| 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 | 48.2 | Very low | 63.3 | Low | 209 Ų | 209 | 108 Ų | 108 | 100% | 1.03 | 61% | 0.613 | S | S | * | * | 0 | 119.1 | 0 | -70.5 | -179.2 | 157.2 | 0 | 0 | 105.9 | G3 T32 | M1-G3 PolarHBondContact O-N 3.44Å; M1-T32 HydrophobicContact CE-CG2 3.61Å | |||
| 2 | D | 56.8 | Low | 63.4 | Low | 127 Ų | 127 | 107.7 Ų | 107.7 | 68% | 0.679 | 60% | 0.602 | S | S | * | * | trans | -69 | 101.7 | 175.4 | -164.4 | -97 | 0 | 0 | 0 | 106.1 | T4 | D2-T4 PolarHBondContact O-N 3.27Š| ||
| 3 | G | 57.9 | Low | 62.9 | Low | 77 Ų | 77 | 109.2 Ų | 109.2 | 79% | 0.794 | 62% | 0.616 | S | S | * | * | trans | -74.7 | 38.2 | -162.8 | 0 | 0 | 0 | 0 | 0 | 114.1 | M1 E5 | M1-G3 PolarHBondContact O-N 3.44Å; G3-E5 PolarHBondContact O-N 3.02Å; G3-E5 VanDerWaalsContact O-N 3.14Å | ||
| 4 | T | 64.1 | Low | 62.6 | Low | 111 Ų | 111 | 106.9 Ų | 106.9 | 68% | 0.681 | 63% | 0.629 | S | S | * | * | trans | -73.9 | 104.5 | 169.2 | 40 | 0 | 0 | 0 | 0 | 107.9 | D2 | D2-T4 PolarHBondContact O-N 3.27Š| ||
| 5 | E | 67.5 | Low | 62.5 | Low | 171 Ų | 171 | 106.8 Ų | 106.8 | 80% | 0.799 | 62% | 0.623 | S | S | * | * | P | Polyproline II helix | trans | -52.2 | 132.5 | 171 | 57.3 | -173.4 | 107 | 0 | 0 | 109.7 | G3 | G3-E5 PolarHBondContact O-N 3.02Å; G3-E5 VanDerWaalsContact O-N 3.14Å |
| 6 | P | 70.1 | Confident | 62.8 | Low | 35 Ų | 35 | 102.4 Ų | 102.4 | 23% | 0.227 | 60% | 0.596 | C | S | . | * | P | Polyproline II helix | trans | -64.9 | 135.5 | 178.9 | 25.8 | -32.5 | 0 | 0 | 0 | 108.9 | V8 L39 | P6-V8 PolarHBondContact O-N 3.48Å; P6-V8 VanDerWaalsContact O-N 3.1Å; P6-L39 HydrophobicContact CB-CB 4.3Å; P6-L39 HydrophobicContact CG-CB 3.94Å |
| 7 | P | 67.5 | Low | 63.1 | Low | 86 Ų | 86 | 104.9 Ų | 104.9 | 56% | 0.558 | 60% | 0.598 | S | S | * | * | P | Polyproline II helix | trans | -60.3 | 121.5 | 176.6 | 24.5 | -32.4 | 0 | 0 | 0 | 109.1 | Y38 | P7-Y38 HydrophobicContact CG-CD1 4.11Å; P7-Y38 HydrophobicContact CG-CE1 4.35Å |
| 8 | V | 70.5 | Confident | 63.2 | Low | 95 Ų | 95 | 106.5 Ų | 106.5 | 58% | 0.576 | 61% | 0.613 | S | S | * | * | B | Isolated β-bridge | trans | -82.5 | 121 | 176.4 | -171.1 | 0 | 0 | 0 | 0 | 108 | P6 L39 | P6-V8 PolarHBondContact O-N 3.48Å; P6-V8 VanDerWaalsContact O-N 3.1Å; V8-L39 WeakPolarHBondContact CA-O 3.27Å; V8-L39 HydrophobicContact CG2-CB 4.27Å; V8-L39 HydrophobicContact CG2-CD2 4.03Å; V8-L39 HydrophobicContact CG2-CG 4.42Å |
| 9 | G | 66.8 | Low | 63.3 | Low | 39 Ų | 39 | 103.9 Ų | 103.9 | 40% | 0.402 | 61% | 0.612 | S | S | . | * | trans | -167.3 | 165.8 | -177.3 | 0 | 0 | 0 | 0 | 0 | 113.9 | V11 L39 | G9-V11 PolarHBondContact O-N 2.96Å; G9-L39 PolarHBondContact N-O 3.46Å | ||
| 10 | R | 64 | Low | 63.5 | Low | 195 Ų | 195 | 100.8 Ų | 100.8 | 74% | 0.736 | 59% | 0.591 | S | S | * | * | trans | -69.5 | 111.4 | 170.3 | -179.2 | 179.5 | 173.5 | 166.3 | -2.1 | 108.2 | E12 | R10-E12 HydrophobicContact CG-CG 4.21Å; R10-E12 IonicContact CZ-OE1 3.41Å; R10-E12 IonicContact NE-OE1 3.4Å; R10-E12 PolarHBondContact NE-OE1 3.27Å; R10-E12 IonicContact NH2-OE1 3.18Å; R10-E12 PolarHBondContact O-N 3.39Å | ||
| 11 | V | 63.3 | Low | 63.7 | Low | 43 Ų | 43 | 100.1 Ų | 100.1 | 26% | 0.261 | 59% | 0.589 | S | S | . | * | trans | -82 | 107 | 172.7 | 175.7 | 0 | 0 | 0 | 0 | 108.8 | G9 I16 Y38 V40 I49 | G9-V11 PolarHBondContact O-N 2.96Å; V11-I16 HydrophobicContact CG1-CD1 3.59Å; V11-I16 HydrophobicContact CG1-CG1 4.23Å; V11-Y38 HydrophobicContact CG2-CG 4.31Å; V11-V40 HydrophobicContact CB-CG2 4.15Å; V11-V40 HydrophobicContact CG2-CG2 3.6Å; V11-I49 HydrophobicContact CB-CD1 3.84Å; V11-I49 HydrophobicContact CG1-CD1 4Å; V11-I49 HydrophobicContact CG2-CD1 3.66Å | ||
| 12 | E | 63.7 | Low | 64.7 | Low | 104 Ų | 104 | 92 Ų | 92 | 49% | 0.486 | 55% | 0.55 | S | S | . | * | trans | -86 | 133.6 | 169.2 | -58.6 | -162.9 | 133.8 | 0 | 0 | 108.9 | R10 G14 I15 | R10-E12 HydrophobicContact CG-CG 4.21Å; R10-E12 IonicContact CZ-OE1 3.41Å; R10-E12 IonicContact NE-OE1 3.4Å; R10-E12 PolarHBondContact NE-OE1 3.27Å; R10-E12 IonicContact NH2-OE1 3.18Å; R10-E12 PolarHBondContact O-N 3.39Å; E12-G14 PolarHBondContact O-N 3.01Å; E12-I15 PolarHBondContact O-N 3.32Å | ||
| 13 | T | 57.3 | Low | 65.3 | Low | 127 Ų | 127 | 89.2 Ų | 89.2 | 78% | 0.779 | 54% | 0.538 | S | S | * | . | G | 310 helix | trans | -52.5 | -26.1 | -176.5 | 26.8 | 0 | 0 | 0 | 0 | 113.4 | I15 I16 | T13-I15 VanDerWaalsContact C-N 3.31Å; T13-I15 PolarHBondContact O-N 3.38Å; T13-I16 PolarHBondContact O-N 3.27Å |
| 14 | G | 58.1 | Low | 66 | Low | 77 Ų | 77 | 91.9 Ų | 91.9 | 79% | 0.794 | 53% | 0.528 | S | S | * | . | G | 310 helix | trans | -69.3 | -18.1 | 176.7 | 0 | 0 | 0 | 0 | 0 | 115.8 | E12 I16 | E12-G14 PolarHBondContact O-N 3.01Å; G14-I16 VanDerWaalsContact C-N 3.32Å |
| 15 | I | 62.3 | Low | 66.3 | Low | 106 Ų | 106 | 87.1 Ų | 87.1 | 54% | 0.544 | 50% | 0.5 | S | S | . | . | G | 310 helix | trans | -78.4 | -23.4 | 176.8 | -59.1 | 172.9 | 0 | 0 | 0 | 110.8 | E12 T13 K17 | E12-I15 PolarHBondContact O-N 3.32Å; T13-I15 VanDerWaalsContact C-N 3.31Å; T13-I15 PolarHBondContact O-N 3.38Å; I15-K17 PolarHBondContact O-N 3.25Å |
| 16 | I | 66.7 | Low | 66.2 | Low | 36 Ų | 36 | 82.3 Ų | 82.3 | 19% | 0.185 | 48% | 0.484 | C | S | . | . | S | Bend | trans | -86.5 | 115.7 | -176.8 | -62.5 | 151.1 | 0 | 0 | 0 | 108.6 | V11 T13 G14 M20 V22 | V11-I16 HydrophobicContact CG1-CD1 3.59Å; V11-I16 HydrophobicContact CG1-CG1 4.23Å; T13-I16 PolarHBondContact O-N 3.27Å; G14-I16 VanDerWaalsContact C-N 3.32Å; I16-M20 HydrophobicContact CG2-CB 3.55Å; I16-M20 HydrophobicContact CG2-CG 4.45Å; I16-M20 HydrophobicContact CG2-SD 4.24Å; I16-V22 HydrophobicContact CD1-CG2 3.64Å; I16-V22 HydrophobicContact CG1-CG2 4.09Å; I16-V22 HydrophobicContact CG2-CG2 3.92Å |
| 17 | K | 67.3 | Low | 66 | Low | 145 Ų | 145 | 86.9 Ų | 86.9 | 63% | 0.63 | 50% | 0.502 | S | S | * | . | trans | -62.8 | 146.6 | -179 | -63.8 | -174.3 | 176.8 | -177.2 | 0 | 111 | I15 G19 M20 | I15-K17 PolarHBondContact O-N 3.25Å; K17-G19 PolarHBondContact O-N 3.18Å; K17-M20 HydrophobicContact CB-CE 3.88Å; K17-M20 HydrophobicContact CB-CG 4.2Å; K17-M20 HydrophobicContact CB-SD 3.8Å; K17-M20 HydrophobicContact CD-CE 3.96Å; K17-M20 HydrophobicContact CG-CE 3.99Å; K17-M20 HydrophobicContact CG-SD 4.27Å; K17-M20 PolarHBondContact N-SD 3.42Å; K17-M20 VanDerWaalsContact N-SD 3.45Å; K17-M20 VanDerWaalsContact O-CB 3.24Å; K17-M20 WeakPolarHBondContact O-CB 3.42Å; K17-M20 WeakPolarHBondContact O-CG 3.34Å; K17-M20 PolarHBondContact O-N 3.41Å | ||
| 18 | P | 65.6 | Low | 66 | Low | 134 Ų | 134 | 87.7 Ų | 87.7 | 87% | 0.87 | 52% | 0.516 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.8 | 135.5 | 172 | -25.7 | 33.9 | 0 | 0 | 0 | 111.9 | M20 | P18-M20 VanDerWaalsContact C-N 3.33Š|
| 19 | G | 65.2 | Low | 65.8 | Low | 58 Ų | 58 | 89 Ų | 89 | 60% | 0.598 | 52% | 0.518 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 84.3 | -1.5 | -176.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | K17 | K17-G19 PolarHBondContact O-N 3.18Š|
| 20 | M | 66.3 | Low | 65.6 | Low | 40 Ų | 40 | 88.9 Ų | 88.9 | 20% | 0.197 | 51% | 0.508 | C | S | . | . | P | Polyproline II helix | trans | -80.2 | 126.2 | 166.6 | -73 | -179.2 | 173.9 | 0 | 0 | 110.3 | I16 K17 P18 V51 Q53 | I16-M20 HydrophobicContact CG2-CB 3.55Å; I16-M20 HydrophobicContact CG2-CG 4.45Å; I16-M20 HydrophobicContact CG2-SD 4.24Å; K17-M20 HydrophobicContact CB-CE 3.88Å; K17-M20 HydrophobicContact CB-CG 4.2Å; K17-M20 HydrophobicContact CB-SD 3.8Å; K17-M20 HydrophobicContact CD-CE 3.96Å; K17-M20 HydrophobicContact CG-CE 3.99Å; K17-M20 HydrophobicContact CG-SD 4.27Å; K17-M20 PolarHBondContact N-SD 3.42Å; K17-M20 VanDerWaalsContact N-SD 3.45Å; K17-M20 VanDerWaalsContact O-CB 3.24Å; K17-M20 WeakPolarHBondContact O-CB 3.42Å; K17-M20 WeakPolarHBondContact O-CG 3.34Å; K17-M20 PolarHBondContact O-N 3.41Å; P18-M20 VanDerWaalsContact C-N 3.33Å; M20-V51 HydrophobicContact CB-CG1 3.88Å; M20-V51 HydrophobicContact CE-CG1 4.23Å; M20-V51 HydrophobicContact CG-CG1 3.73Å; M20-V51 HydrophobicContact SD-CG1 3.44Å; M20-V51 WeakPolarHBondContact SD-CG1 3.4Å; M20-Q53 HydrophobicContact CE-CG 4.1Å |
| 21 | V | 68.3 | Low | 65.4 | Low | 88 Ų | 88 | 84.8 Ų | 84.8 | 53% | 0.533 | 50% | 0.501 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.5 | 127.2 | 172.6 | -178.3 | 0 | 0 | 0 | 0 | 108.5 | L50 V51 Q52 | V21-L50 VanDerWaalsContact O-O 3.09Å; V21-V51 WeakPolarHBondContact O-CA 3.31Å; V21-Q52 HydrophobicContact CB-CB 4.33Å; V21-Q52 PolarHBondContact N-O 3.03Å; V21-Q52 PolarHBondContact O-N 3.27Å |
| 22 | V | 69.5 | Low | 65.2 | Low | 37 Ų | 37 | 88.2 Ų | 88.2 | 22% | 0.224 | 52% | 0.522 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.3 | 116.4 | 175.2 | 168.4 | 0 | 0 | 0 | 0 | 108.8 | I16 F24 I49 L50 | I16-V22 HydrophobicContact CD1-CG2 3.64Å; I16-V22 HydrophobicContact CG1-CG2 4.09Å; I16-V22 HydrophobicContact CG2-CG2 3.92Å; V22-F24 HydrophobicContact CG1-CD1 4.43Å; V22-F24 HydrophobicContact CG1-CD2 4.27Å; V22-F24 HydrophobicContact CG1-CE1 4.02Å; V22-F24 HydrophobicContact CG1-CE2 3.79Å; V22-F24 HydrophobicContact CG1-CZ 3.66Å; V22-I49 HydrophobicContact CB-CG2 4.47Å; V22-I49 HydrophobicContact CG1-CB 4.46Å; V22-I49 HydrophobicContact CG1-CG1 4.16Å; V22-I49 HydrophobicContact CG1-CG2 3.72Å; V22-I49 HydrophobicContact CG2-CG2 4.19Å; V22-L50 WeakPolarHBondContact CA-O 3.44Å |
| 23 | T | 69.7 | Low | 65.3 | Low | 70 Ų | 70 | 87.6 Ų | 87.6 | 43% | 0.429 | 53% | 0.529 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107 | 125.2 | 171.8 | -52.9 | 0 | 0 | 0 | 0 | 108.7 | Y48 L50 | T23-Y48 VanDerWaalsContact O-O 3.13Å; T23-L50 PolarHBondContact N-O 3.45Å; T23-L50 VanDerWaalsContact N-O 3.15Å; T23-L50 PolarHBondContact O-N 3.49Å; T23-L50 VanDerWaalsContact O-N 3.09Å |
| 24 | F | 72.3 | Confident | 65.8 | Low | 132 Ų | 132 | 85.3 Ų | 85.3 | 58% | 0.579 | 51% | 0.512 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -91.6 | 117.5 | 171.7 | -62.2 | -75 | 0 | 0 | 0 | 108.3 | V22 I47 Y48 I49 | V22-F24 HydrophobicContact CG1-CD1 4.43Å; V22-F24 HydrophobicContact CG1-CD2 4.27Å; V22-F24 HydrophobicContact CG1-CE1 4.02Å; V22-F24 HydrophobicContact CG1-CE2 3.79Å; V22-F24 HydrophobicContact CG1-CZ 3.66Å; F24-I47 HydrophobicContact CB-CG2 3.52Å; F24-I47 HydrophobicContact CD1-CG2 3.46Å; F24-I47 VanDerWaalsContact CD1-CG2 3.46Å; F24-I47 HydrophobicContact CG-CG2 3.92Å; F24-Y48 WeakPolarHBondContact CA-O 3.43Å; F24-I49 HydrophobicContact CD1-CD1 4.29Å; F24-I49 HydrophobicContact CD1-CG1 3.69Å; F24-I49 HydrophobicContact CE1-CD1 3.68Å; F24-I49 HydrophobicContact CE1-CG1 3.57Å |
| 25 | A | 69.2 | Low | 66.3 | Low | 11 Ų | 11 | 89.7 Ų | 89.7 | 9% | 0.091 | 51% | 0.509 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.1 | 140.6 | 177.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | I30 Y48 | A25-I30 HydrophobicContact CB-CG2 3.65Å; A25-Y48 PolarHBondContact N-O 3.31Å; A25-Y48 VanDerWaalsContact N-O 3.16Å; A25-Y48 PolarHBondContact O-N 3.37Å; A25-Y48 VanDerWaalsContact O-N 3.16Å |
| 26 | P | 66.9 | Low | 66.7 | Low | 70 Ų | 70 | 86.5 Ų | 86.5 | 46% | 0.455 | 50% | 0.495 | S | S | . | . | trans | -66.2 | 152.9 | 167.5 | 29.1 | -32.4 | 0 | 0 | 0 | 109.5 | A28 I29 | P26-A28 PolarHBondContact O-N 2.87Å; P26-I29 HydrophobicContact CG-CB 4.09Å; P26-I29 HydrophobicContact CG-CD1 3.44Å; P26-I29 VanDerWaalsContact CG-CD1 3.44Å; P26-I29 HydrophobicContact CG-CG1 3.74Å; P26-I29 PolarHBondContact O-N 2.98Å | ||
| 27 | Q | 65.5 | Low | 67 | Low | 132 Ų | 132 | 89.3 Ų | 89.3 | 62% | 0.617 | 51% | 0.506 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -53.7 | -31.6 | -176.4 | -159.2 | 174 | 1 | 0 | 0 | 113.5 | I29 I30 Y48 | Q27-I29 VanDerWaalsContact C-N 3.28Å; Q27-I29 PolarHBondContact O-N 3.19Å; Q27-I30 HydrophobicContact CG-CD1 4.39Å; Q27-I30 WeakPolarHBondContact O-CG1 3.34Å; Q27-Y48 HydrophobicContact CB-CD2 4.1Å; Q27-Y48 HydrophobicContact CB-CE2 3.5Å; Q27-Y48 VanDerWaalsContact CB-CE2 3.5Å; Q27-Y48 HydrophobicContact CG-CD2 4.4Å; Q27-Y48 HydrophobicContact CG-CE2 3.58Å; Q27-Y48 PolarHBondContact NE2-OH 3.33Å; Q27-Y48 PolarHBondContact OE1-OH 2.98Å |
| 28 | A | 67.9 | Low | 67.4 | Low | 102 Ų | 102 | 85.6 Ų | 85.6 | 84% | 0.843 | 49% | 0.488 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.3 | -19.8 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | P26 | P26-A28 PolarHBondContact O-N 2.87Š|
| 29 | I | 66.4 | Low | 67.7 | Low | 122 Ų | 122 | 80 Ų | 80 | 63% | 0.626 | 45% | 0.451 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.3 | -16.6 | -173 | -62.5 | 179.1 | 0 | 0 | 0 | 112.1 | P26 Q27 D31 | P26-I29 HydrophobicContact CG-CB 4.09Å; P26-I29 HydrophobicContact CG-CD1 3.44Å; P26-I29 VanDerWaalsContact CG-CD1 3.44Å; P26-I29 HydrophobicContact CG-CG1 3.74Å; P26-I29 PolarHBondContact O-N 2.98Å; Q27-I29 VanDerWaalsContact C-N 3.28Å; Q27-I29 PolarHBondContact O-N 3.19Å; I29-D31 PolarHBondContact O-N 3.39Å |
| 30 | I | 61.9 | Low | 68.2 | Low | 37 Ų | 37 | 77.7 Ų | 77.7 | 19% | 0.19 | 43% | 0.425 | C | S | . | . | trans | -69.5 | 105.4 | 178.6 | 44.4 | 169.7 | 0 | 0 | 0 | 110.4 | A25 Q27 T32 P36 Y48 L50 | A25-I30 HydrophobicContact CB-CG2 3.65Å; Q27-I30 HydrophobicContact CG-CD1 4.39Å; Q27-I30 WeakPolarHBondContact O-CG1 3.34Å; I30-T32 PolarHBondContact O-N 3.4Å; I30-P36 HydrophobicContact CD1-CG 4.31Å; I30-Y48 HydrophobicContact CD1-CD1 4.12Å; I30-Y48 HydrophobicContact CD1-CD2 4.3Å; I30-Y48 HydrophobicContact CD1-CE1 4.48Å; I30-Y48 HydrophobicContact CD1-CG 4.01Å; I30-L50 HydrophobicContact CG2-CD1 4.11Å; I30-L50 HydrophobicContact CG2-CD2 4.48Å | ||
| 31 | D | 59.9 | Low | 68.5 | Low | 110 Ų | 110 | 82 Ų | 82 | 59% | 0.588 | 44% | 0.441 | S | S | * | . | trans | -56.5 | 134.2 | 170.2 | -149.8 | -81.3 | 0 | 0 | 0 | 109.6 | I29 S33 L34 | I29-D31 PolarHBondContact O-N 3.39Å; D31-S33 PolarHBondContact O-N 3.47Å; D31-S33 PolarHBondContact OD1-OG 3.47Å; D31-L34 PolarHBondContact O-N 2.92Å | ||
| 32 | T | 60.1 | Low | 68.7 | Low | 115 Ų | 115 | 83.1 Ų | 83.1 | 71% | 0.706 | 44% | 0.438 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.9 | -18.3 | -173.6 | -38.3 | 0 | 0 | 0 | 0 | 113.1 | M1 I30 L34 | M1-T32 HydrophobicContact CE-CG2 3.61Å; I30-T32 PolarHBondContact O-N 3.4Å; T32-L34 VanDerWaalsContact C-N 3.31Å; T32-L34 PolarHBondContact O-N 2.98Å |
| 33 | S | 65.5 | Low | 69.1 | Low | 91 Ų | 91 | 90 Ų | 90 | 64% | 0.636 | 47% | 0.468 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70 | -21.4 | 176 | 63.3 | 0 | 0 | 0 | 0 | 114.2 | D31 | D31-S33 PolarHBondContact O-N 3.47Å; D31-S33 PolarHBondContact OD1-OG 3.47Å |
| 34 | L | 66.5 | Low | 69.3 | Low | 79 Ų | 79 | 88.8 Ų | 88.8 | 41% | 0.414 | 47% | 0.469 | S | S | . | . | S | Bend | trans | -102.6 | 117.2 | 177.9 | -57.6 | 178.3 | 0 | 0 | 0 | 109.8 | D31 T32 P36 L50 | D31-L34 PolarHBondContact O-N 2.92Å; T32-L34 VanDerWaalsContact C-N 3.31Å; T32-L34 PolarHBondContact O-N 2.98Å; L34-P36 VanDerWaalsContact O-CD 3.29Å; L34-P36 WeakPolarHBondContact O-CD 3.25Å; L34-L50 HydrophobicContact CB-CD1 4.09Å; L34-L50 HydrophobicContact CB-CD2 3.82Å; L34-L50 HydrophobicContact CD1-CD1 3.71Å |
| 35 | K | 69.8 | Low | 69.5 | Low | 168 Ų | 168 | 88.9 Ų | 88.9 | 73% | 0.73 | 47% | 0.471 | S | S | * | . | trans | -82.1 | 114.1 | 173.3 | -66.2 | -174.3 | -178.6 | -176.7 | 0 | 109.1 | K37 | K35-K37 PolarHBondContact O-N 3.14Š| ||
| 36 | P | 69.2 | Low | 69.6 | Low | 40 Ų | 40 | 93.8 Ų | 93.8 | 26% | 0.26 | 49% | 0.491 | S | S | . | . | trans | -61.9 | 139.1 | 171.5 | 27.3 | -33.4 | 0 | 0 | 0 | 109.6 | I30 L34 Y48 L50 | I30-P36 HydrophobicContact CD1-CG 4.31Å; L34-P36 VanDerWaalsContact O-CD 3.29Å; L34-P36 WeakPolarHBondContact O-CD 3.25Å; P36-Y48 HydrophobicContact CB-CD1 3.62Å; P36-Y48 HydrophobicContact CB-CG 4.26Å; P36-Y48 HydrophobicContact CG-CD1 3.7Å; P36-Y48 HydrophobicContact CG-CE1 4.31Å; P36-L50 VanDerWaalsContact CA-CD2 3.43Å; P36-L50 HydrophobicContact CB-CD2 3.96Å | ||
| 37 | K | 74 | Confident | 69.8 | Low | 94 Ų | 94 | 92.6 Ų | 92.6 | 41% | 0.409 | 48% | 0.48 | S | S | . | . | trans | -98.4 | -30.3 | -178.1 | -164.7 | 167.6 | -179.1 | 169.9 | 0 | 112.1 | K35 I49 V51 | K35-K37 PolarHBondContact O-N 3.14Å; K37-I49 PolarHBondContact N-O 3.32Å; K37-V51 HydrophobicContact CB-CG2 4.37Å; K37-V51 HydrophobicContact CD-CB 4.28Å; K37-V51 HydrophobicContact CD-CG2 4.47Å | ||
| 38 | Y | 75 | Confident | 70.2 | Confident | 67 Ų | 67 | 87.6 Ų | 87.6 | 26% | 0.263 | 46% | 0.456 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -138.2 | 148.7 | 178.7 | -52.5 | -83.2 | 0 | 0 | 0 | 110.1 | P7 V11 I49 V51 | P7-Y38 HydrophobicContact CG-CD1 4.11Å; P7-Y38 HydrophobicContact CG-CE1 4.35Å; V11-Y38 HydrophobicContact CG2-CG 4.31Å; Y38-I49 HydrophobicContact CD2-CG2 4.16Å; Y38-I49 PolarHBondContact N-O 3.48Å; Y38-I49 PolarHBondContact O-N 3.39Å; Y38-V51 HydrophobicContact CD2-CG2 4.03Å; Y38-V51 HydrophobicContact CE2-CG2 3.89Å |
| 39 | L | 72.9 | Confident | 70.5 | Confident | 17 Ų | 17 | 82.8 Ų | 82.8 | 9% | 0.089 | 42% | 0.416 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -116 | 130 | 171.8 | -178.9 | 61.1 | 0 | 0 | 0 | 108.4 | P6 V8 G9 F46 Y48 | P6-L39 HydrophobicContact CB-CB 4.3Å; P6-L39 HydrophobicContact CG-CB 3.94Å; V8-L39 WeakPolarHBondContact CA-O 3.27Å; V8-L39 HydrophobicContact CG2-CB 4.27Å; V8-L39 HydrophobicContact CG2-CD2 4.03Å; V8-L39 HydrophobicContact CG2-CG 4.42Å; G9-L39 PolarHBondContact N-O 3.46Å; L39-F46 HydrophobicContact CD1-CB 4.02Å; L39-F46 HydrophobicContact CD1-CD1 4.1Å; L39-F46 HydrophobicContact CD2-CD1 3.93Å; L39-F46 HydrophobicContact CD2-CE1 4.41Å; L39-F46 HydrophobicContact CG-CD1 4.03Å; L39-Y48 HydrophobicContact CD1-CD1 3.72Å; L39-Y48 HydrophobicContact CD1-CD2 3.79Å; L39-Y48 HydrophobicContact CD1-CE1 3.58Å; L39-Y48 HydrophobicContact CD1-CE2 3.58Å; L39-Y48 HydrophobicContact CD1-CG 3.85Å; L39-Y48 VanDerWaalsContact CD1-CZ 3.5Å; L39-Y48 HydrophobicContact CD2-CE1 4.37Å; L39-Y48 HydrophobicContact CG-CE1 4.41Å |
| 40 | V | 75 | Confident | 70.8 | Confident | 9 Ų | 9 | 77.8 Ų | 77.8 | 6% | 0.055 | 39% | 0.39 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -126 | 134.4 | -178.4 | -172.8 | 0 | 0 | 0 | 0 | 109.6 | V11 K42 I47 I49 | V11-V40 HydrophobicContact CB-CG2 4.15Å; V11-V40 HydrophobicContact CG2-CG2 3.6Å; V40-K42 HydrophobicContact CG1-CG 3.98Å; V40-I47 PolarHBondContact N-O 2.88Å; V40-I47 PolarHBondContact O-N 2.94Å; V40-I49 HydrophobicContact CB-CD1 4.46Å; V40-I49 HydrophobicContact CG2-CD1 3.38Å; V40-I49 HydrophobicContact CG2-CG1 4.19Å |
| 41 | Y | 72.3 | Confident | 71.2 | Confident | 132 Ų | 132 | 77.2 Ų | 77.2 | 52% | 0.518 | 39% | 0.388 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97 | 123.2 | 172.5 | -170.5 | -105 | 0 | 0 | 0 | 110.3 | G44 H45 F46 | Y41-G44 VanDerWaalsContact CE2-C 3.5Å; Y41-G44 WeakPolarHBondContact CE2-O 3.44Å; Y41-G44 WeakPolarHBondContact OH-CA 3.36Å; Y41-H45 WeakPolarHBondContact CA-O 3.24Å; Y41-F46 AromaticContact CD2-CD1 3.89Å; Y41-F46 HydrophobicContact CD2-CD1 3.89Å; Y41-F46 HydrophobicContact CD2-CD2 4.16Å; Y41-F46 AromaticContact CD2-CE1 3.73Å; Y41-F46 HydrophobicContact CD2-CE1 3.73Å; Y41-F46 AromaticContact CD2-CE2 4Å; Y41-F46 HydrophobicContact CD2-CE2 4Å; Y41-F46 HydrophobicContact CD2-CG 4.11Å; Y41-F46 AromaticContact CD2-CZ 3.78Å; Y41-F46 HydrophobicContact CD2-CZ 3.78Å; Y41-F46 HydrophobicContact CE2-CD2 4.31Å; Y41-F46 HydrophobicContact CE2-CE1 4.47Å; Y41-F46 AromaticContact CE2-CE2 3.98Å; Y41-F46 HydrophobicContact CE2-CE2 3.98Å; Y41-F46 HydrophobicContact CE2-CZ 4.07Å; Y41-F46 HydrophobicContact CG-CE1 4.46Å |
| 42 | K | 72.9 | Confident | 71.7 | Confident | 111 Ų | 111 | 76.6 Ų | 76.6 | 48% | 0.483 | 38% | 0.382 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.5 | 131.8 | 179 | -73.3 | -65 | -177.4 | 176.9 | 0 | 110.2 | V40 G44 H45 I47 | V40-K42 HydrophobicContact CG1-CG 3.98Å; K42-G44 PolarHBondContact O-N 3.18Å; K42-G44 VanDerWaalsContact O-N 3.14Å; K42-H45 PolarHBondContact N-O 3.39Å; K42-H45 WeakPolarHBondContact O-CA 3.37Å; K42-H45 PolarHBondContact O-N 2.73Å; K42-I47 HydrophobicContact CB-CD1 3.87Å; K42-I47 HydrophobicContact CG-CD1 4.32Å |
| 43 | E | 79 | Confident | 72.1 | Confident | 180 Ų | 180 | 74.6 Ų | 74.6 | 84% | 0.841 | 37% | 0.365 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.5 | 38.8 | 173.7 | -55.5 | -59 | 113.2 | 0 | 0 | 113.5 | H45 | E43-H45 VanDerWaalsContact C-N 3.27Å; E43-H45 PolarHBondContact O-CD2 3.18Å; E43-H45 VanDerWaalsContact O-CD2 3.28Å; E43-H45 PolarHBondContact O-N 3.06Å |
| 44 | G | 72.9 | Confident | 71.9 | Confident | 45 Ų | 45 | 73 Ų | 73 | 46% | 0.464 | 35% | 0.352 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 84.1 | -7.5 | -177.6 | 0 | 0 | 0 | 0 | 0 | 115.5 | Y41 K42 | Y41-G44 VanDerWaalsContact CE2-C 3.5Å; Y41-G44 WeakPolarHBondContact CE2-O 3.44Å; Y41-G44 WeakPolarHBondContact OH-CA 3.36Å; K42-G44 PolarHBondContact O-N 3.18Å; K42-G44 VanDerWaalsContact O-N 3.14Å |
| 45 | H | 76 | Confident | 72 | Confident | 134 Ų | 134 | 76.7 Ų | 76.7 | 62% | 0.62 | 37% | 0.365 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -111.6 | 138.9 | -174 | -67.9 | -75.7 | 0 | 0 | 0 | 113 | Y41 K42 E43 | Y41-H45 WeakPolarHBondContact CA-O 3.24Å; K42-H45 PolarHBondContact N-O 3.39Å; K42-H45 WeakPolarHBondContact O-CA 3.37Å; K42-H45 PolarHBondContact O-N 2.73Å; E43-H45 VanDerWaalsContact C-N 3.27Å; E43-H45 PolarHBondContact O-CD2 3.18Å; E43-H45 VanDerWaalsContact O-CD2 3.28Å; E43-H45 PolarHBondContact O-N 3.06Å |
| 46 | F | 71.9 | Confident | 71.9 | Confident | 115 Ų | 115 | 78 Ų | 78 | 50% | 0.504 | 37% | 0.37 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -82.9 | 120.3 | 168.5 | -73.1 | -76.5 | 0 | 0 | 0 | 110.2 | L39 Y41 | L39-F46 HydrophobicContact CD1-CB 4.02Å; L39-F46 HydrophobicContact CD1-CD1 4.1Å; L39-F46 HydrophobicContact CD2-CD1 3.93Å; L39-F46 HydrophobicContact CD2-CE1 4.41Å; L39-F46 HydrophobicContact CG-CD1 4.03Å; Y41-F46 AromaticContact CD2-CD1 3.89Å; Y41-F46 HydrophobicContact CD2-CD1 3.89Å; Y41-F46 HydrophobicContact CD2-CD2 4.16Å; Y41-F46 AromaticContact CD2-CE1 3.73Å; Y41-F46 HydrophobicContact CD2-CE1 3.73Å; Y41-F46 AromaticContact CD2-CE2 4Å; Y41-F46 HydrophobicContact CD2-CE2 4Å; Y41-F46 HydrophobicContact CD2-CG 4.11Å; Y41-F46 AromaticContact CD2-CZ 3.78Å; Y41-F46 HydrophobicContact CD2-CZ 3.78Å; Y41-F46 HydrophobicContact CE2-CD2 4.31Å; Y41-F46 HydrophobicContact CE2-CE1 4.47Å; Y41-F46 AromaticContact CE2-CE2 3.98Å; Y41-F46 HydrophobicContact CE2-CE2 3.98Å; Y41-F46 HydrophobicContact CE2-CZ 4.07Å; Y41-F46 HydrophobicContact CG-CE1 4.46Å |
| 47 | I | 72 | Confident | 71.8 | Confident | 44 Ų | 44 | 81.1 Ų | 81.1 | 23% | 0.226 | 38% | 0.384 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.6 | 119.8 | -179.2 | -49.2 | -178.8 | 0 | 0 | 0 | 108.6 | F24 V40 K42 | F24-I47 HydrophobicContact CB-CG2 3.52Å; F24-I47 HydrophobicContact CD1-CG2 3.46Å; F24-I47 VanDerWaalsContact CD1-CG2 3.46Å; F24-I47 HydrophobicContact CG-CG2 3.92Å; V40-I47 PolarHBondContact N-O 2.88Å; V40-I47 PolarHBondContact O-N 2.94Å; K42-I47 HydrophobicContact CB-CD1 3.87Å; K42-I47 HydrophobicContact CG-CD1 4.32Å |
| 48 | Y | 73.3 | Confident | 71.5 | Confident | 27 Ų | 27 | 84.5 Ų | 84.5 | 11% | 0.106 | 40% | 0.395 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.4 | 131.2 | 175.2 | -68.3 | -96.1 | 0 | 0 | 0 | 109.2 | T23 F24 A25 Q27 I30 P36 L39 | T23-Y48 VanDerWaalsContact O-O 3.13Å; F24-Y48 WeakPolarHBondContact CA-O 3.43Å; A25-Y48 PolarHBondContact N-O 3.31Å; A25-Y48 VanDerWaalsContact N-O 3.16Å; A25-Y48 PolarHBondContact O-N 3.37Å; A25-Y48 VanDerWaalsContact O-N 3.16Å; Q27-Y48 HydrophobicContact CB-CD2 4.1Å; Q27-Y48 HydrophobicContact CB-CE2 3.5Å; Q27-Y48 VanDerWaalsContact CB-CE2 3.5Å; Q27-Y48 HydrophobicContact CG-CD2 4.4Å; Q27-Y48 HydrophobicContact CG-CE2 3.58Å; Q27-Y48 PolarHBondContact NE2-OH 3.33Å; Q27-Y48 PolarHBondContact OE1-OH 2.98Å; I30-Y48 HydrophobicContact CD1-CD1 4.12Å; I30-Y48 HydrophobicContact CD1-CD2 4.3Å; I30-Y48 HydrophobicContact CD1-CE1 4.48Å; I30-Y48 HydrophobicContact CD1-CG 4.01Å; P36-Y48 HydrophobicContact CB-CD1 3.62Å; P36-Y48 HydrophobicContact CB-CG 4.26Å; P36-Y48 HydrophobicContact CG-CD1 3.7Å; P36-Y48 HydrophobicContact CG-CE1 4.31Å; L39-Y48 HydrophobicContact CD1-CD1 3.72Å; L39-Y48 HydrophobicContact CD1-CD2 3.79Å; L39-Y48 HydrophobicContact CD1-CE1 3.58Å; L39-Y48 HydrophobicContact CD1-CE2 3.58Å; L39-Y48 HydrophobicContact CD1-CG 3.85Å; L39-Y48 VanDerWaalsContact CD1-CZ 3.5Å; L39-Y48 HydrophobicContact CD2-CE1 4.37Å; L39-Y48 HydrophobicContact CG-CE1 4.41Å |
| 49 | I | 73.4 | Confident | 71.3 | Confident | 1 Ų | 1 | 85.1 Ų | 85.1 | 1% | 0.005 | 41% | 0.408 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.7 | 116.8 | 174.3 | -70.1 | 171.6 | 0 | 0 | 0 | 108.8 | V11 V22 F24 K37 Y38 V40 V51 | V11-I49 HydrophobicContact CB-CD1 3.84Å; V11-I49 HydrophobicContact CG1-CD1 4Å; V11-I49 HydrophobicContact CG2-CD1 3.66Å; V22-I49 HydrophobicContact CB-CG2 4.47Å; V22-I49 HydrophobicContact CG1-CB 4.46Å; V22-I49 HydrophobicContact CG1-CG1 4.16Å; V22-I49 HydrophobicContact CG1-CG2 3.72Å; V22-I49 HydrophobicContact CG2-CG2 4.19Å; F24-I49 HydrophobicContact CD1-CD1 4.29Å; F24-I49 HydrophobicContact CD1-CG1 3.69Å; F24-I49 HydrophobicContact CE1-CD1 3.68Å; F24-I49 HydrophobicContact CE1-CG1 3.57Å; K37-I49 PolarHBondContact N-O 3.32Å; Y38-I49 HydrophobicContact CD2-CG2 4.16Å; Y38-I49 PolarHBondContact N-O 3.48Å; Y38-I49 PolarHBondContact O-N 3.39Å; V40-I49 HydrophobicContact CB-CD1 4.46Å; V40-I49 HydrophobicContact CG2-CD1 3.38Å; V40-I49 HydrophobicContact CG2-CG1 4.19Å; I49-V51 HydrophobicContact CG2-CG2 3.86Å |
| 50 | L | 73.3 | Confident | 71.4 | Confident | 17 Ų | 17 | 86.7 Ų | 86.7 | 9% | 0.089 | 42% | 0.423 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.1 | 127.1 | 168.5 | -57.8 | 167.9 | 0 | 0 | 0 | 107.9 | V21 V22 T23 I30 L34 P36 | V21-L50 VanDerWaalsContact O-O 3.09Å; V22-L50 WeakPolarHBondContact CA-O 3.44Å; T23-L50 PolarHBondContact N-O 3.45Å; T23-L50 VanDerWaalsContact N-O 3.15Å; T23-L50 PolarHBondContact O-N 3.49Å; T23-L50 VanDerWaalsContact O-N 3.09Å; I30-L50 HydrophobicContact CG2-CD1 4.11Å; I30-L50 HydrophobicContact CG2-CD2 4.48Å; L34-L50 HydrophobicContact CB-CD1 4.09Å; L34-L50 HydrophobicContact CB-CD2 3.82Å; L34-L50 HydrophobicContact CD1-CD1 3.71Å; P36-L50 VanDerWaalsContact CA-CD2 3.43Å; P36-L50 HydrophobicContact CB-CD2 3.96Å |
| 51 | V | 70.8 | Confident | 71.4 | Confident | 25 Ų | 25 | 90.8 Ų | 90.8 | 15% | 0.152 | 44% | 0.444 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.2 | 100 | 175.9 | 178.2 | 0 | 0 | 0 | 0 | 108.3 | M20 V21 K37 Y38 I49 Q53 | M20-V51 HydrophobicContact CB-CG1 3.88Å; M20-V51 HydrophobicContact CE-CG1 4.23Å; M20-V51 HydrophobicContact CG-CG1 3.73Å; M20-V51 HydrophobicContact SD-CG1 3.44Å; M20-V51 WeakPolarHBondContact SD-CG1 3.4Å; V21-V51 WeakPolarHBondContact O-CA 3.31Å; K37-V51 HydrophobicContact CB-CG2 4.37Å; K37-V51 HydrophobicContact CD-CB 4.28Å; K37-V51 HydrophobicContact CD-CG2 4.47Å; Y38-V51 HydrophobicContact CD2-CG2 4.03Å; Y38-V51 HydrophobicContact CE2-CG2 3.89Å; I49-V51 HydrophobicContact CG2-CG2 3.86Å; V51-Q53 PolarHBondContact O-N 3.04Å |
| 52 | Q | 69.3 | Low | 71.9 | Confident | 98 Ų | 98 | 91.4 Ų | 91.4 | 46% | 0.458 | 45% | 0.45 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -78 | 108.4 | 174.6 | -174.6 | 59.7 | 49.5 | 0 | 0 | 108.8 | V21 | V21-Q52 HydrophobicContact CB-CB 4.33Å; V21-Q52 PolarHBondContact N-O 3.03Å; V21-Q52 PolarHBondContact O-N 3.27Å |
| 53 | Q | 69 | Low | 72.3 | Confident | 73 Ų | 73 | 90.8 Ų | 90.8 | 34% | 0.341 | 45% | 0.448 | S | S | . | . | trans | -74 | 138.6 | 171 | -68.8 | -162.3 | -10.9 | 0 | 0 | 110.3 | M20 V51 K55 | M20-Q53 HydrophobicContact CE-CG 4.1Å; V51-Q53 PolarHBondContact O-N 3.04Å; Q53-K55 PolarHBondContact O-N 3.5Å | ||
| 54 | P | 61.7 | Low | 72.4 | Confident | 57 Ų | 57 | 87 Ų | 87 | 37% | 0.37 | 43% | 0.433 | S | S | . | . | trans | -70.2 | 92.3 | 175.1 | 28.2 | -33.2 | 0 | 0 | 0 | 109.5 | K56 L57 W58 | P54-K56 PolarHBondContact O-N 3.24Å; P54-L57 HydrophobicContact CB-CB 4.3Å; P54-L57 HydrophobicContact CG-CB 4.29Å; P54-L57 PolarHBondContact O-N 3.09Å; P54-W58 PolarHBondContact O-N 3.22Å | ||
| 55 | K | 69.1 | Low | 72.8 | Confident | 157 Ų | 157 | 91.5 Ų | 91.5 | 68% | 0.683 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -55.7 | -34.6 | -179.9 | -66.5 | -174.1 | 179.7 | 179.8 | 0 | 112.3 | Q53 W58 C59 | Q53-K55 PolarHBondContact O-N 3.5Å; K55-W58 PolarHBondContact O-N 3.33Å; K55-C59 PolarHBondContact O-N 3.16Å; K55-C59 PolarHBondContact O-SG 2.96Å; K55-C59 VanDerWaalsContact O-SG 3.33Å |
| 56 | K | 67.8 | Low | 72.9 | Confident | 194 Ų | 194 | 91.8 Ų | 91.8 | 84% | 0.843 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -61.3 | -45.5 | 179 | -74.3 | -169.5 | 176.3 | -177.3 | 0 | 112.6 | P54 W58 C59 A60 | P54-K56 PolarHBondContact O-N 3.24Å; K56-W58 VanDerWaalsContact C-N 3.34Å; K56-C59 PolarHBondContact O-N 3.32Å; K56-A60 PolarHBondContact O-N 3.15Å; K56-A60 VanDerWaalsContact O-N 3.14Å |
| 57 | L | 66.1 | Low | 73.2 | Confident | 106 Ų | 106 | 91.5 Ų | 91.5 | 56% | 0.555 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -66 | -40.2 | 178 | -175.7 | 63.8 | 0 | 0 | 0 | 110.9 | P54 A60 I61 | P54-L57 HydrophobicContact CB-CB 4.3Å; P54-L57 HydrophobicContact CG-CB 4.29Å; P54-L57 PolarHBondContact O-N 3.09Å; L57-A60 PolarHBondContact O-N 3.25Å; L57-I61 HydrophobicContact CD1-CD1 4.16Å; L57-I61 HydrophobicContact CD1-CG1 4.46Å; L57-I61 HydrophobicContact CD2-CD1 4.48Å; L57-I61 HydrophobicContact CG-CD1 3.85Å; L57-I61 VanDerWaalsContact O-CG1 3.31Å; L57-I61 WeakPolarHBondContact O-CG1 3.37Å; L57-I61 PolarHBondContact O-N 3.4Å |
| 58 | W | 67.8 | Low | 73.7 | Confident | 165 Ų | 165 | 95.7 Ų | 95.7 | 63% | 0.625 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -63.6 | -44.6 | 177.7 | -169.7 | -82.5 | 0 | 0 | 0 | 112.7 | P54 K55 K56 A60 I61 K62 | P54-W58 PolarHBondContact O-N 3.22Å; K55-W58 PolarHBondContact O-N 3.33Å; K56-W58 VanDerWaalsContact C-N 3.34Å; W58-A60 VanDerWaalsContact C-N 3.34Å; W58-A60 PolarHBondContact O-N 3.16Å; W58-I61 PolarHBondContact O-N 2.98Å; W58-K62 VanDerWaalsContact O-CB 3.27Å; W58-K62 WeakPolarHBondContact O-CB 3.48Å; W58-K62 PolarHBondContact O-N 3.49Å |
| 59 | C | 71.4 | Confident | 73.7 | Confident | 81 Ų | 81 | 100.5 Ų | 100.5 | 55% | 0.547 | 49% | 0.487 | S | S | . | . | H | α-helix | trans | -61.1 | -42.8 | 176.5 | -69.6 | 0 | 0 | 0 | 0 | 111.6 | K55 K56 K62 Q63 | K55-C59 PolarHBondContact O-N 3.16Å; K55-C59 PolarHBondContact O-SG 2.96Å; K55-C59 VanDerWaalsContact O-SG 3.33Å; K56-C59 PolarHBondContact O-N 3.32Å; C59-K62 PolarHBondContact O-N 2.92Å; C59-Q63 WeakPolarHBondContact O-CB 3.29Å; C59-Q63 PolarHBondContact O-N 3.48Å |
| 60 | A | 73.5 | Confident | 72.9 | Confident | 49 Ų | 49 | 109.1 Ų | 109.1 | 41% | 0.405 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -61.9 | -48.3 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | K56 L57 W58 K62 Q63 I64 | K56-A60 PolarHBondContact O-N 3.15Å; K56-A60 VanDerWaalsContact O-N 3.14Å; L57-A60 PolarHBondContact O-N 3.25Å; W58-A60 VanDerWaalsContact C-N 3.34Å; W58-A60 PolarHBondContact O-N 3.16Å; A60-K62 VanDerWaalsContact C-N 3.34Å; A60-K62 PolarHBondContact O-N 2.83Å; A60-Q63 PolarHBondContact O-N 2.96Å; A60-I64 WeakPolarHBondContact O-CG1 3.48Å; A60-I64 PolarHBondContact O-N 3.48Å |
| 61 | I | 76.1 | Confident | 72.9 | Confident | 96 Ų | 96 | 113.8 Ų | 113.8 | 49% | 0.492 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -62.1 | -42.5 | 177.3 | -67.2 | 168.6 | 0 | 0 | 0 | 111 | L57 W58 Q63 I64 K65 | L57-I61 HydrophobicContact CD1-CD1 4.16Å; L57-I61 HydrophobicContact CD1-CG1 4.46Å; L57-I61 HydrophobicContact CD2-CD1 4.48Å; L57-I61 HydrophobicContact CG-CD1 3.85Å; L57-I61 VanDerWaalsContact O-CG1 3.31Å; L57-I61 WeakPolarHBondContact O-CG1 3.37Å; L57-I61 PolarHBondContact O-N 3.4Å; W58-I61 PolarHBondContact O-N 2.98Å; I61-Q63 VanDerWaalsContact C-N 3.34Å; I61-Q63 PolarHBondContact O-N 3.36Å; I61-I64 PolarHBondContact O-N 2.91Å; I61-K65 WeakPolarHBondContact O-CB 3.44Å; I61-K65 PolarHBondContact O-N 2.84Å |
| 62 | K | 82.5 | Confident | 73 | Confident | 145 Ų | 145 | 118.4 Ų | 118.4 | 63% | 0.63 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -62.5 | -40.9 | 177.9 | -171 | -179.6 | -179.8 | -175.5 | 0 | 111.5 | W58 C59 A60 K65 R66 | W58-K62 VanDerWaalsContact O-CB 3.27Å; W58-K62 WeakPolarHBondContact O-CB 3.48Å; W58-K62 PolarHBondContact O-N 3.49Å; C59-K62 PolarHBondContact O-N 2.92Å; A60-K62 VanDerWaalsContact C-N 3.34Å; A60-K62 PolarHBondContact O-N 2.83Å; K62-K65 PolarHBondContact O-N 3.03Å; K62-R66 WeakPolarHBondContact O-CB 3.48Å; K62-R66 PolarHBondContact O-N 2.88Å |
| 63 | Q | 80.8 | Confident | 73.2 | Confident | 97 Ų | 97 | 119.6 Ų | 119.6 | 45% | 0.453 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -64.5 | -45.3 | 177.4 | -167.1 | 68.7 | 29.3 | 0 | 0 | 111.5 | C59 A60 I61 K65 R66 N67 | C59-Q63 WeakPolarHBondContact O-CB 3.29Å; C59-Q63 PolarHBondContact O-N 3.48Å; A60-Q63 PolarHBondContact O-N 2.96Å; I61-Q63 VanDerWaalsContact C-N 3.34Å; I61-Q63 PolarHBondContact O-N 3.36Å; Q63-K65 PolarHBondContact O-N 2.96Å; Q63-R66 PolarHBondContact O-N 3.14Å; Q63-N67 PolarHBondContact O-N 2.83Å |
| 64 | I | 81 | Confident | 73.4 | Confident | 102 Ų | 102 | 122.3 Ų | 122.3 | 52% | 0.523 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -61.1 | -45.9 | 177 | -66.4 | 163.9 | 0 | 0 | 0 | 110.4 | A60 I61 R66 N67 I68 | A60-I64 WeakPolarHBondContact O-CG1 3.48Å; A60-I64 PolarHBondContact O-N 3.48Å; I61-I64 PolarHBondContact O-N 2.91Å; I64-R66 VanDerWaalsContact C-N 3.29Å; I64-R66 PolarHBondContact O-N 2.85Å; I64-N67 PolarHBondContact O-N 2.76Å; I64-I68 HydrophobicContact CG2-CD1 4.04Å; I64-I68 WeakPolarHBondContact O-CG1 3.41Å; I64-I68 PolarHBondContact O-N 3.1Å |
| 65 | K | 82.2 | Confident | 74.2 | Confident | 139 Ų | 139 | 126.4 Ų | 126.4 | 60% | 0.604 | 60% | 0.604 | S | S | * | * | H | α-helix | trans | -63.5 | -36.4 | 179.4 | -162.7 | 177.7 | -175.2 | -170.9 | 0 | 112 | I61 K62 Q63 I68 I69 | I61-K65 WeakPolarHBondContact O-CB 3.44Å; I61-K65 PolarHBondContact O-N 2.84Å; K62-K65 PolarHBondContact O-N 3.03Å; Q63-K65 PolarHBondContact O-N 2.96Å; K65-I68 PolarHBondContact O-N 2.97Å; K65-I69 HydrophobicContact CD-CD1 4.48Å; K65-I69 HydrophobicContact CG-CD1 3.79Å; K65-I69 WeakPolarHBondContact O-CD1 3.33Å; K65-I69 VanDerWaalsContact O-CG1 3.25Å; K65-I69 WeakPolarHBondContact O-CG1 3.11Å; K65-I69 PolarHBondContact O-N 3.36Å |
| 66 | R | 77.7 | Confident | 74.5 | Confident | 139 Ų | 139 | 124.3 Ų | 124.3 | 53% | 0.525 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -66.8 | -42.7 | 176.2 | -170.5 | 179 | 162.1 | -155.2 | -11.3 | 111.8 | K62 Q63 I64 I68 I69 E70 | K62-R66 WeakPolarHBondContact O-CB 3.48Å; K62-R66 PolarHBondContact O-N 2.88Å; Q63-R66 PolarHBondContact O-N 3.14Å; I64-R66 VanDerWaalsContact C-N 3.29Å; I64-R66 PolarHBondContact O-N 2.85Å; R66-I68 PolarHBondContact O-N 3.28Å; R66-I69 PolarHBondContact O-N 3.48Å; R66-E70 HydrophobicContact CG-CG 4.3Å; R66-E70 WeakPolarHBondContact CG-OE2 3.41Å; R66-E70 IonicContact CZ-OE2 2.73Å; R66-E70 IonicContact NE-OE2 3.66Å; R66-E70 PolarHBondContact NE-OE2 3.3Å; R66-E70 IonicContact NH2-OE2 3.6Å; R66-E70 PolarHBondContact NH2-OE2 3.14Å; R66-E70 PolarHBondContact O-N 3.4Å |
| 67 | N | 79.3 | Confident | 75 | Confident | 109 Ų | 109 | 119.4 Ų | 119.4 | 58% | 0.583 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -67.5 | -10.7 | 177 | -72.1 | 0.6 | 0 | 0 | 0 | 114.8 | Q63 I64 | Q63-N67 PolarHBondContact O-N 2.83Å; I64-N67 PolarHBondContact O-N 2.76Å |
| 68 | I | 81 | Confident | 75.7 | Confident | 133 Ų | 133 | 120.4 Ų | 120.4 | 68% | 0.682 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -97 | -26.3 | 177 | -66.7 | 167.2 | 0 | 0 | 0 | 111.2 | I64 K65 R66 | I64-I68 HydrophobicContact CG2-CD1 4.04Å; I64-I68 WeakPolarHBondContact O-CG1 3.41Å; I64-I68 PolarHBondContact O-N 3.1Å; K65-I68 PolarHBondContact O-N 2.97Å; R66-I68 PolarHBondContact O-N 3.28Å |
| 69 | I | 73.2 | Confident | 76.3 | Confident | 127 Ų | 127 | 116.7 Ų | 116.7 | 65% | 0.651 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -100.7 | -21.8 | -173.3 | -53.3 | 165.2 | 0 | 0 | 0 | 111.3 | K65 R66 | K65-I69 HydrophobicContact CD-CD1 4.48Å; K65-I69 HydrophobicContact CG-CD1 3.79Å; K65-I69 WeakPolarHBondContact O-CD1 3.33Å; K65-I69 VanDerWaalsContact O-CG1 3.25Å; K65-I69 WeakPolarHBondContact O-CG1 3.11Å; K65-I69 PolarHBondContact O-N 3.36Å; R66-I69 PolarHBondContact O-N 3.48Å |
| 70 | E | 57.4 | Low | 76.8 | Confident | 183 Ų | 183 | 119.9 Ų | 119.9 | 86% | 0.855 | 58% | 0.582 | S | S | * | * | trans | -100.2 | 0 | 168 | -57 | -161.1 | 108.2 | 0 | 0 | 110.6 | R66 | R66-E70 HydrophobicContact CG-CG 4.3Å; R66-E70 WeakPolarHBondContact CG-OE2 3.41Å; R66-E70 IonicContact CZ-OE2 2.73Å; R66-E70 IonicContact NE-OE2 3.66Å; R66-E70 PolarHBondContact NE-OE2 3.3Å; R66-E70 IonicContact NH2-OE2 3.6Å; R66-E70 PolarHBondContact NH2-OE2 3.14Å; R66-E70 PolarHBondContact O-N 3.4Å |
Retrieved 70 of 70 residues in 23.5 ms
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