| 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 | 44.1 | Very low | 67.6 | Low | 242 Ų | 242 | 124.4 Ų | 124.4 | 100% | 1.192 | 65% | 0.646 | S | S | * | * | 0 | 87.6 | 0 | -73.4 | -56.8 | -164.7 | 0 | 0 | 108.3 | |||||
| 2 | Q | 48.2 | Very low | 68.9 | Low | 189 Ų | 189 | 119.8 Ų | 119.8 | 88% | 0.883 | 62% | 0.619 | S | S | * | * | trans | -78.2 | 133.1 | -176.9 | -152.3 | 161.2 | 5.6 | 0 | 0 | 107.7 | L4 | Q2-L4 PolarHBondContact O-N 2.92Š| ||
| 3 | I | 57.7 | Low | 70.3 | Confident | 118 Ų | 118 | 115.5 Ų | 115.5 | 61% | 0.605 | 59% | 0.593 | S | S | * | * | trans | -25.7 | 90.3 | 174.2 | -54 | 166.6 | 0 | 0 | 0 | 113 | E5 | I3-E5 VanDerWaalsContact C-N 3.31Š| ||
| 4 | L | 58.8 | Low | 71.6 | Confident | 171 Ų | 171 | 112.3 Ų | 112.3 | 90% | 0.895 | 58% | 0.578 | S | S | * | * | S | Bend | trans | -75.9 | -24.5 | 175.7 | -162.4 | 73 | 0 | 0 | 0 | 111.5 | Q2 | Q2-L4 PolarHBondContact O-N 2.92Š|
| 5 | E | 66.7 | Low | 72.8 | Confident | 129 Ų | 129 | 105.9 Ų | 105.9 | 60% | 0.603 | 55% | 0.546 | S | S | * | . | S | Bend | trans | -124.3 | 8.9 | -172 | -61.5 | -165.8 | 162.5 | 0 | 0 | 115.3 | I3 I7 L39 | I3-E5 VanDerWaalsContact C-N 3.31Å; E5-I7 HydrophobicContact CB-CD1 4.14Å; E5-I7 HydrophobicContact CB-CG1 4.27Å; E5-I7 PolarHBondContact O-N 3.27Å; E5-L39 VanDerWaalsContact OE2-CD2 3.23Å; E5-L39 WeakPolarHBondContact OE2-CD2 3.23Å |
| 6 | G | 74.9 | Confident | 73.9 | Confident | 60 Ų | 60 | 101.8 Ų | 101.8 | 62% | 0.619 | 52% | 0.522 | S | S | * | . | S | Bend | trans | 78 | -4.2 | -177.7 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||
| 7 | I | 74.5 | Confident | 74.7 | Confident | 34 Ų | 34 | 103.3 Ų | 103.3 | 17% | 0.174 | 53% | 0.531 | C | S | . | . | trans | -85.5 | 123.5 | -171.9 | -55.8 | 168.8 | 0 | 0 | 0 | 110.9 | E5 D11 Q12 L39 C41 | E5-I7 HydrophobicContact CB-CD1 4.14Å; E5-I7 HydrophobicContact CB-CG1 4.27Å; E5-I7 PolarHBondContact O-N 3.27Å; I7-D11 HydrophobicContact CG2-CB 4.08Å; I7-Q12 HydrophobicContact CB-CG 4.22Å; I7-Q12 HydrophobicContact CG2-CG 3.73Å; I7-Q12 PolarHBondContact O-NE2 3.26Å; I7-L39 HydrophobicContact CD1-CD2 4.06Å; I7-C41 HydrophobicContact CD1-CB 4.34Å; I7-C41 HydrophobicContact CG2-CB 4.43Å | ||
| 8 | P | 79.5 | Confident | 75.3 | Confident | 60 Ų | 60 | 101.3 Ų | 101.3 | 39% | 0.39 | 54% | 0.54 | S | S | . | . | trans | -58.3 | 141 | 174.3 | -23.4 | 33.9 | 0 | 0 | 0 | 112.2 | K10 D11 Q12 | P8-K10 HydrophobicContact CB-CG 3.9Å; P8-K10 PolarHBondContact O-N 2.86Å; P8-D11 PolarHBondContact O-N 3.11Å; P8-Q12 PolarHBondContact O-N 3.2Å | ||
| 9 | I | 79.5 | Confident | 75.9 | Confident | 140 Ų | 140 | 104.2 Ų | 104.2 | 72% | 0.718 | 55% | 0.547 | S | S | * | . | G | 310 helix | trans | -51.3 | -37.8 | -177.6 | -63.7 | 170.2 | 0 | 0 | 0 | 112.4 | D11 Q12 | I9-D11 PolarHBondContact O-N 3.24Å; I9-Q12 PolarHBondContact O-N 3.47Å |
| 10 | K | 79.5 | Confident | 76.5 | Confident | 172 Ų | 172 | 102.1 Ų | 102.1 | 75% | 0.748 | 54% | 0.54 | S | S | * | . | G | 310 helix | trans | -62.3 | -24.5 | 178.3 | 60.2 | 170.5 | -171 | 178.7 | 0 | 114.7 | P8 | P8-K10 HydrophobicContact CB-CG 3.9Å; P8-K10 PolarHBondContact O-N 2.86Å |
| 11 | D | 80 | Confident | 77 | Confident | 53 Ų | 53 | 99.2 Ų | 99.2 | 28% | 0.283 | 53% | 0.525 | S | S | . | . | G | 310 helix | trans | -101.9 | -7.8 | -175.3 | -59.4 | -37.9 | 0 | 0 | 0 | 111.8 | I7 P8 I9 C41 R42 | I7-D11 HydrophobicContact CG2-CB 4.08Å; P8-D11 PolarHBondContact O-N 3.11Å; I9-D11 PolarHBondContact O-N 3.24Å; D11-C41 WeakPolarHBondContact O-CA 3.36Å; D11-R42 PolarHBondContact O-N 3.23Å |
| 12 | Q | 84.1 | Confident | 78.9 | Confident | 69 Ų | 69 | 94.8 Ų | 94.8 | 32% | 0.322 | 50% | 0.501 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.4 | 134.4 | 175.1 | -62.4 | 174.6 | 14.7 | 0 | 0 | 110.4 | I7 P8 I9 L39 | I7-Q12 HydrophobicContact CB-CG 4.22Å; I7-Q12 HydrophobicContact CG2-CG 3.73Å; I7-Q12 PolarHBondContact O-NE2 3.26Å; P8-Q12 PolarHBondContact O-N 3.2Å; I9-Q12 PolarHBondContact O-N 3.47Å; Q12-L39 HydrophobicContact CB-CD1 4.08Å; Q12-L39 HydrophobicContact CG-CD1 4.02Å |
| 13 | F | 86.4 | Confident | 80.4 | Confident | 64 Ų | 64 | 91.4 Ų | 91.4 | 28% | 0.281 | 51% | 0.505 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -132 | 107.9 | 178.7 | -174.2 | -109 | 0 | 0 | 0 | 108.6 | T15 P20 C40 R42 | F13-T15 HydrophobicContact CD1-CG2 3.74Å; F13-T15 HydrophobicContact CE1-CG2 3.43Å; F13-T15 VanDerWaalsContact CE1-CG2 3.43Å; F13-T15 HydrophobicContact CZ-CG2 4.3Å; F13-P20 HydrophobicContact CE1-CB 4.3Å; F13-P20 HydrophobicContact CE2-CB 3.83Å; F13-P20 HydrophobicContact CZ-CB 3.5Å; F13-P20 VanDerWaalsContact CZ-CB 3.5Å; F13-P20 HydrophobicContact CZ-CG 4.41Å; F13-C40 WeakPolarHBondContact CA-O 3.47Å; F13-C40 WeakPolarHBondContact CB-O 3.23Å; F13-C40 HydrophobicContact CD1-CB 4.46Å; F13-C40 PolarHBondContact N-O 3.17Å; F13-C40 PolarHBondContact O-N 3.31Å; F13-R42 HydrophobicContact CB-CG 4.44Å |
| 14 | L | 89 | Confident | 81.7 | Confident | 71 Ų | 71 | 90 Ų | 90 | 37% | 0.372 | 50% | 0.499 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89.8 | 132.4 | -178.4 | -61.9 | 174.3 | 0 | 0 | 0 | 110.2 | L21 I37 D38 L39 | L14-L21 HydrophobicContact CB-CB 4.21Å; L14-L21 HydrophobicContact CB-CD1 4.03Å; L14-L21 HydrophobicContact CB-CG 4.36Å; L14-L21 PolarHBondContact O-N 2.84Å; L14-I37 HydrophobicContact CB-CG2 4.06Å; L14-I37 HydrophobicContact CD2-CG2 3.92Å; L14-I37 HydrophobicContact CG-CG2 4.48Å; L14-D38 WeakPolarHBondContact CA-O 3.38Å; L14-L39 HydrophobicContact CD2-CB 3.98Å; L14-L39 HydrophobicContact CD2-CD1 3.66Å; L14-L39 HydrophobicContact CD2-CG 4.23Å |
| 15 | T | 89.9 | Confident | 82.8 | Confident | 16 Ų | 16 | 85.7 Ų | 85.7 | 10% | 0.098 | 48% | 0.48 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -129.7 | 145.4 | 174.9 | 54.1 | 0 | 0 | 0 | 0 | 111.6 | F13 K19 D38 | F13-T15 HydrophobicContact CD1-CG2 3.74Å; F13-T15 HydrophobicContact CE1-CG2 3.43Å; F13-T15 VanDerWaalsContact CE1-CG2 3.43Å; F13-T15 HydrophobicContact CZ-CG2 4.3Å; T15-K19 CarbonylContact C-O 3.53Å; T15-K19 WeakPolarHBondContact CA-O 3.46Å; T15-D38 PolarHBondContact N-O 2.9Å; T15-D38 PolarHBondContact O-N 2.89Å; T15-D38 WeakPolarHBondContact OG1-CB 3.21Å |
| 16 | Y | 90.5 | Very high | 83.6 | Confident | 41 Ų | 41 | 85.4 Ų | 85.4 | 16% | 0.161 | 48% | 0.48 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126.8 | 124.4 | 170.9 | 176.8 | -122 | 0 | 0 | 0 | 109 | G18 K19 G30 L31 C35 T36 | Y16-G18 PolarHBondContact O-N 2.86Å; Y16-K19 PolarHBondContact N-O 2.74Å; Y16-K19 WeakPolarHBondContact O-CB 3.43Å; Y16-K19 PolarHBondContact O-N 3.05Å; Y16-G30 WeakPolarHBondContact CE1-O 3.4Å; Y16-L31 HydrophobicContact CD1-CD2 3.57Å; Y16-L31 HydrophobicContact CD2-CD2 4.08Å; Y16-L31 HydrophobicContact CE1-CD2 4Å; Y16-L31 HydrophobicContact CE2-CD2 4.49Å; Y16-L31 HydrophobicContact CG-CD2 3.59Å; Y16-C35 HydrophobicContact CD2-CB 4.46Å; Y16-C35 HydrophobicContact CE2-CB 3.72Å; Y16-T36 WeakPolarHBondContact CD2-O 3.4Å |
| 17 | N | 87.6 | Confident | 83.9 | Confident | 127 Ų | 127 | 88.4 Ų | 88.4 | 68% | 0.679 | 49% | 0.487 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.1 | 41.1 | -175.1 | -68.9 | -38.8 | 0 | 0 | 0 | 113.2 | K19 | N17-K19 PolarHBondContact O-N 3.39Š|
| 18 | G | 84.3 | Confident | 84.2 | Confident | 67 Ų | 67 | 92.1 Ų | 92.1 | 69% | 0.691 | 51% | 0.507 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 73.1 | 1.4 | -178.3 | 0 | 0 | 0 | 0 | 0 | 115.6 | Y16 | Y16-G18 PolarHBondContact O-N 2.86Š|
| 19 | K | 86.5 | Confident | 84.4 | Confident | 156 Ų | 156 | 91.4 Ų | 91.4 | 68% | 0.678 | 50% | 0.499 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -95.8 | 131.5 | 174.5 | -66.2 | -178.4 | -179.3 | 176.5 | 0 | 110.5 | T15 Y16 N17 L21 | T15-K19 CarbonylContact C-O 3.53Å; T15-K19 WeakPolarHBondContact CA-O 3.46Å; Y16-K19 PolarHBondContact N-O 2.74Å; Y16-K19 WeakPolarHBondContact O-CB 3.43Å; Y16-K19 PolarHBondContact O-N 3.05Å; N17-K19 PolarHBondContact O-N 3.39Å; K19-L21 PolarHBondContact O-N 2.88Å |
| 20 | P | 88.7 | Confident | 84.6 | Confident | 63 Ų | 63 | 86.8 Ų | 86.8 | 41% | 0.409 | 49% | 0.486 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -64.6 | 130.4 | 173.9 | 26.7 | -33 | 0 | 0 | 0 | 111 | F13 Q22 | F13-P20 HydrophobicContact CE1-CB 4.3Å; F13-P20 HydrophobicContact CE2-CB 3.83Å; F13-P20 HydrophobicContact CZ-CB 3.5Å; F13-P20 VanDerWaalsContact CZ-CB 3.5Å; F13-P20 HydrophobicContact CZ-CG 4.41Å; P20-Q22 PolarHBondContact O-N 2.89Å |
| 21 | L | 87.9 | Confident | 85 | Confident | 41 Ų | 41 | 79.8 Ų | 79.8 | 22% | 0.215 | 46% | 0.457 | C | S | . | . | P | Polyproline II helix | trans | -74.2 | 123.6 | 172.8 | -61.9 | -175.8 | 0 | 0 | 0 | 108.9 | L14 K19 L29 L31 I37 | L14-L21 HydrophobicContact CB-CB 4.21Å; L14-L21 HydrophobicContact CB-CD1 4.03Å; L14-L21 HydrophobicContact CB-CG 4.36Å; L14-L21 PolarHBondContact O-N 2.84Å; K19-L21 PolarHBondContact O-N 2.88Å; L21-L29 HydrophobicContact CD2-CB 4.29Å; L21-L29 HydrophobicContact CD2-CD1 4.29Å; L21-L29 HydrophobicContact CD2-CD2 4.21Å; L21-L29 HydrophobicContact CD2-CG 4.5Å; L21-L31 HydrophobicContact CD2-CD2 4.3Å; L21-I37 HydrophobicContact CD1-CD1 4.13Å; L21-I37 HydrophobicContact CD1-CG1 4.26Å; L21-I37 HydrophobicContact CD1-CG2 3.88Å |
| 22 | Q | 82.9 | Confident | 85.3 | Confident | 149 Ų | 149 | 81.6 Ų | 81.6 | 70% | 0.696 | 47% | 0.47 | S | S | * | . | P | Polyproline II helix | trans | -101 | 166.5 | 171.5 | -64.5 | -175.4 | -5.6 | 0 | 0 | 109.2 | P20 D24 | P20-Q22 PolarHBondContact O-N 2.89Å; Q22-D24 VanDerWaalsContact C-N 3.29Å; Q22-D24 PolarHBondContact O-N 3.49Å |
| 23 | A | 80.1 | Confident | 85.5 | Confident | 118 Ų | 118 | 86.1 Ų | 86.1 | 98% | 0.975 | 49% | 0.491 | S | S | * | . | S | Bend | trans | -70.5 | 86 | 177.7 | 0 | 0 | 0 | 0 | 0 | 110.4 | ||
| 24 | D | 83.8 | Confident | 85.5 | Confident | 90 Ų | 90 | 93.7 Ų | 93.7 | 48% | 0.481 | 52% | 0.52 | S | S | . | . | S | Bend | trans | -143.2 | 169.6 | 177.4 | -159.1 | -8.5 | 0 | 0 | 0 | 110.2 | Q22 N28 L29 | Q22-D24 VanDerWaalsContact C-N 3.29Å; Q22-D24 PolarHBondContact O-N 3.49Å; D24-N28 PolarHBondContact OD1-ND2 3.17Å; D24-N28 VanDerWaalsContact OD2-CB 3.23Å; D24-N28 WeakPolarHBondContact OD2-CB 3.36Å; D24-N28 PolarHBondContact OD2-ND2 3.18Å; D24-L29 HydrophobicContact CB-CD1 4.45Å; D24-L29 HydrophobicContact CB-CD2 4.2Å; D24-L29 HydrophobicContact CB-CG 4.15Å; D24-L29 WeakPolarHBondContact O-CD1 3.38Å |
| 25 | T | 83.4 | Confident | 85.5 | Confident | 79 Ų | 79 | 92 Ų | 92 | 49% | 0.485 | 51% | 0.513 | S | S | . | . | trans | -64.2 | 147.5 | 176.9 | 59.3 | 0 | 0 | 0 | 0 | 111.6 | T27 N28 L29 | T25-T27 PolarHBondContact O-N 3.46Å; T25-T27 VanDerWaalsContact O-N 3.17Å; T25-N28 PolarHBondContact O-N 2.84Å; T25-N28 PolarHBondContact OG1-ND2 3.12Å; T25-N28 VanDerWaalsContact OG1-ND2 3.08Å; T25-L29 PolarHBondContact O-N 3.08Å; T25-L29 VanDerWaalsContact O-N 3.12Å | ||
| 26 | M | 83 | Confident | 85.4 | Confident | 124 Ų | 124 | 96.4 Ų | 96.4 | 61% | 0.611 | 54% | 0.54 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.3 | -37.2 | -178.3 | -66 | 179 | 67.6 | 0 | 0 | 112.5 | L29 G30 L31 | M26-L29 PolarHBondContact O-N 3.42Å; M26-G30 PolarHBondContact O-N 3.41Å; M26-L31 HydrophobicContact CB-CB 4.29Å; M26-L31 HydrophobicContact CB-CD1 4.43Å; M26-L31 HydrophobicContact CE-CB 4.44Å; M26-L31 HydrophobicContact CG-CD1 4.32Å; M26-L31 PolarHBondContact O-N 3.05Å |
| 27 | T | 80.5 | Confident | 85.4 | Confident | 123 Ų | 123 | 97.9 Ų | 97.9 | 76% | 0.755 | 55% | 0.55 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.5 | -43.6 | 177.8 | -39.5 | 0 | 0 | 0 | 0 | 112 | T25 L29 G30 | T25-T27 PolarHBondContact O-N 3.46Å; T25-T27 VanDerWaalsContact O-N 3.17Å; T27-L29 VanDerWaalsContact C-N 3.3Å; T27-L29 PolarHBondContact O-N 2.9Å; T27-G30 PolarHBondContact O-N 3.18Å; T27-G30 VanDerWaalsContact O-N 3.13Å |
| 28 | N | 82.1 | Confident | 85.5 | Confident | 111 Ų | 111 | 95.8 Ų | 95.8 | 59% | 0.594 | 54% | 0.539 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.3 | -30.9 | 178.9 | -70.9 | -10.2 | 0 | 0 | 0 | 112.2 | D24 T25 G30 | D24-N28 PolarHBondContact OD1-ND2 3.17Å; D24-N28 VanDerWaalsContact OD2-CB 3.23Å; D24-N28 WeakPolarHBondContact OD2-CB 3.36Å; D24-N28 PolarHBondContact OD2-ND2 3.18Å; T25-N28 PolarHBondContact O-N 2.84Å; T25-N28 PolarHBondContact OG1-ND2 3.12Å; T25-N28 VanDerWaalsContact OG1-ND2 3.08Å; N28-G30 PolarHBondContact O-N 3.44Å |
| 29 | L | 82.5 | Confident | 85.6 | Confident | 45 Ų | 45 | 95.9 Ų | 95.9 | 24% | 0.236 | 52% | 0.523 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -78.7 | -5.7 | 175 | -63.6 | 170.1 | 0 | 0 | 0 | 112.9 | L21 D24 T25 M26 T27 L31 | L21-L29 HydrophobicContact CD2-CB 4.29Å; L21-L29 HydrophobicContact CD2-CD1 4.29Å; L21-L29 HydrophobicContact CD2-CD2 4.21Å; L21-L29 HydrophobicContact CD2-CG 4.5Å; D24-L29 HydrophobicContact CB-CD1 4.45Å; D24-L29 HydrophobicContact CB-CD2 4.2Å; D24-L29 HydrophobicContact CB-CG 4.15Å; D24-L29 WeakPolarHBondContact O-CD1 3.38Å; T25-L29 PolarHBondContact O-N 3.08Å; T25-L29 VanDerWaalsContact O-N 3.12Å; M26-L29 PolarHBondContact O-N 3.42Å; T27-L29 VanDerWaalsContact C-N 3.3Å; T27-L29 PolarHBondContact O-N 2.9Å; L29-L31 VanDerWaalsContact C-N 3.27Å; L29-L31 HydrophobicContact CB-CD1 4.12Å; L29-L31 HydrophobicContact CB-CG 3.88Å; L29-L31 HydrophobicContact CD1-CD1 4.25Å; L29-L31 PolarHBondContact O-N 3.13Å |
| 30 | G | 84.9 | Confident | 85.5 | Confident | 43 Ų | 43 | 91.3 Ų | 91.3 | 44% | 0.443 | 51% | 0.51 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 68.9 | 24.4 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | Y16 M26 T27 N28 T32 | Y16-G30 WeakPolarHBondContact CE1-O 3.4Å; M26-G30 PolarHBondContact O-N 3.41Å; T27-G30 PolarHBondContact O-N 3.18Å; T27-G30 VanDerWaalsContact O-N 3.13Å; N28-G30 PolarHBondContact O-N 3.44Å; G30-T32 PolarHBondContact O-N 3.34Å |
| 31 | L | 87.2 | Confident | 85.2 | Confident | 26 Ų | 26 | 91.8 Ų | 91.8 | 14% | 0.136 | 51% | 0.514 | C | S | . | . | P | Polyproline II helix | trans | -79.4 | 118.7 | 179.8 | -59.8 | 176.8 | 0 | 0 | 0 | 109.5 | Y16 L21 M26 L29 | Y16-L31 HydrophobicContact CD1-CD2 3.57Å; Y16-L31 HydrophobicContact CD2-CD2 4.08Å; Y16-L31 HydrophobicContact CE1-CD2 4Å; Y16-L31 HydrophobicContact CE2-CD2 4.49Å; Y16-L31 HydrophobicContact CG-CD2 3.59Å; L21-L31 HydrophobicContact CD2-CD2 4.3Å; M26-L31 HydrophobicContact CB-CB 4.29Å; M26-L31 HydrophobicContact CB-CD1 4.43Å; M26-L31 HydrophobicContact CE-CB 4.44Å; M26-L31 HydrophobicContact CG-CD1 4.32Å; M26-L31 PolarHBondContact O-N 3.05Å; L29-L31 VanDerWaalsContact C-N 3.27Å; L29-L31 HydrophobicContact CB-CD1 4.12Å; L29-L31 HydrophobicContact CB-CG 3.88Å; L29-L31 HydrophobicContact CD1-CD1 4.25Å; L29-L31 PolarHBondContact O-N 3.13Å |
| 32 | T | 86.6 | Confident | 84.6 | Confident | 90 Ų | 90 | 97.9 Ų | 97.9 | 55% | 0.552 | 54% | 0.535 | S | S | * | . | P | Polyproline II helix | trans | -95 | 166.9 | 172.8 | 57.8 | 0 | 0 | 0 | 0 | 110.5 | G30 Y34 C35 | G30-T32 PolarHBondContact O-N 3.34Å; T32-Y34 PolarHBondContact O-N 3.46Å; T32-C35 WeakPolarHBondContact O-CB 3.49Å; T32-C35 PolarHBondContact O-N 3Å; T32-C35 PolarHBondContact O-SG 3.45Å |
| 33 | E | 86.9 | Confident | 83.9 | Confident | 164 Ų | 164 | 98.5 Ų | 98.5 | 77% | 0.766 | 54% | 0.542 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.7 | 141.8 | 168.5 | -64.3 | -173.7 | 169.3 | 0 | 0 | 110.3 | C35 | E33-C35 PolarHBondContact O-N 3.22Š|
| 34 | Y | 86.7 | Confident | 83.3 | Confident | 224 Ų | 224 | 99.7 Ų | 99.7 | 88% | 0.878 | 54% | 0.536 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 61.1 | 19.7 | -178.8 | -48 | -78.4 | 0 | 0 | 0 | 115.4 | T32 | T32-Y34 PolarHBondContact O-N 3.46Š|
| 35 | C | 88.7 | Confident | 82.4 | Confident | 35 Ų | 35 | 98.6 Ų | 98.6 | 24% | 0.236 | 55% | 0.546 | C | S | . | . | trans | -65.8 | 142.8 | 171.3 | 65 | 0 | 0 | 0 | 0 | 111.7 | Y16 T32 E33 | Y16-C35 HydrophobicContact CD2-CB 4.46Å; Y16-C35 HydrophobicContact CE2-CB 3.72Å; T32-C35 WeakPolarHBondContact O-CB 3.49Å; T32-C35 PolarHBondContact O-N 3Å; T32-C35 PolarHBondContact O-SG 3.45Å; E33-C35 PolarHBondContact O-N 3.22Å | ||
| 36 | T | 89.5 | Confident | 81.4 | Confident | 109 Ų | 109 | 97.8 Ų | 97.8 | 67% | 0.669 | 55% | 0.554 | S | S | * | * | trans | -91.1 | 125.2 | 174.3 | -53.5 | 0 | 0 | 0 | 0 | 109.4 | Y16 | Y16-T36 WeakPolarHBondContact CD2-O 3.4Š| ||
| 37 | I | 89.9 | Confident | 80.5 | Confident | 71 Ų | 71 | 102.5 Ų | 102.5 | 36% | 0.364 | 57% | 0.571 | S | S | . | * | trans | -106 | 131.4 | 174.9 | -61.9 | 168 | 0 | 0 | 0 | 107.9 | L14 L21 | L14-I37 HydrophobicContact CB-CG2 4.06Å; L14-I37 HydrophobicContact CD2-CG2 3.92Å; L14-I37 HydrophobicContact CG-CG2 4.48Å; L21-I37 HydrophobicContact CD1-CD1 4.13Å; L21-I37 HydrophobicContact CD1-CG1 4.26Å; L21-I37 HydrophobicContact CD1-CG2 3.88Å | ||
| 38 | D | 89.5 | Confident | 79.9 | Confident | 84 Ų | 84 | 102.8 Ų | 102.8 | 45% | 0.449 | 57% | 0.572 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -88.3 | 123.2 | 174.9 | -60.7 | -46.5 | 0 | 0 | 0 | 109.3 | L14 T15 | L14-D38 WeakPolarHBondContact CA-O 3.38Å; T15-D38 PolarHBondContact N-O 2.9Å; T15-D38 PolarHBondContact O-N 2.89Å; T15-D38 WeakPolarHBondContact OG1-CB 3.21Å |
| 39 | L | 86.7 | Confident | 79.3 | Confident | 68 Ų | 68 | 106.8 Ų | 106.8 | 36% | 0.356 | 59% | 0.587 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -95.1 | 116.3 | 169.7 | 179.6 | 121.8 | 0 | 0 | 0 | 108.9 | E5 I7 Q12 L14 | E5-L39 VanDerWaalsContact OE2-CD2 3.23Å; E5-L39 WeakPolarHBondContact OE2-CD2 3.23Å; I7-L39 HydrophobicContact CD1-CD2 4.06Å; Q12-L39 HydrophobicContact CB-CD1 4.08Å; Q12-L39 HydrophobicContact CG-CD1 4.02Å; L14-L39 HydrophobicContact CD2-CB 3.98Å; L14-L39 HydrophobicContact CD2-CD1 3.66Å; L14-L39 HydrophobicContact CD2-CG 4.23Å |
| 40 | C | 84.4 | Confident | 78.9 | Confident | 61 Ų | 61 | 107.4 Ų | 107.4 | 41% | 0.412 | 60% | 0.604 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -114.9 | 150.6 | 175.8 | -69.2 | 0 | 0 | 0 | 0 | 110.1 | F13 | F13-C40 WeakPolarHBondContact CA-O 3.47Å; F13-C40 WeakPolarHBondContact CB-O 3.23Å; F13-C40 HydrophobicContact CD1-CB 4.46Å; F13-C40 PolarHBondContact N-O 3.17Å; F13-C40 PolarHBondContact O-N 3.31Å |
| 41 | C | 81.8 | Confident | 78.7 | Confident | 73 Ų | 73 | 109.6 Ų | 109.6 | 49% | 0.493 | 61% | 0.613 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -101.2 | 138.6 | 165.9 | 57.9 | 0 | 0 | 0 | 0 | 110.6 | I7 D11 L43 | I7-C41 HydrophobicContact CD1-CB 4.34Å; I7-C41 HydrophobicContact CG2-CB 4.43Å; D11-C41 WeakPolarHBondContact O-CA 3.36Å; C41-L43 PolarHBondContact O-N 2.86Å |
| 42 | R | 75 | Confident | 78.6 | Confident | 169 Ų | 169 | 115.8 Ų | 115.8 | 64% | 0.638 | 65% | 0.645 | S | S | * | * | P | Polyproline II helix | trans | -71 | 128 | 172.2 | -67 | -180 | 179.4 | 173.3 | 1.2 | 109.4 | D11 F13 V44 | D11-R42 PolarHBondContact O-N 3.23Å; F13-R42 HydrophobicContact CB-CG 4.44Å; R42-V44 PolarHBondContact O-N 3.3Å |
| 43 | L | 69.4 | Low | 78.5 | Confident | 162 Ų | 162 | 115.7 Ų | 115.7 | 85% | 0.848 | 65% | 0.654 | S | S | * | * | P | Polyproline II helix | trans | -62.8 | 118.6 | 171.9 | -69.8 | 173.1 | 0 | 0 | 0 | 109.6 | C41 G45 | C41-L43 PolarHBondContact O-N 2.86Å; L43-G45 PolarHBondContact O-N 3.43Å |
| 44 | V | 66.7 | Low | 78.5 | Confident | 142 Ų | 142 | 117.6 Ų | 117.6 | 86% | 0.861 | 65% | 0.654 | S | S | * | * | S | Bend | trans | -73.3 | 110 | 174.1 | -165.1 | 0 | 0 | 0 | 0 | 107.8 | R42 | R42-V44 PolarHBondContact O-N 3.3Š|
| 45 | G | 64.8 | Low | 78.7 | Confident | 67 Ų | 67 | 110.7 Ų | 110.7 | 69% | 0.691 | 64% | 0.643 | S | S | * | * | S | Bend | trans | 103.8 | 88.5 | -175 | 0 | 0 | 0 | 0 | 0 | 112.5 | L43 | L43-G45 PolarHBondContact O-N 3.43Š|
| 46 | G | 63.4 | Low | 78.9 | Confident | 62 Ų | 62 | 111.5 Ų | 111.5 | 64% | 0.639 | 66% | 0.658 | S | S | * | * | trans | -70.7 | 168.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | V48 | G46-V48 PolarHBondContact O-N 2.92Š| ||
| 47 | K | 64.1 | Low | 79.2 | Confident | 223 Ų | 223 | 112.1 Ų | 112.1 | 97% | 0.97 | 65% | 0.651 | S | S | * | * | trans | -57.7 | 101.8 | 170.3 | -71.3 | 178.4 | 179.7 | 175.1 | 0 | 109.6 | ||||
| 48 | V | 67.5 | Low | 79.5 | Confident | 129 Ų | 129 | 113.9 Ų | 113.9 | 78% | 0.782 | 67% | 0.665 | S | S | * | * | trans | -78.6 | 123.1 | 170.1 | 178.4 | 0 | 0 | 0 | 0 | 108.5 | G46 | G46-V48 PolarHBondContact O-N 2.92Š| ||
| 49 | H | 68.6 | Low | 79.7 | Confident | 195 Ų | 195 | 118.4 Ų | 118.4 | 90% | 0.903 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -70.8 | 139 | 173.5 | -173.9 | 79.7 | 0 | 0 | 0 | 110.3 | ||
| 50 | G | 74 | Confident | 80 | Confident | 58 Ų | 58 | 118.5 Ų | 118.5 | 60% | 0.598 | 70% | 0.697 | S | S | * | * | S | Bend | trans | 88.9 | 72.8 | -175.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | ||
| 51 | S | 81.7 | Confident | 80.5 | Confident | 90 Ų | 90 | 122.1 Ų | 122.1 | 63% | 0.629 | 71% | 0.708 | S | S | * | * | trans | -66.6 | 147.8 | 178 | 63.4 | 0 | 0 | 0 | 0 | 112.5 | A53 | S51-A53 PolarHBondContact O-N 3.09Å; S51-A53 VanDerWaalsContact O-N 3.12Å | ||
| 52 | L | 85.3 | Confident | 81.2 | Confident | 156 Ų | 156 | 122.3 Ų | 122.3 | 82% | 0.817 | 71% | 0.707 | S | S | * | * | G | 310 helix | trans | -71.2 | 1.5 | 174.1 | -68.6 | 172.8 | 0 | 0 | 0 | 113.5 | R54 A55 | L52-R54 PolarHBondContact O-N 3.24Å; L52-A55 WeakPolarHBondContact O-CB 3.32Å; L52-A55 PolarHBondContact O-N 2.98Å |
| 53 | A | 84.8 | Confident | 82.2 | Confident | 88 Ų | 88 | 119.4 Ų | 119.4 | 73% | 0.727 | 71% | 0.71 | S | S | * | * | G | 310 helix | trans | -60.2 | -22.5 | -173 | 0 | 0 | 0 | 0 | 0 | 114.5 | S51 | S51-A53 PolarHBondContact O-N 3.09Å; S51-A53 VanDerWaalsContact O-N 3.12Å |
| 54 | R | 86.5 | Confident | 83.4 | Confident | 203 Ų | 203 | 121.4 Ų | 121.4 | 77% | 0.766 | 71% | 0.712 | S | S | * | * | G | 310 helix | trans | -99.5 | 3.1 | -179.6 | -62.4 | -169.8 | -66.5 | 176 | -0.7 | 114 | L52 G56 K57 | L52-R54 PolarHBondContact O-N 3.24Å; R54-G56 PolarHBondContact O-N 3.06Å; R54-K57 PolarHBondContact O-N 3.03Å |
| 55 | A | 91.5 | Very high | 84.7 | Confident | 80 Ų | 80 | 120.6 Ų | 120.6 | 66% | 0.661 | 71% | 0.707 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.7 | 127.7 | 179.4 | 0 | 0 | 0 | 0 | 0 | 110.6 | L52 K57 | L52-A55 WeakPolarHBondContact O-CB 3.32Å; L52-A55 PolarHBondContact O-N 2.98Å; A55-K57 VanDerWaalsContact C-N 3.31Å; A55-K57 PolarHBondContact O-N 3.32Å |
| 56 | G | 92.7 | Very high | 86.2 | Confident | 52 Ų | 52 | 125.8 Ų | 125.8 | 54% | 0.536 | 71% | 0.714 | S | S | . | * | T | Hydrogen-bonded Turn | trans | 77.4 | 1.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 116.6 | R54 V58 K59 G60 | R54-G56 PolarHBondContact O-N 3.06Å; G56-V58 VanDerWaalsContact C-N 3.35Å; G56-V58 PolarHBondContact O-N 3.05Å; G56-K59 PolarHBondContact O-N 3.12Å; G56-K59 VanDerWaalsContact O-N 3.09Å; G56-G60 PolarHBondContact O-N 3.4Å |
| 57 | K | 95.1 | Very high | 87.7 | Confident | 121 Ų | 121 | 132.7 Ų | 132.7 | 53% | 0.526 | 73% | 0.726 | S | S | . | * | H | α-helix | trans | -47.9 | -52.8 | -178.4 | -178.7 | -179.2 | 177.8 | -178.5 | 0 | 112.8 | R54 A55 K59 G60 Q61 | R54-K57 PolarHBondContact O-N 3.03Å; A55-K57 VanDerWaalsContact C-N 3.31Å; A55-K57 PolarHBondContact O-N 3.32Å; K57-K59 PolarHBondContact O-N 3.44Å; K57-G60 PolarHBondContact O-N 3.3Å; K57-Q61 VanDerWaalsContact CE-NE2 3.31Å; K57-Q61 WeakPolarHBondContact O-CB 3.36Å; K57-Q61 WeakPolarHBondContact O-CG 3.5Å; K57-Q61 PolarHBondContact O-N 3.3Å |
| 58 | V | 95.5 | Very high | 89.1 | Confident | 108 Ų | 108 | 130.8 Ų | 130.8 | 66% | 0.655 | 72% | 0.718 | S | S | * | * | H | α-helix | trans | -67.5 | -37.9 | -176.6 | -178.2 | 0 | 0 | 0 | 0 | 111.8 | G56 G60 Q61 T62 | G56-V58 VanDerWaalsContact C-N 3.35Å; G56-V58 PolarHBondContact O-N 3.05Å; V58-G60 VanDerWaalsContact C-N 3.3Å; V58-G60 PolarHBondContact O-N 3.3Å; V58-Q61 PolarHBondContact O-N 3.23Å; V58-T62 HydrophobicContact CG1-CG2 4.31Å; V58-T62 WeakPolarHBondContact O-CG2 3.33Å; V58-T62 PolarHBondContact O-N 2.94Å; V58-T62 VanDerWaalsContact O-N 3.11Å; V58-T62 PolarHBondContact O-OG1 3.44Å |
| 59 | K | 94.3 | Very high | 90.3 | Very high | 180 Ų | 180 | 134.2 Ų | 134.2 | 78% | 0.783 | 73% | 0.725 | S | S | * | * | H | α-helix | trans | -67.4 | -31.5 | 178.1 | -171.5 | 177.8 | 179.8 | -177.6 | 0 | 112.2 | G56 K57 T62 | G56-K59 PolarHBondContact O-N 3.12Å; G56-K59 VanDerWaalsContact O-N 3.09Å; K57-K59 PolarHBondContact O-N 3.44Å; K59-T62 PolarHBondContact O-OG1 3.39Å |
| 60 | G | 93.2 | Very high | 91.4 | Very high | 69 Ų | 69 | 133.7 Ų | 133.7 | 71% | 0.711 | 72% | 0.72 | S | S | * | * | H | α-helix | trans | -80 | -31.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | G56 K57 V58 | G56-G60 PolarHBondContact O-N 3.4Å; K57-G60 PolarHBondContact O-N 3.3Å; V58-G60 VanDerWaalsContact C-N 3.3Å; V58-G60 PolarHBondContact O-N 3.3Å |
| 61 | Q | 95.5 | Very high | 92.4 | Very high | 137 Ų | 137 | 142.2 Ų | 142.2 | 64% | 0.64 | 73% | 0.734 | S | S | * | * | H | α-helix | trans | -81.4 | -22.2 | -179.8 | -72.1 | -177.7 | -17 | 0 | 0 | 113.8 | K57 V58 | K57-Q61 VanDerWaalsContact CE-NE2 3.31Å; K57-Q61 WeakPolarHBondContact O-CB 3.36Å; K57-Q61 WeakPolarHBondContact O-CG 3.5Å; K57-Q61 PolarHBondContact O-N 3.3Å; V58-Q61 PolarHBondContact O-N 3.23Å |
| 62 | T | 95.3 | Very high | 92.9 | Very high | 77 Ų | 77 | 148 Ų | 148 | 47% | 0.472 | 75% | 0.748 | S | S | . | * | S | Bend | trans | -78.2 | 126.6 | -179 | 40 | 0 | 0 | 0 | 0 | 110.8 | V58 K59 K64 | V58-T62 HydrophobicContact CG1-CG2 4.31Å; V58-T62 WeakPolarHBondContact O-CG2 3.33Å; V58-T62 PolarHBondContact O-N 2.94Å; V58-T62 VanDerWaalsContact O-N 3.11Å; V58-T62 PolarHBondContact O-OG1 3.44Å; K59-T62 PolarHBondContact O-OG1 3.39Å; T62-K64 PolarHBondContact O-N 2.83Å |
| 63 | P | 95.8 | Very high | 93.3 | Very high | 108 Ų | 108 | 147.3 Ų | 147.3 | 70% | 0.701 | 74% | 0.741 | S | S | * | * | trans | -62 | 136.6 | 179.9 | 25.5 | -33.8 | 0 | 0 | 0 | 110.4 | V65 | P63-V65 VanDerWaalsContact C-N 3.31Å; P63-V65 PolarHBondContact O-N 3.11Å | ||
| 64 | K | 95 | Very high | 93.8 | Very high | 205 Ų | 205 | 149.8 Ų | 149.8 | 89% | 0.891 | 74% | 0.735 | S | S | * | * | trans | -77.3 | 81.6 | 177 | -67.9 | -177.7 | -176.3 | 174.2 | 0 | 109.9 | T62 E66 | T62-K64 PolarHBondContact O-N 2.83Å; K64-E66 PolarHBondContact O-N 3.47Å | ||
| 65 | V | 95.3 | Very high | 94.3 | Very high | 125 Ų | 125 | 145.4 Ų | 145.4 | 76% | 0.758 | 73% | 0.731 | S | S | * | * | trans | -67.8 | 116.4 | 177.9 | -177.3 | 0 | 0 | 0 | 0 | 109.7 | P63 | P63-V65 VanDerWaalsContact C-N 3.31Å; P63-V65 PolarHBondContact O-N 3.11Å | ||
| 66 | E | 94.7 | Very high | 94.6 | Very high | 176 Ų | 176 | 144.1 Ų | 144.1 | 82% | 0.822 | 73% | 0.726 | S | S | * | * | trans | -62.5 | 144.2 | 176.4 | -66.3 | -173.4 | 169.5 | 0 | 0 | 111.5 | K64 K68 | K64-E66 PolarHBondContact O-N 3.47Å; E66-K68 PolarHBondContact O-N 3.43Å | ||
| 67 | K | 94.9 | Very high | 94.8 | Very high | 206 Ų | 206 | 151 Ų | 151 | 90% | 0.896 | 74% | 0.736 | S | S | * | * | trans | -73.1 | 113 | 177.1 | -69.3 | 179.7 | -178 | 173 | 0 | 108.6 | E69 | K67-E69 PolarHBondContact O-N 3.18Š| ||
| 68 | K | 93.9 | Very high | 94.9 | Very high | 183 Ų | 183 | 147.7 Ų | 147.7 | 80% | 0.796 | 73% | 0.731 | S | S | * | * | trans | -57.9 | 134.6 | 167.9 | -61.4 | -175.9 | 179.8 | -175.8 | 0 | 109.7 | E66 K70 | E66-K68 PolarHBondContact O-N 3.43Å; K68-K70 PolarHBondContact O-N 3.28Å | ||
| 69 | E | 92.1 | Very high | 95 | Very high | 202 Ų | 202 | 147.8 Ų | 147.8 | 94% | 0.944 | 72% | 0.722 | S | S | * | * | trans | -61.7 | 126.4 | 173.3 | -65.5 | -166.5 | 162.3 | 0 | 0 | 110 | K67 | K67-E69 PolarHBondContact O-N 3.18Š| ||
| 70 | K | 93.6 | Very high | 95.1 | Very high | 184 Ų | 184 | 147.3 Ų | 147.3 | 80% | 0.8 | 72% | 0.716 | S | S | * | * | trans | -114.2 | 142.1 | 173.6 | -65 | -177 | -178.6 | 178.6 | 0 | 108 | K68 K72 | K68-K70 PolarHBondContact O-N 3.28Å; K70-K72 PolarHBondContact O-N 3.21Å | ||
| 71 | R | 93.6 | Very high | 95.3 | Very high | 236 Ų | 236 | 151.2 Ų | 151.2 | 89% | 0.891 | 71% | 0.709 | S | S | * | * | P | Polyproline II helix | trans | -52.8 | 136.6 | 174.6 | -65.9 | -176.8 | 178.7 | -175.3 | -0.7 | 110 | Q73 | R71-Q73 PolarHBondContact O-N 3.39Š|
| 72 | K | 93.1 | Very high | 95.3 | Very high | 211 Ų | 211 | 148.7 Ų | 148.7 | 92% | 0.917 | 70% | 0.698 | S | S | * | * | P | Polyproline II helix | trans | -55.6 | 125.5 | 176.6 | -68 | -174.6 | -178.9 | 177.7 | 0 | 109.2 | K70 | K70-K72 PolarHBondContact O-N 3.21Š|
| 73 | Q | 93.4 | Very high | 95.3 | Very high | 143 Ų | 143 | 147 Ų | 147 | 67% | 0.668 | 69% | 0.685 | S | S | * | * | P | Polyproline II helix | trans | -72.2 | 140.2 | 178.8 | -64.4 | -67.4 | 0.2 | 0 | 0 | 110 | R71 | R71-Q73 PolarHBondContact O-N 3.39Š|
| 74 | K | 95.3 | Very high | 95.3 | Very high | 139 Ų | 139 | 148.5 Ų | 148.5 | 60% | 0.604 | 68% | 0.678 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 141.6 | 173.8 | -65.1 | -177.9 | 179.4 | -179.7 | 0 | 109.7 | A78 K79 | K74-A78 HydrophobicContact CB-CB 4.37Å; K74-A78 HydrophobicContact CD-CB 4.44Å; K74-K79 VanDerWaalsContact O-CB 3.28Å; K74-K79 WeakPolarHBondContact O-CB 3.4Å; K74-K79 WeakPolarHBondContact O-CD 3.38Å; K74-K79 WeakPolarHBondContact O-CG 3.28Å |
| 75 | T | 96.3 | Very high | 95.3 | Very high | 112 Ų | 112 | 141 Ų | 141 | 69% | 0.687 | 65% | 0.649 | S | S | * | * | trans | -117.4 | 171.5 | 178.1 | 57 | 0 | 0 | 0 | 0 | 111.4 | K79 | T75-K79 PolarHBondContact O-N 3.34Š| ||
| 76 | G | 97.5 | Very high | 95.1 | Very high | 53 Ų | 53 | 141.4 Ų | 141.4 | 55% | 0.546 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | 60.5 | -142.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 115.3 | A78 K79 R80 | G76-A78 VanDerWaalsContact C-N 3.25Å; G76-A78 PolarHBondContact O-N 3.47Å; G76-K79 WeakPolarHBondContact O-CB 3.35Å; G76-K79 PolarHBondContact O-N 3.18Å; G76-K79 VanDerWaalsContact O-N 3.11Å; G76-R80 PolarHBondContact O-N 3.29Å |
| 77 | R | 97.4 | Very high | 94.9 | Very high | 196 Ų | 196 | 139.6 Ų | 139.6 | 74% | 0.74 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -58.6 | -36.4 | -178.2 | -170.7 | 174.7 | -176.1 | -117.1 | 3 | 112.5 | K79 R80 R81 | R77-K79 VanDerWaalsContact C-N 3.35Å; R77-K79 PolarHBondContact O-N 3.49Å; R77-R80 PolarHBondContact O-N 2.92Å; R77-R81 VanDerWaalsContact NH1-NH2 3.19Å; R77-R81 PolarHBondContact O-N 3.36Å |
| 78 | A | 97 | Very high | 94.7 | Very high | 52 Ų | 52 | 136.4 Ų | 136.4 | 43% | 0.43 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -63.4 | -40.2 | 177.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | K74 G76 R81 M82 | K74-A78 HydrophobicContact CB-CB 4.37Å; K74-A78 HydrophobicContact CD-CB 4.44Å; G76-A78 VanDerWaalsContact C-N 3.25Å; G76-A78 PolarHBondContact O-N 3.47Å; A78-R81 PolarHBondContact O-N 2.93Å; A78-M82 PolarHBondContact O-N 3.11Å; A78-M82 VanDerWaalsContact O-N 3.1Å |
| 79 | K | 97.9 | Very high | 94.5 | Very high | 109 Ų | 109 | 132 Ų | 132 | 47% | 0.474 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -62.7 | -44.3 | 173.7 | -167.1 | 179.5 | -179.1 | 176.6 | 0 | 111.6 | K74 T75 G76 R77 M82 Q83 | K74-K79 VanDerWaalsContact O-CB 3.28Å; K74-K79 WeakPolarHBondContact O-CB 3.4Å; K74-K79 WeakPolarHBondContact O-CD 3.38Å; K74-K79 WeakPolarHBondContact O-CG 3.28Å; T75-K79 PolarHBondContact O-N 3.34Å; G76-K79 WeakPolarHBondContact O-CB 3.35Å; G76-K79 PolarHBondContact O-N 3.18Å; G76-K79 VanDerWaalsContact O-N 3.11Å; R77-K79 VanDerWaalsContact C-N 3.35Å; R77-K79 PolarHBondContact O-N 3.49Å; K79-M82 PolarHBondContact O-N 2.91Å; K79-Q83 WeakPolarHBondContact O-CB 3.42Å; K79-Q83 PolarHBondContact O-N 3.25Å |
| 80 | R | 97.3 | Very high | 94.2 | Very high | 171 Ų | 171 | 127.6 Ų | 127.6 | 65% | 0.645 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -64.5 | -41 | 179.2 | -67.8 | -60.5 | -171.2 | 179.2 | 7.2 | 112.2 | G76 R77 Q83 Y84 | G76-R80 PolarHBondContact O-N 3.29Å; R77-R80 PolarHBondContact O-N 2.92Å; R80-Q83 PolarHBondContact O-N 3.36Å; R80-Y84 PolarHBondContact O-N 3.1Å |
| 81 | R | 97.4 | Very high | 93.5 | Very high | 151 Ų | 151 | 121.6 Ų | 121.6 | 57% | 0.57 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -58.9 | -50.6 | 173.1 | -172.3 | -177.6 | -66.3 | 168.4 | -2.2 | 111.2 | R77 A78 Q83 Y84 T85 | R77-R81 VanDerWaalsContact NH1-NH2 3.19Å; R77-R81 PolarHBondContact O-N 3.36Å; A78-R81 PolarHBondContact O-N 2.93Å; R81-Q83 VanDerWaalsContact C-N 3.3Å; R81-Q83 PolarHBondContact O-N 3.48Å; R81-Y84 PolarHBondContact O-N 3.37Å; R81-T85 PolarHBondContact O-N 3.32Å; R81-T85 PolarHBondContact O-OG1 3.14Å |
| 82 | M | 95 | Very high | 92.3 | Very high | 84 Ų | 84 | 116.3 Ų | 116.3 | 41% | 0.414 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -59.1 | -41.3 | 177.4 | 178.9 | -90.5 | -79.5 | 0 | 0 | 112.2 | A78 K79 R86 | A78-M82 PolarHBondContact O-N 3.11Å; A78-M82 VanDerWaalsContact O-N 3.1Å; K79-M82 PolarHBondContact O-N 2.91Å; M82-R86 WeakPolarHBondContact O-CB 3.35Å; M82-R86 PolarHBondContact O-N 3.19Å |
| 83 | Q | 94.7 | Very high | 91.1 | Very high | 40 Ų | 40 | 110.2 Ų | 110.2 | 19% | 0.187 | 55% | 0.548 | C | S | . | . | H | α-helix | trans | -64.2 | -42.2 | 176.9 | -174.8 | 177.4 | 18.1 | 0 | 0 | 112.5 | K79 R80 R81 R86 R87 | K79-Q83 WeakPolarHBondContact O-CB 3.42Å; K79-Q83 PolarHBondContact O-N 3.25Å; R80-Q83 PolarHBondContact O-N 3.36Å; R81-Q83 VanDerWaalsContact C-N 3.3Å; R81-Q83 PolarHBondContact O-N 3.48Å; Q83-R86 PolarHBondContact O-N 2.97Å; Q83-R87 HydrophobicContact CG-CG 4.46Å; Q83-R87 VanDerWaalsContact NE2-NH2 3.12Å; Q83-R87 VanDerWaalsContact O-CB 3.32Å; Q83-R87 WeakPolarHBondContact O-CB 3.32Å; Q83-R87 VanDerWaalsContact O-CG 3.31Å; Q83-R87 WeakPolarHBondContact O-CG 3.47Å; Q83-R87 PolarHBondContact O-N 3.13Å |
| 84 | Y | 95.9 | Very high | 89.7 | Confident | 140 Ų | 140 | 106.4 Ų | 106.4 | 55% | 0.549 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -62.5 | -51.1 | 176.4 | 176.1 | -90.8 | 0 | 0 | 0 | 110.9 | R80 R81 R86 R87 F88 V89 | R80-Y84 PolarHBondContact O-N 3.1Å; R81-Y84 PolarHBondContact O-N 3.37Å; Y84-R86 VanDerWaalsContact C-N 3.3Å; Y84-R86 PolarHBondContact O-N 2.9Å; Y84-R87 PolarHBondContact O-N 2.9Å; Y84-R87 VanDerWaalsContact O-N 3.13Å; Y84-F88 AromaticContact CD2-CD2 3.44Å; Y84-F88 HydrophobicContact CD2-CD2 3.44Å; Y84-F88 VanDerWaalsContact CD2-CD2 3.44Å; Y84-F88 HydrophobicContact CD2-CE2 4.03Å; Y84-F88 HydrophobicContact CD2-CG 4.37Å; Y84-F88 HydrophobicContact CE2-CB 4.26Å; Y84-F88 AromaticContact CE2-CD2 3.71Å; Y84-F88 HydrophobicContact CE2-CD2 3.71Å; Y84-F88 HydrophobicContact CE2-CE2 4.43Å; Y84-F88 HydrophobicContact CE2-CG 4.26Å; Y84-F88 HydrophobicContact CG-CD2 4.11Å; Y84-F88 PolarHBondContact O-N 3.3Å; Y84-V89 HydrophobicContact CD1-CG2 4.03Å; Y84-V89 HydrophobicContact CE1-CG2 3.67Å |
| 85 | T | 95 | Very high | 88.5 | Confident | 49 Ų | 49 | 102.4 Ų | 102.4 | 30% | 0.301 | 53% | 0.533 | S | S | . | . | I | π-helix | trans | -56.4 | -45 | 176.6 | -55.9 | 0 | 0 | 0 | 0 | 110.9 | R81 R87 V89 N90 | R81-T85 PolarHBondContact O-N 3.32Å; R81-T85 PolarHBondContact O-OG1 3.14Å; T85-R87 PolarHBondContact O-N 3.21Å; T85-V89 HydrophobicContact CG2-CB 4.08Å; T85-V89 HydrophobicContact CG2-CG1 4.45Å; T85-V89 WeakPolarHBondContact O-CB 3.31Å; T85-V89 PolarHBondContact O-N 2.98Å; T85-N90 WeakPolarHBondContact O-CB 3.13Å; T85-N90 PolarHBondContact O-N 3.44Å |
| 86 | R | 91.6 | Very high | 87.1 | Confident | 132 Ų | 132 | 104 Ų | 104 | 50% | 0.498 | 55% | 0.545 | S | S | . | . | I | π-helix | trans | -65.7 | -34.4 | 178.4 | -169.5 | 176.7 | 71.9 | 105.6 | -4.9 | 114 | M82 Q83 Y84 | M82-R86 WeakPolarHBondContact O-CB 3.35Å; M82-R86 PolarHBondContact O-N 3.19Å; Q83-R86 PolarHBondContact O-N 2.97Å; Y84-R86 VanDerWaalsContact C-N 3.3Å; Y84-R86 PolarHBondContact O-N 2.9Å |
| 87 | R | 91.1 | Very high | 86 | Confident | 138 Ų | 138 | 104.5 Ų | 104.5 | 52% | 0.521 | 55% | 0.55 | S | S | . | . | I | π-helix | trans | -90.9 | -28.6 | -172.9 | -76.7 | -177 | 173.6 | -171.6 | -4.4 | 114.6 | Q83 Y84 T85 A91 | Q83-R87 HydrophobicContact CG-CG 4.46Å; Q83-R87 VanDerWaalsContact NE2-NH2 3.12Å; Q83-R87 VanDerWaalsContact O-CB 3.32Å; Q83-R87 WeakPolarHBondContact O-CB 3.32Å; Q83-R87 VanDerWaalsContact O-CG 3.31Å; Q83-R87 WeakPolarHBondContact O-CG 3.47Å; Q83-R87 PolarHBondContact O-N 3.13Å; Y84-R87 PolarHBondContact O-N 2.9Å; Y84-R87 VanDerWaalsContact O-N 3.13Å; T85-R87 PolarHBondContact O-N 3.21Å; R87-A91 WeakPolarHBondContact O-CB 3.49Å |
| 88 | F | 90 | Very high | 85.1 | Confident | 140 Ų | 140 | 106.8 Ų | 106.8 | 61% | 0.614 | 56% | 0.558 | S | S | * | * | I | π-helix | trans | -126.2 | -39.2 | -169.8 | -58 | -67.5 | 0 | 0 | 0 | 112.6 | Y84 | Y84-F88 AromaticContact CD2-CD2 3.44Å; Y84-F88 HydrophobicContact CD2-CD2 3.44Å; Y84-F88 VanDerWaalsContact CD2-CD2 3.44Å; Y84-F88 HydrophobicContact CD2-CE2 4.03Å; Y84-F88 HydrophobicContact CD2-CG 4.37Å; Y84-F88 HydrophobicContact CE2-CB 4.26Å; Y84-F88 AromaticContact CE2-CD2 3.71Å; Y84-F88 HydrophobicContact CE2-CD2 3.71Å; Y84-F88 HydrophobicContact CE2-CE2 4.43Å; Y84-F88 HydrophobicContact CE2-CG 4.26Å; Y84-F88 HydrophobicContact CG-CD2 4.11Å; Y84-F88 PolarHBondContact O-N 3.3Å |
| 89 | V | 89.5 | Confident | 84.3 | Confident | 91 Ų | 91 | 115.3 Ų | 115.3 | 55% | 0.552 | 58% | 0.579 | S | S | * | * | I | π-helix | trans | -81.8 | -50.6 | -178.9 | -175.9 | 0 | 0 | 0 | 0 | 110.9 | Y84 T85 A91 | Y84-V89 HydrophobicContact CD1-CG2 4.03Å; Y84-V89 HydrophobicContact CE1-CG2 3.67Å; T85-V89 HydrophobicContact CG2-CB 4.08Å; T85-V89 HydrophobicContact CG2-CG1 4.45Å; T85-V89 WeakPolarHBondContact O-CB 3.31Å; T85-V89 PolarHBondContact O-N 2.98Å; V89-A91 VanDerWaalsContact C-N 3.33Å |
| 90 | N | 86.3 | Confident | 83.7 | Confident | 109 Ų | 109 | 118.4 Ų | 118.4 | 58% | 0.583 | 59% | 0.588 | S | S | * | * | S | Bend | trans | -94.5 | 9.4 | -177.5 | -62.2 | 0.3 | 0 | 0 | 0 | 112.4 | T85 V92 | T85-N90 WeakPolarHBondContact O-CB 3.13Å; T85-N90 PolarHBondContact O-N 3.44Å; N90-V92 VanDerWaalsContact C-N 3.32Å; N90-V92 PolarHBondContact O-N 3.43Å |
| 91 | A | 78.5 | Confident | 83.2 | Confident | 58 Ų | 58 | 112.4 Ų | 112.4 | 48% | 0.479 | 58% | 0.579 | S | S | . | * | trans | -76.2 | 88 | 176.7 | 0 | 0 | 0 | 0 | 0 | 109.4 | R87 V89 A93 | R87-A91 WeakPolarHBondContact O-CB 3.49Å; V89-A91 VanDerWaalsContact C-N 3.33Å; A91-A93 PolarHBondContact O-N 2.79Å | ||
| 92 | V | 69 | Low | 82.8 | Confident | 124 Ų | 124 | 110.7 Ų | 110.7 | 75% | 0.752 | 59% | 0.588 | S | S | * | * | trans | -69.6 | 126.2 | 167.9 | -177.9 | 0 | 0 | 0 | 0 | 107.6 | N90 T94 | N90-V92 VanDerWaalsContact C-N 3.32Å; N90-V92 PolarHBondContact O-N 3.43Å; V92-T94 PolarHBondContact O-N 2.96Å | ||
| 93 | A | 67.3 | Low | 82.7 | Confident | 84 Ų | 84 | 113.7 Ų | 113.7 | 69% | 0.694 | 61% | 0.606 | S | S | * | * | trans | -57.2 | 109.6 | 168.2 | 0 | 0 | 0 | 0 | 0 | 107.5 | A91 G95 | A91-A93 PolarHBondContact O-N 2.79Å; A93-G95 PolarHBondContact O-N 3.31Å | ||
| 94 | T | 63.7 | Low | 82.4 | Confident | 62 Ų | 62 | 114.6 Ų | 114.6 | 38% | 0.38 | 62% | 0.62 | S | S | . | * | trans | -68.3 | 82.1 | -179.4 | 35.4 | 0 | 0 | 0 | 0 | 109.9 | V92 | V92-T94 PolarHBondContact O-N 2.96Š| ||
| 95 | G | 69.2 | Low | 82.1 | Confident | 56 Ų | 56 | 114.8 Ų | 114.8 | 58% | 0.577 | 63% | 0.631 | S | S | * | * | S | Bend | trans | 51.3 | -172 | 173.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | A93 G97 | A93-G95 PolarHBondContact O-N 3.31Å; G95-G97 PolarHBondContact O-N 3.18Å |
| 96 | P | 68.5 | Low | 81.4 | Confident | 146 Ų | 146 | 120.9 Ų | 120.9 | 95% | 0.948 | 68% | 0.675 | S | S | * | * | S | Bend | trans | -68.2 | 107.6 | 163 | 27 | -29.4 | 0 | 0 | 0 | 108.7 | ||
| 97 | G | 74.1 | Confident | 80.9 | Confident | 62 Ų | 62 | 120.3 Ų | 120.3 | 64% | 0.639 | 68% | 0.684 | S | S | * | * | S | Bend | trans | 163 | 177.4 | 179.4 | 0 | 0 | 0 | 0 | 0 | 114.6 | G95 | G95-G97 PolarHBondContact O-N 3.18Š|
| 98 | R | 78.5 | Confident | 80.4 | Confident | 244 Ų | 244 | 119.4 Ų | 119.4 | 92% | 0.921 | 69% | 0.692 | S | S | * | * | P | Polyproline II helix | trans | -66.9 | 135.4 | 175.2 | -71.3 | -173.3 | 179.1 | -160.9 | 0.5 | 110 | R100 | R98-R100 PolarHBondContact O-N 3.45Š|
| 99 | R | 79.8 | Confident | 79.8 | Confident | 231 Ų | 231 | 118.2 Ų | 118.2 | 87% | 0.872 | 70% | 0.697 | S | S | * | * | P | Polyproline II helix | trans | -55.8 | 127.6 | 176.5 | -68.8 | -177.8 | 173.3 | -174.9 | -2.6 | 110.6 | ||
| 100 | R | 84.9 | Confident | 79.3 | Confident | 175 Ų | 175 | 119.8 Ų | 119.8 | 66% | 0.66 | 71% | 0.705 | S | S | * | * | P | Polyproline II helix | trans | -68.9 | 140.3 | 176 | -71.8 | -152.1 | -90.3 | -171.8 | -7.1 | 111.5 | R98 | R98-R100 PolarHBondContact O-N 3.45Š|
| 101 | G | 87.1 | Confident | 78.8 | Confident | 44 Ų | 44 | 120.5 Ų | 120.5 | 45% | 0.454 | 71% | 0.713 | S | S | . | * | P | Polyproline II helix | trans | -72.7 | 159.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113 | N103 A104 | G101-N103 PolarHBondContact O-N 2.96Å; G101-A104 PolarHBondContact O-N 2.76Å |
| 102 | P | 89 | Confident | 78.9 | Confident | 116 Ų | 116 | 124.7 Ų | 124.7 | 75% | 0.753 | 73% | 0.728 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -69.5 | -12.4 | -175.7 | 28.2 | -36.2 | 0 | 0 | 0 | 115.2 | ||
| 103 | N | 91.9 | Very high | 79.6 | Confident | 147 Ų | 147 | 124.7 Ų | 124.7 | 79% | 0.786 | 73% | 0.727 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -133.1 | 34.8 | 178.4 | -166.2 | 53 | 0 | 0 | 0 | 110.7 | G101 N105 | G101-N103 PolarHBondContact O-N 2.96Å; N103-N105 PolarHBondContact O-N 3.17Å |
| 104 | A | 88.8 | Confident | 80.5 | Confident | 59 Ų | 59 | 127.8 Ų | 127.8 | 49% | 0.488 | 73% | 0.729 | S | S | . | * | trans | -74.4 | 122 | 172.9 | 0 | 0 | 0 | 0 | 0 | 108.7 | G101 | G101-A104 PolarHBondContact O-N 2.76Š| ||
| 105 | N | 89.6 | Confident | 81.9 | Confident | 144 Ų | 144 | 133.3 Ų | 133.3 | 77% | 0.77 | 76% | 0.758 | S | S | * | * | trans | -68.3 | 149.7 | 166.8 | -63.2 | -24.6 | 0 | 0 | 0 | 108.6 | N103 | N103-N105 PolarHBondContact O-N 3.17Š| ||
| 106 | S | 81.2 | Confident | 83.1 | Confident | 176 Ų | 176 | 140.4 Ų | 140.4 | 100% | 1.231 | 78% | 0.775 | S | S | * | * | trans | -62.7 | 0 | -179.5 | -62.9 | 0 | 0 | 0 | 0 | 112.5 |
Retrieved 106 of 106 residues in 66 ms
(Link to these results)