q58 VanDerWaalsContact CB-OE1 3.31Å; L55-Q58 VanDerWaalsContact N-OE1 3.16Å; L55-Q58 WeakPolarHBondContact O-CB 2.91Å; L55-Q58 PolarHBondContact O-N 3.06Å; L56-Q58 PolarHBondContact O-N 2.98Å |
| 59 | Q | 87.6 | Confident | 90.4 | Very high | 107 Ų | 107 | 127.9 Ų | 127.9 | 50% | 0.5 | 64% | 0.636 | S | S | . | * | S | Bend | trans | -87.3 | 150.3 | -179.7 | -63.6 | -63.7 | -37.3 | 0 | 0 | 110.3 | G53 L55 L56 | G53-Q59 PolarHBondContact O-NE2 3.35Å; L55-Q59 PolarHBondContact O-N 3.37Å; L56-Q59 PolarHBondContact O-N 3.35Å |
| 60 | P | 87.6 | Confident | 90 | Very high | 110 Ų | 110 | 130.6 Ų | 130.6 | 71% | 0.714 | 65% | 0.653 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 149.7 | 173.9 | 26.7 | -34.2 | 0 | 0 | 0 | 110 | ||
| 61 | R | 86.3 | Confident | 89.5 | Confident | 226 Ų | 226 | 130.4 Ų | 130.4 | 85% | 0.853 | 66% | 0.658 | S | S | * | * | P | Polyproline II helix | trans | -58 | 129.3 | 176.6 | -168.7 | 177 | -175.3 | -173.5 | 0.4 | 108.4 | I63 | R61-I63 PolarHBondContact O-N 3.02Š|
| 62 | P | 84.8 | Confident | 89 | Confident | 107 Ų | 107 | 125.7 Ų | 125.7 | 70% | 0.695 | 65% | 0.653 | S | S | * | * | P | Polyproline II helix | trans | -58.3 | 129.9 | 176.1 | 22.3 | -30.9 | 0 | 0 | 0 | 108.8 | L64 | P62-L64 PolarHBondContact O-N 2.91Š|
| 63 | I | 84.3 | Confident | 88.3 | Confident | 171 Ų | 171 | 125.1 Ų | 125.1 | 88% | 0.877 | 66% | 0.659 | S | S | * | * | P | Polyproline II helix | trans | -76.6 | 120.3 | 171 | -50.6 | 171.8 | 0 | 0 | 0 | 105.1 | R61 | R61-I63 PolarHBondContact O-N 3.02Š|
| 64 | L | 73.1 | Confident | 87.8 | Confident | 233 Ų | 233 | 134.4 Ų | 134.4 | 100% | 1.22 | 70% | 0.697 | S | S | * | * | trans | -72.8 | 0 | 176 | -69.4 | 174.9 | 0 | 0 | 0 | 110.8 | P62 | P62-L64 PolarHBondContact O-N 2.91Š|
Retrieved 64 of 64 residues in 105.8 ms
(Link to these results)