| 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 | 53.3 | Low | 70.5 | Confident | 242 Ų | 242 | 109.3 Ų | 109.3 | 100% | 1.192 | 60% | 0.604 | S | S | * | * | 0 | 114.8 | 0 | -165.7 | 156.5 | -144.3 | 0 | 0 | 106.7 | |||||
| 2 | I | 73.3 | Confident | 70.3 | Confident | 160 Ų | 160 | 112.8 Ų | 112.8 | 82% | 0.821 | 61% | 0.609 | S | S | * | * | P | Polyproline II helix | trans | -74.4 | 128 | -176.4 | -60.3 | 163.1 | 0 | 0 | 0 | 106.9 | L4 | I2-L4 PolarHBondContact O-N 3.22Š|
| 3 | P | 68.6 | Low | 69.9 | Low | 85 Ų | 85 | 111.8 Ų | 111.8 | 55% | 0.552 | 60% | 0.603 | S | S | * | * | P | Polyproline II helix | trans | -61.6 | 131.6 | 176 | 25.2 | -31.9 | 0 | 0 | 0 | 109.2 | ||
| 4 | L | 77.6 | Confident | 69.5 | Low | 118 Ų | 118 | 116.4 Ų | 116.4 | 62% | 0.618 | 62% | 0.615 | S | S | * | * | P | Polyproline II helix | trans | -70.6 | 149.5 | -178.7 | -149.8 | 102 | 0 | 0 | 0 | 108.5 | I2 S6 D7 | I2-L4 PolarHBondContact O-N 3.22Å; L4-S6 VanDerWaalsContact CD2-OG 3.23Å; L4-S6 WeakPolarHBondContact CD2-OG 3.49Å; L4-S6 PolarHBondContact O-N 3.01Å; L4-D7 PolarHBondContact N-OD2 2.91Å; L4-D7 WeakPolarHBondContact O-CB 3.3Å; L4-D7 PolarHBondContact O-N 3.35Å |
| 5 | H | 73.5 | Confident | 69.2 | Low | 147 Ų | 147 | 113.6 Ų | 113.6 | 68% | 0.681 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -53.5 | -31.3 | -179.9 | -178.7 | 71.9 | 0 | 0 | 0 | 112.8 | D7 I8 V9 | H5-D7 VanDerWaalsContact C-N 3.31Å; H5-D7 PolarHBondContact O-N 3.17Å; H5-I8 PolarHBondContact O-N 3.06Å; H5-V9 WeakPolarHBondContact O-CG2 3.48Å; H5-V9 PolarHBondContact O-N 3.28Å; H5-V9 VanDerWaalsContact O-N 3.16Å |
| 6 | S | 72.5 | Confident | 69 | Low | 61 Ų | 61 | 112.3 Ų | 112.3 | 43% | 0.427 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -59 | -37.6 | 174.4 | 54.5 | 0 | 0 | 0 | 0 | 113.6 | L4 V9 S10 | L4-S6 VanDerWaalsContact CD2-OG 3.23Å; L4-S6 WeakPolarHBondContact CD2-OG 3.49Å; L4-S6 PolarHBondContact O-N 3.01Å; S6-V9 PolarHBondContact O-N 2.94Å; S6-S10 WeakPolarHBondContact O-CB 3.47Å; S6-S10 PolarHBondContact O-N 3.09Å |
| 7 | D | 74.1 | Confident | 68.8 | Low | 91 Ų | 91 | 113.4 Ų | 113.4 | 49% | 0.487 | 60% | 0.595 | S | S | . | * | H | α-helix | trans | -76.1 | -33.3 | -174.1 | -50.7 | -27.3 | 0 | 0 | 0 | 110.6 | L4 H5 S11 | L4-D7 PolarHBondContact N-OD2 2.91Å; L4-D7 WeakPolarHBondContact O-CB 3.3Å; L4-D7 PolarHBondContact O-N 3.35Å; H5-D7 VanDerWaalsContact C-N 3.31Å; H5-D7 PolarHBondContact O-N 3.17Å; D7-S11 PolarHBondContact O-N 3.08Å; D7-S11 VanDerWaalsContact O-N 3.1Å; D7-S11 PolarHBondContact O-OG 2.96Å |
| 8 | I | 73.3 | Confident | 69 | Low | 83 Ų | 83 | 111.9 Ų | 111.9 | 43% | 0.426 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -69.2 | -39.7 | 174.8 | -51.8 | 175 | 0 | 0 | 0 | 110.5 | H5 S11 K12 | H5-I8 PolarHBondContact O-N 3.06Å; I8-S11 PolarHBondContact O-OG 2.98Å; I8-K12 WeakPolarHBondContact O-CB 3.48Å; I8-K12 VanDerWaalsContact O-CG 3.3Å; I8-K12 WeakPolarHBondContact O-CG 3.43Å; I8-K12 PolarHBondContact O-N 3.07Å; I8-K12 VanDerWaalsContact O-N 3.16Å |
| 9 | V | 73.4 | Confident | 69.2 | Low | 62 Ų | 62 | 111.5 Ų | 111.5 | 38% | 0.376 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -70.3 | -41.4 | 176.8 | 174.9 | 0 | 0 | 0 | 0 | 111 | H5 S6 S11 K12 L13 | H5-V9 WeakPolarHBondContact O-CG2 3.48Å; H5-V9 PolarHBondContact O-N 3.28Å; H5-V9 VanDerWaalsContact O-N 3.16Å; S6-V9 PolarHBondContact O-N 2.94Å; V9-S11 PolarHBondContact O-N 3.26Å; V9-K12 WeakPolarHBondContact O-CB 3.49Å; V9-K12 PolarHBondContact O-N 2.94Å; V9-L13 HydrophobicContact CG1-CD1 4.05Å; V9-L13 HydrophobicContact CG1-CG 4.37Å; V9-L13 WeakPolarHBondContact O-CG 3.5Å; V9-L13 PolarHBondContact O-N 3.22Å |
| 10 | S | 66.5 | Low | 69.6 | Low | 81 Ų | 81 | 109.7 Ų | 109.7 | 57% | 0.566 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -63.9 | -41.8 | 179.4 | -157.9 | 0 | 0 | 0 | 0 | 112.4 | S6 L13 F14 | S6-S10 WeakPolarHBondContact O-CB 3.47Å; S6-S10 PolarHBondContact O-N 3.09Å; S10-L13 PolarHBondContact O-N 3.07Å; S10-F14 WeakPolarHBondContact O-CB 3.42Å; S10-F14 PolarHBondContact O-N 3.48Å |
| 11 | S | 68.8 | Low | 69.9 | Low | 72 Ų | 72 | 107.6 Ų | 107.6 | 50% | 0.503 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -66.2 | -35.8 | 174.1 | 54.1 | 0 | 0 | 0 | 0 | 113.4 | D7 I8 V9 S15 | D7-S11 PolarHBondContact O-N 3.08Å; D7-S11 VanDerWaalsContact O-N 3.1Å; D7-S11 PolarHBondContact O-OG 2.96Å; I8-S11 PolarHBondContact O-OG 2.98Å; V9-S11 PolarHBondContact O-N 3.26Å; S11-S15 PolarHBondContact O-N 3.43Å |
| 12 | K | 69 | Low | 70.9 | Confident | 151 Ų | 151 | 98.7 Ų | 98.7 | 66% | 0.657 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -64.9 | -45.1 | 173.4 | -80.4 | -110.5 | -175.3 | 176.8 | 0 | 112.6 | I8 V9 F14 S15 E16 | I8-K12 WeakPolarHBondContact O-CB 3.48Å; I8-K12 VanDerWaalsContact O-CG 3.3Å; I8-K12 WeakPolarHBondContact O-CG 3.43Å; I8-K12 PolarHBondContact O-N 3.07Å; I8-K12 VanDerWaalsContact O-N 3.16Å; V9-K12 WeakPolarHBondContact O-CB 3.49Å; V9-K12 PolarHBondContact O-N 2.94Å; K12-F14 VanDerWaalsContact C-N 3.32Å; K12-F14 PolarHBondContact O-N 3.28Å; K12-S15 PolarHBondContact O-N 2.95Å; K12-E16 PolarHBondContact O-N 3.25Å |
| 13 | L | 65 | Low | 71.2 | Confident | 101 Ų | 101 | 99.9 Ų | 99.9 | 53% | 0.529 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -65.7 | -36.2 | 177.8 | -71.4 | 174.6 | 0 | 0 | 0 | 112 | V9 S10 S15 E16 K17 | V9-L13 HydrophobicContact CG1-CD1 4.05Å; V9-L13 HydrophobicContact CG1-CG 4.37Å; V9-L13 WeakPolarHBondContact O-CG 3.5Å; V9-L13 PolarHBondContact O-N 3.22Å; S10-L13 PolarHBondContact O-N 3.07Å; L13-S15 VanDerWaalsContact C-N 3.34Å; L13-E16 PolarHBondContact O-N 3.16Å; L13-K17 PolarHBondContact O-N 3.2Å |
| 14 | F | 64.7 | Low | 71.9 | Confident | 176 Ų | 176 | 104.5 Ų | 104.5 | 77% | 0.772 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -65.5 | -37.9 | 174 | -161.1 | -92.6 | 0 | 0 | 0 | 111.9 | S10 K12 | S10-F14 WeakPolarHBondContact O-CB 3.42Å; S10-F14 PolarHBondContact O-N 3.48Å; K12-F14 VanDerWaalsContact C-N 3.32Å; K12-F14 PolarHBondContact O-N 3.28Å |
| 15 | S | 64.8 | Low | 72.1 | Confident | 74 Ų | 74 | 103.5 Ų | 103.5 | 52% | 0.517 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -70.8 | -27.8 | 173.6 | -173.2 | 0 | 0 | 0 | 0 | 113.4 | S11 K12 L13 | S11-S15 PolarHBondContact O-N 3.43Å; K12-S15 PolarHBondContact O-N 2.95Å; L13-S15 VanDerWaalsContact C-N 3.34Å |
| 16 | E | 64.8 | Low | 72.5 | Confident | 92 Ų | 92 | 103.7 Ų | 103.7 | 43% | 0.43 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -78.8 | -25 | 179.5 | -167.9 | 172.6 | 142.2 | 0 | 0 | 112.8 | K12 L13 D18 I21 | K12-E16 PolarHBondContact O-N 3.25Å; L13-E16 PolarHBondContact O-N 3.16Å; E16-D18 PolarHBondContact O-N 3.38Å; E16-I21 HydrophobicContact CG-CG2 4Å |
| 17 | K | 65.9 | Low | 72.9 | Confident | 131 Ų | 131 | 104.8 Ų | 104.8 | 57% | 0.57 | 55% | 0.551 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71 | 7.9 | 172.5 | -81.2 | -166.5 | 168.5 | -171 | 0 | 114.1 | L13 D30 | L13-K17 PolarHBondContact O-N 3.2Å; K17-D30 IonicContact NZ-OD2 2.7Å; K17-D30 PolarHBondContact NZ-OD2 3.22Å |
| 18 | D | 72.5 | Confident | 73.2 | Confident | 87 Ų | 87 | 104.6 Ų | 104.6 | 47% | 0.465 | 56% | 0.562 | S | S | . | * | trans | -58.5 | 130.2 | 169.7 | -90.1 | -28.3 | 0 | 0 | 0 | 110.7 | E16 A20 I21 I22 | E16-D18 PolarHBondContact O-N 3.38Å; D18-A20 PolarHBondContact O-N 3.48Å; D18-I21 HydrophobicContact CB-CB 4.46Å; D18-I21 HydrophobicContact CB-CG1 4.07Å; D18-I21 PolarHBondContact O-N 2.97Å; D18-I22 PolarHBondContact O-N 3.43Å | ||
| 19 | P | 73.6 | Confident | 73.6 | Confident | 104 Ų | 104 | 105.3 Ų | 105.3 | 68% | 0.675 | 57% | 0.572 | S | S | * | * | H | α-helix | trans | -61.2 | -24.3 | -173.2 | 24.4 | -34.5 | 0 | 0 | 0 | 112.9 | K23 | P19-K23 WeakPolarHBondContact O-CB 3.42Å; P19-K23 PolarHBondContact O-N 3.02Å |
| 20 | A | 77.2 | Confident | 74 | Confident | 76 Ų | 76 | 108.6 Ų | 108.6 | 63% | 0.628 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -72.8 | -35.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | D18 K24 | D18-A20 PolarHBondContact O-N 3.48Å; A20-K24 WeakPolarHBondContact O-CB 3.23Å; A20-K24 PolarHBondContact O-N 3.1Å |
| 21 | I | 75.2 | Confident | 74.8 | Confident | 65 Ų | 65 | 109.8 Ų | 109.8 | 33% | 0.333 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -74.7 | -45.3 | 179 | -62.9 | -73.4 | 0 | 0 | 0 | 110 | E16 D18 K23 K24 L25 | E16-I21 HydrophobicContact CG-CG2 4Å; D18-I21 HydrophobicContact CB-CB 4.46Å; D18-I21 HydrophobicContact CB-CG1 4.07Å; D18-I21 PolarHBondContact O-N 2.97Å; I21-K23 VanDerWaalsContact C-N 3.26Å; I21-K23 PolarHBondContact O-N 3.39Å; I21-K24 PolarHBondContact O-N 2.9Å; I21-L25 HydrophobicContact CG2-CD1 3.56Å; I21-L25 HydrophobicContact CG2-CG 4.32Å; I21-L25 PolarHBondContact O-N 3.05Å |
| 22 | I | 75.3 | Confident | 75.7 | Confident | 55 Ų | 55 | 114 Ų | 114 | 28% | 0.282 | 59% | 0.591 | S | S | . | * | H | α-helix | trans | -54.5 | -44.9 | 176.8 | -62.6 | 179.8 | 0 | 0 | 0 | 110.7 | D18 N26 L27 | D18-I22 PolarHBondContact O-N 3.43Å; I22-N26 PolarHBondContact O-N 3.16Å; I22-N26 VanDerWaalsContact O-N 3.08Å; I22-L27 HydrophobicContact CG2-CB 3.93Å; I22-L27 PolarHBondContact O-N 3.42Å; I22-L27 VanDerWaalsContact O-N 3.09Å |
| 23 | K | 78.9 | Confident | 76.8 | Confident | 186 Ų | 186 | 114.8 Ų | 114.8 | 81% | 0.809 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -66.9 | -37.8 | 178.4 | -169.3 | 177.6 | -177.8 | -178.9 | 0 | 112.9 | P19 I21 | P19-K23 WeakPolarHBondContact O-CB 3.42Å; P19-K23 PolarHBondContact O-N 3.02Å; I21-K23 VanDerWaalsContact C-N 3.26Å; I21-K23 PolarHBondContact O-N 3.39Å |
| 24 | K | 82.5 | Confident | 78.1 | Confident | 181 Ų | 181 | 112.9 Ų | 112.9 | 79% | 0.787 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -70.9 | -36.2 | 179.9 | -173.4 | 179.7 | 178.8 | -173.6 | 0 | 112.4 | A20 I21 | A20-K24 WeakPolarHBondContact O-CB 3.23Å; A20-K24 PolarHBondContact O-N 3.1Å; I21-K24 PolarHBondContact O-N 2.9Å |
| 25 | L | 82.9 | Confident | 79.4 | Confident | 98 Ų | 98 | 111 Ų | 111 | 51% | 0.513 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -90.8 | -0.5 | -178.9 | -67.4 | 172.3 | 0 | 0 | 0 | 113.2 | I21 L27 | I21-L25 HydrophobicContact CG2-CD1 3.56Å; I21-L25 HydrophobicContact CG2-CG 4.32Å; I21-L25 PolarHBondContact O-N 3.05Å; L25-L27 HydrophobicContact CB-CD1 3.36Å; L25-L27 HydrophobicContact CD1-CD1 4.21Å; L25-L27 HydrophobicContact CG-CD1 4.42Å; L25-L27 PolarHBondContact O-N 2.7Å |
| 26 | N | 82.1 | Confident | 80.8 | Confident | 151 Ų | 151 | 110 Ų | 110 | 81% | 0.807 | 58% | 0.578 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 51.4 | 41 | -176.2 | -165.8 | 33.7 | 0 | 0 | 0 | 112.4 | I22 | I22-N26 PolarHBondContact O-N 3.16Å; I22-N26 VanDerWaalsContact O-N 3.08Å |
| 27 | L | 81.3 | Confident | 82.2 | Confident | 84 Ų | 84 | 111 Ų | 111 | 44% | 0.44 | 58% | 0.582 | S | S | . | * | P | Polyproline II helix | trans | -71.1 | 139.4 | 177.3 | -102.4 | 70.1 | 0 | 0 | 0 | 109.7 | I22 L25 | I22-L27 HydrophobicContact CG2-CB 3.93Å; I22-L27 PolarHBondContact O-N 3.42Å; I22-L27 VanDerWaalsContact O-N 3.09Å; L25-L27 HydrophobicContact CB-CD1 3.36Å; L25-L27 HydrophobicContact CD1-CD1 4.21Å; L25-L27 HydrophobicContact CG-CD1 4.42Å; L25-L27 PolarHBondContact O-N 2.7Å |
| 28 | A | 79.3 | Confident | 83.6 | Confident | 86 Ų | 86 | 108.2 Ų | 108.2 | 71% | 0.711 | 57% | 0.574 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 143.1 | 173.9 | 0 | 0 | 0 | 0 | 0 | 110.2 | ||
| 29 | P | 81.6 | Confident | 84.7 | Confident | 99 Ų | 99 | 108.7 Ų | 108.7 | 64% | 0.643 | 57% | 0.572 | S | S | * | * | P | Polyproline II helix | trans | -62.1 | 144.3 | 172.8 | 25.7 | -31.9 | 0 | 0 | 0 | 110.1 | I31 | P29-I31 HydrophobicContact CG-CD1 4.46Å; P29-I31 PolarHBondContact O-N 3.13Å; P29-I31 VanDerWaalsContact O-N 3.13Å |
| 30 | D | 81.3 | Confident | 85.8 | Confident | 130 Ų | 130 | 108.1 Ų | 108.1 | 70% | 0.695 | 56% | 0.56 | S | S | * | * | trans | -66.6 | 111.9 | 176.6 | -136.4 | -10.3 | 0 | 0 | 0 | 108.4 | K17 | K17-D30 IonicContact NZ-OD2 2.7Å; K17-D30 PolarHBondContact NZ-OD2 3.22Å | ||
| 31 | I | 84.3 | Confident | 86.7 | Confident | 106 Ų | 106 | 109.7 Ų | 109.7 | 54% | 0.544 | 56% | 0.557 | S | S | . | * | trans | -92.4 | 133.3 | 176.1 | -57.8 | -58.4 | 0 | 0 | 0 | 107.6 | P29 Y35 | P29-I31 HydrophobicContact CG-CD1 4.46Å; P29-I31 PolarHBondContact O-N 3.13Å; P29-I31 VanDerWaalsContact O-N 3.13Å; I31-Y35 HydrophobicContact CG2-CG 4.17Å | ||
| 32 | R | 87.9 | Confident | 87.7 | Confident | 160 Ų | 160 | 111 Ų | 111 | 60% | 0.604 | 57% | 0.568 | S | S | * | * | trans | -68.6 | 139.3 | 178 | -59.9 | 166.1 | 51 | 162.9 | 2.1 | 110.1 | D34 Y35 | R32-D34 WeakPolarHBondContact CB-OD1 3.27Å; R32-D34 IonicContact CZ-OD1 3.39Å; R32-D34 IonicContact CZ-OD2 3.62Å; R32-D34 IonicContact NE-OD1 3.2Å; R32-D34 PolarHBondContact NE-OD1 3.43Å; R32-D34 IonicContact NE-OD2 2.81Å; R32-D34 IonicContact NH2-OD1 2.68Å; R32-D34 PolarHBondContact NH2-OD1 2.81Å; R32-D34 IonicContact NH2-OD2 3.82Å; R32-D34 PolarHBondContact NH2-OD2 2.95Å; R32-D34 PolarHBondContact O-N 3.09Å; R32-Y35 WeakPolarHBondContact O-CB 3.17Å; R32-Y35 PolarHBondContact O-N 2.68Å; R32-Y35 VanDerWaalsContact O-N 3.09Å | ||
| 33 | D | 90.8 | Very high | 88.7 | Confident | 168 Ų | 168 | 111.1 Ų | 111.1 | 90% | 0.898 | 57% | 0.569 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.4 | -28.5 | 177.6 | -72.1 | -17.4 | 0 | 0 | 0 | 112.7 | Y35 | D33-Y35 VanDerWaalsContact C-N 3.29Å; D33-Y35 PolarHBondContact O-N 3.2Å |
| 34 | D | 92.9 | Very high | 89.6 | Confident | 62 Ų | 62 | 110.1 Ų | 110.1 | 33% | 0.332 | 56% | 0.56 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -88.1 | 12.4 | 179.6 | 69.9 | -26.1 | 0 | 0 | 0 | 114.2 | R32 A36 E37 L38 | R32-D34 WeakPolarHBondContact CB-OD1 3.27Å; R32-D34 IonicContact CZ-OD1 3.39Å; R32-D34 IonicContact CZ-OD2 3.62Å; R32-D34 IonicContact NE-OD1 3.2Å; R32-D34 PolarHBondContact NE-OD1 3.43Å; R32-D34 IonicContact NE-OD2 2.81Å; R32-D34 IonicContact NH2-OD1 2.68Å; R32-D34 PolarHBondContact NH2-OD1 2.81Å; R32-D34 IonicContact NH2-OD2 3.82Å; R32-D34 PolarHBondContact NH2-OD2 2.95Å; R32-D34 PolarHBondContact O-N 3.09Å; D34-A36 VanDerWaalsContact C-N 3.29Å; D34-A36 PolarHBondContact O-N 3.2Å; D34-E37 VanDerWaalsContact C-OE2 3.28Å; D34-E37 VanDerWaalsContact CA-OE2 3.27Å; D34-E37 WeakPolarHBondContact CA-OE2 3.14Å; D34-L38 WeakPolarHBondContact O-CG 3.27Å; D34-L38 PolarHBondContact O-N 2.91Å |
| 35 | Y | 92.5 | Very high | 90.3 | Very high | 137 Ų | 137 | 105.1 Ų | 105.1 | 54% | 0.537 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -62.2 | -36.8 | -177.7 | 177.5 | -98 | 0 | 0 | 0 | 112.4 | I31 R32 D33 F39 | I31-Y35 HydrophobicContact CG2-CG 4.17Å; R32-Y35 WeakPolarHBondContact O-CB 3.17Å; R32-Y35 PolarHBondContact O-N 2.68Å; R32-Y35 VanDerWaalsContact O-N 3.09Å; D33-Y35 VanDerWaalsContact C-N 3.29Å; D33-Y35 PolarHBondContact O-N 3.2Å; Y35-F39 VanDerWaalsContact O-CB 3.27Å; Y35-F39 WeakPolarHBondContact O-CB 3.29Å; Y35-F39 PolarHBondContact O-N 2.73Å |
| 36 | A | 92.9 | Very high | 91 | Very high | 53 Ų | 53 | 103.3 Ų | 103.3 | 44% | 0.438 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -64.7 | -45.9 | -177.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | D34 F39 Q40 | D34-A36 VanDerWaalsContact C-N 3.29Å; D34-A36 PolarHBondContact O-N 3.2Å; A36-F39 PolarHBondContact O-N 3.4Å; A36-Q40 PolarHBondContact O-N 3.03Å; A36-Q40 VanDerWaalsContact O-N 3.09Å |
| 37 | E | 95.4 | Very high | 91.7 | Very high | 111 Ų | 111 | 99.4 Ų | 99.4 | 52% | 0.519 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -64.9 | -47 | 179.6 | -64.4 | 79.2 | -178.1 | 0 | 0 | 110.9 | D34 F39 Q40 I41 | D34-E37 VanDerWaalsContact C-OE2 3.28Å; D34-E37 VanDerWaalsContact CA-OE2 3.27Å; D34-E37 WeakPolarHBondContact CA-OE2 3.14Å; E37-F39 VanDerWaalsContact C-N 3.33Å; E37-F39 PolarHBondContact O-N 3.43Å; E37-Q40 PolarHBondContact O-N 3.46Å; E37-I41 WeakPolarHBondContact O-CG1 3.41Å; E37-I41 PolarHBondContact O-N 2.96Å |
| 38 | L | 95 | Very high | 92.5 | Very high | 74 Ų | 74 | 97.9 Ų | 97.9 | 39% | 0.387 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.8 | -39.9 | 178.3 | -71.2 | 175.2 | 0 | 0 | 0 | 112.1 | D34 T42 | D34-L38 WeakPolarHBondContact O-CG 3.27Å; D34-L38 PolarHBondContact O-N 2.91Å; L38-T42 VanDerWaalsContact O-CB 3.29Å; L38-T42 WeakPolarHBondContact O-CB 3.29Å; L38-T42 PolarHBondContact O-N 3.34Å; L38-T42 PolarHBondContact O-OG1 3.22Å |
| 39 | F | 95 | Very high | 93.4 | Very high | 97 Ų | 97 | 98.8 Ų | 98.8 | 43% | 0.425 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -62.9 | -46.8 | 177.3 | 178.6 | -104.2 | 0 | 0 | 0 | 111.4 | Y35 A36 E37 T42 L43 | Y35-F39 VanDerWaalsContact O-CB 3.27Å; Y35-F39 WeakPolarHBondContact O-CB 3.29Å; Y35-F39 PolarHBondContact O-N 2.73Å; A36-F39 PolarHBondContact O-N 3.4Å; E37-F39 VanDerWaalsContact C-N 3.33Å; E37-F39 PolarHBondContact O-N 3.43Å; F39-T42 PolarHBondContact O-N 3.09Å; F39-L43 HydrophobicContact CE1-CD1 3.77Å; F39-L43 HydrophobicContact CZ-CD1 3.71Å; F39-L43 VanDerWaalsContact O-CB 3.23Å; F39-L43 WeakPolarHBondContact O-CB 3.32Å; F39-L43 PolarHBondContact O-N 3.05Å |
| 40 | Q | 96.6 | Very high | 94.2 | Very high | 91 Ų | 91 | 99 Ų | 99 | 43% | 0.425 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -62.5 | -47.2 | 179.4 | -113.8 | 66.7 | 81.2 | 0 | 0 | 112.4 | A36 E37 T42 L43 W44 | A36-Q40 PolarHBondContact O-N 3.03Å; A36-Q40 VanDerWaalsContact O-N 3.09Å; E37-Q40 PolarHBondContact O-N 3.46Å; Q40-T42 VanDerWaalsContact C-N 3.33Å; Q40-T42 PolarHBondContact O-N 3.44Å; Q40-L43 PolarHBondContact O-N 3.38Å; Q40-W44 PolarHBondContact O-N 2.92Å |
| 41 | I | 97.2 | Very high | 95 | Very high | 109 Ų | 109 | 98.4 Ų | 98.4 | 56% | 0.559 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -62.3 | -44.4 | -179.8 | -66.7 | 166.1 | 0 | 0 | 0 | 110.3 | E37 T45 | E37-I41 WeakPolarHBondContact O-CG1 3.41Å; E37-I41 PolarHBondContact O-N 2.96Å; I41-T45 WeakPolarHBondContact O-CB 3.23Å; I41-T45 PolarHBondContact O-N 3.47Å; I41-T45 PolarHBondContact O-OG1 3.43Å |
| 42 | T | 96.4 | Very high | 95.6 | Very high | 92 Ų | 92 | 97.7 Ų | 97.7 | 56% | 0.564 | 50% | 0.502 | S | S | * | . | H | α-helix | trans | -65.5 | -43.8 | -179.8 | -55.1 | 0 | 0 | 0 | 0 | 111.5 | L38 F39 Q40 S46 | L38-T42 VanDerWaalsContact O-CB 3.29Å; L38-T42 WeakPolarHBondContact O-CB 3.29Å; L38-T42 PolarHBondContact O-N 3.34Å; L38-T42 PolarHBondContact O-OG1 3.22Å; F39-T42 PolarHBondContact O-N 3.09Å; Q40-T42 VanDerWaalsContact C-N 3.33Å; Q40-T42 PolarHBondContact O-N 3.44Å; T42-S46 VanDerWaalsContact O-CB 3.32Å; T42-S46 WeakPolarHBondContact O-CB 3.36Å; T42-S46 PolarHBondContact O-N 3.42Å |
| 43 | L | 96.8 | Very high | 96.1 | Very high | 58 Ų | 58 | 95 Ų | 95 | 30% | 0.304 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60.7 | -52.5 | 179.7 | -176.5 | 157.1 | 0 | 0 | 0 | 111 | F39 Q40 S46 I47 | F39-L43 HydrophobicContact CE1-CD1 3.77Å; F39-L43 HydrophobicContact CZ-CD1 3.71Å; F39-L43 VanDerWaalsContact O-CB 3.23Å; F39-L43 WeakPolarHBondContact O-CB 3.32Å; F39-L43 PolarHBondContact O-N 3.05Å; Q40-L43 PolarHBondContact O-N 3.38Å; L43-S46 PolarHBondContact O-N 3.3Å; L43-I47 HydrophobicContact CD2-CD1 3.49Å; L43-I47 VanDerWaalsContact CD2-CD1 3.49Å; L43-I47 HydrophobicContact CD2-CG1 4.46Å; L43-I47 HydrophobicContact CG-CD1 4.33Å; L43-I47 WeakPolarHBondContact O-CG1 3.37Å; L43-I47 PolarHBondContact O-N 3.09Å; L43-I47 VanDerWaalsContact O-N 3.09Å |
| 44 | W | 96.9 | Very high | 96.4 | Very high | 165 Ų | 165 | 95.5 Ų | 95.5 | 63% | 0.625 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -69.7 | -36.3 | -177.2 | -71.8 | 117 | 0 | 0 | 0 | 112.7 | Q40 I47 A48 | Q40-W44 PolarHBondContact O-N 2.92Å; W44-I47 HydrophobicContact CE3-CD1 4.26Å; W44-I47 HydrophobicContact CZ3-CD1 4.35Å; W44-I47 PolarHBondContact O-N 3.49Å; W44-A48 WeakPolarHBondContact O-CB 3.33Å; W44-A48 PolarHBondContact O-N 2.98Å |
| 45 | T | 97.2 | Very high | 96.5 | Very high | 76 Ų | 76 | 94.5 Ų | 94.5 | 47% | 0.466 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -63.5 | -43.3 | 175.2 | -58.9 | 0 | 0 | 0 | 0 | 111.1 | I41 A48 L49 | I41-T45 WeakPolarHBondContact O-CB 3.23Å; I41-T45 PolarHBondContact O-N 3.47Å; I41-T45 PolarHBondContact O-OG1 3.43Å; T45-A48 PolarHBondContact O-N 2.95Å; T45-L49 HydrophobicContact CG2-CD1 4.13Å; T45-L49 VanDerWaalsContact O-CG 3.32Å; T45-L49 WeakPolarHBondContact O-CG 3.32Å; T45-L49 PolarHBondContact O-N 3.44Å |
| 46 | S | 97.7 | Very high | 96.7 | Very high | 61 Ų | 61 | 92 Ų | 92 | 43% | 0.427 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -62.3 | -47 | 177.3 | -176 | 0 | 0 | 0 | 0 | 112 | T42 L43 A48 L49 I50 | T42-S46 VanDerWaalsContact O-CB 3.32Å; T42-S46 WeakPolarHBondContact O-CB 3.36Å; T42-S46 PolarHBondContact O-N 3.42Å; L43-S46 PolarHBondContact O-N 3.3Å; S46-A48 PolarHBondContact O-N 3.47Å; S46-L49 PolarHBondContact O-N 3Å; S46-I50 VanDerWaalsContact O-CG1 3.29Å; S46-I50 WeakPolarHBondContact O-CG1 3.31Å; S46-I50 PolarHBondContact O-N 3.37Å |
| 47 | I | 97.9 | Very high | 96.9 | Very high | 69 Ų | 69 | 93 Ų | 93 | 35% | 0.354 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.5 | -46.1 | 177.8 | -67 | 173 | 0 | 0 | 0 | 111 | L43 W44 L49 I50 L51 | L43-I47 HydrophobicContact CD2-CD1 3.49Å; L43-I47 VanDerWaalsContact CD2-CD1 3.49Å; L43-I47 HydrophobicContact CD2-CG1 4.46Å; L43-I47 HydrophobicContact CG-CD1 4.33Å; L43-I47 WeakPolarHBondContact O-CG1 3.37Å; L43-I47 PolarHBondContact O-N 3.09Å; L43-I47 VanDerWaalsContact O-N 3.09Å; W44-I47 HydrophobicContact CE3-CD1 4.26Å; W44-I47 HydrophobicContact CZ3-CD1 4.35Å; W44-I47 PolarHBondContact O-N 3.49Å; I47-L49 VanDerWaalsContact C-N 3.34Å; I47-L49 PolarHBondContact O-N 2.98Å; I47-I50 PolarHBondContact O-N 2.69Å; I47-L51 HydrophobicContact CG2-CD1 4.16Å; I47-L51 WeakPolarHBondContact O-CG 3.18Å; I47-L51 PolarHBondContact O-N 2.94Å |
| 48 | A | 97.8 | Very high | 96.9 | Very high | 51 Ų | 51 | 95.5 Ų | 95.5 | 42% | 0.421 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -60.1 | -43.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | W44 T45 S46 I50 L51 V52 | W44-A48 WeakPolarHBondContact O-CB 3.33Å; W44-A48 PolarHBondContact O-N 2.98Å; T45-A48 PolarHBondContact O-N 2.95Å; S46-A48 PolarHBondContact O-N 3.47Å; A48-I50 PolarHBondContact O-N 3.42Å; A48-L51 PolarHBondContact O-N 3.29Å; A48-V52 VanDerWaalsContact O-CG2 3.31Å; A48-V52 WeakPolarHBondContact O-CG2 3.33Å; A48-V52 PolarHBondContact O-N 3.27Å |
| 49 | L | 97.8 | Very high | 96.8 | Very high | 106 Ų | 106 | 93.8 Ų | 93.8 | 56% | 0.555 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -62.9 | -41.8 | 177.2 | -73.6 | 172.9 | 0 | 0 | 0 | 112.3 | T45 S46 I47 L51 V52 V53 | T45-L49 HydrophobicContact CG2-CD1 4.13Å; T45-L49 VanDerWaalsContact O-CG 3.32Å; T45-L49 WeakPolarHBondContact O-CG 3.32Å; T45-L49 PolarHBondContact O-N 3.44Å; S46-L49 PolarHBondContact O-N 3Å; I47-L49 VanDerWaalsContact C-N 3.34Å; I47-L49 PolarHBondContact O-N 2.98Å; L49-L51 VanDerWaalsContact C-N 3.34Å; L49-L51 PolarHBondContact O-N 3.32Å; L49-V52 PolarHBondContact O-N 3.45Å; L49-V53 WeakPolarHBondContact O-CG2 3.5Å; L49-V53 PolarHBondContact O-N 3.04Å |
| 50 | I | 97.8 | Very high | 96.8 | Very high | 104 Ų | 104 | 94.5 Ų | 94.5 | 53% | 0.533 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -61 | -44.8 | 177 | -68.3 | 164 | 0 | 0 | 0 | 110.5 | S46 I47 A48 V52 V53 W54 | S46-I50 VanDerWaalsContact O-CG1 3.29Å; S46-I50 WeakPolarHBondContact O-CG1 3.31Å; S46-I50 PolarHBondContact O-N 3.37Å; I47-I50 PolarHBondContact O-N 2.69Å; A48-I50 PolarHBondContact O-N 3.42Å; I50-V52 PolarHBondContact O-N 2.98Å; I50-V53 PolarHBondContact O-N 3.5Å; I50-W54 VanDerWaalsContact O-CB 3.3Å; I50-W54 WeakPolarHBondContact O-CB 3.3Å; I50-W54 PolarHBondContact O-N 3.05Å |
| 51 | L | 97.7 | Very high | 96.5 | Very high | 116 Ų | 116 | 100.1 Ų | 100.1 | 61% | 0.607 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -64.6 | -39 | 178.1 | -69.5 | 174.5 | 0 | 0 | 0 | 112.5 | I47 A48 L49 W54 G55 | I47-L51 HydrophobicContact CG2-CD1 4.16Å; I47-L51 WeakPolarHBondContact O-CG 3.18Å; I47-L51 PolarHBondContact O-N 2.94Å; A48-L51 PolarHBondContact O-N 3.29Å; L49-L51 VanDerWaalsContact C-N 3.34Å; L49-L51 PolarHBondContact O-N 3.32Å; L51-W54 PolarHBondContact O-N 3.29Å; L51-G55 PolarHBondContact O-N 3.47Å |
| 52 | V | 97.7 | Very high | 96.1 | Very high | 92 Ų | 92 | 99.4 Ų | 99.4 | 56% | 0.558 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -63.9 | -49.3 | 176 | 169.8 | 0 | 0 | 0 | 0 | 110.8 | A48 L49 I50 W54 G55 V56 | A48-V52 VanDerWaalsContact O-CG2 3.31Å; A48-V52 WeakPolarHBondContact O-CG2 3.33Å; A48-V52 PolarHBondContact O-N 3.27Å; L49-V52 PolarHBondContact O-N 3.45Å; I50-V52 PolarHBondContact O-N 2.98Å; V52-W54 VanDerWaalsContact C-N 3.3Å; V52-W54 PolarHBondContact O-N 2.9Å; V52-G55 PolarHBondContact O-N 3.48Å; V52-V56 HydrophobicContact CG1-CG2 4.5Å; V52-V56 WeakPolarHBondContact O-CG2 3.44Å; V52-V56 PolarHBondContact O-N 2.93Å |
| 53 | V | 97.6 | Very high | 95.5 | Very high | 102 Ų | 102 | 101.4 Ų | 101.4 | 62% | 0.618 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -60.5 | -43.4 | 178.4 | 172.1 | 0 | 0 | 0 | 0 | 110.6 | L49 I50 V56 S57 | L49-V53 WeakPolarHBondContact O-CG2 3.5Å; L49-V53 PolarHBondContact O-N 3.04Å; I50-V53 PolarHBondContact O-N 3.5Å; V53-V56 PolarHBondContact O-N 2.98Å; V53-S57 WeakPolarHBondContact O-CB 3.37Å; V53-S57 PolarHBondContact O-N 3.46Å |
| 54 | W | 97.3 | Very high | 94.6 | Very high | 179 Ų | 179 | 103.6 Ų | 103.6 | 68% | 0.678 | 54% | 0.543 | S | S | * | . | H | α-helix | trans | -59.6 | -48.1 | 175.6 | -175.3 | -80.3 | 0 | 0 | 0 | 112 | I50 L51 V52 V56 S57 W58 | I50-W54 VanDerWaalsContact O-CB 3.3Å; I50-W54 WeakPolarHBondContact O-CB 3.3Å; I50-W54 PolarHBondContact O-N 3.05Å; L51-W54 PolarHBondContact O-N 3.29Å; V52-W54 VanDerWaalsContact C-N 3.3Å; V52-W54 PolarHBondContact O-N 2.9Å; W54-V56 PolarHBondContact O-N 3.33Å; W54-S57 PolarHBondContact O-N 3.48Å; W54-W58 WeakPolarHBondContact O-CB 3.41Å; W54-W58 PolarHBondContact O-N 3.28Å |
| 55 | G | 96.3 | Very high | 93.4 | Very high | 42 Ų | 42 | 100.7 Ų | 100.7 | 43% | 0.433 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -61.4 | -44 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | L51 V52 W58 G59 | L51-G55 PolarHBondContact O-N 3.47Å; V52-G55 PolarHBondContact O-N 3.48Å; G55-W58 PolarHBondContact O-N 2.95Å; G55-G59 PolarHBondContact O-N 3.41Å |
| 56 | V | 96.8 | Very high | 92 | Very high | 85 Ų | 85 | 98.8 Ų | 98.8 | 52% | 0.515 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -66.3 | -43.2 | 176.9 | 175 | 0 | 0 | 0 | 0 | 111.1 | V52 V53 W54 W58 G59 I60 | V52-V56 HydrophobicContact CG1-CG2 4.5Å; V52-V56 WeakPolarHBondContact O-CG2 3.44Å; V52-V56 PolarHBondContact O-N 2.93Å; V53-V56 PolarHBondContact O-N 2.98Å; W54-V56 PolarHBondContact O-N 3.33Å; V56-W58 VanDerWaalsContact C-N 3.3Å; V56-W58 PolarHBondContact O-N 3.14Å; V56-G59 PolarHBondContact O-N 3.4Å; V56-G59 VanDerWaalsContact O-N 3.14Å; V56-I60 HydrophobicContact CG1-CD1 3.93Å; V56-I60 HydrophobicContact CG1-CG1 4.44Å; V56-I60 WeakPolarHBondContact O-CG1 3.38Å; V56-I60 PolarHBondContact O-N 3.18Å |
| 57 | S | 96.3 | Very high | 90.4 | Very high | 73 Ų | 73 | 103.8 Ų | 103.8 | 51% | 0.51 | 55% | 0.55 | S | S | . | * | H | α-helix | trans | -59.3 | -43.1 | 176.5 | -173.7 | 0 | 0 | 0 | 0 | 111.6 | V53 W54 G59 I60 W61 | V53-S57 WeakPolarHBondContact O-CB 3.37Å; V53-S57 PolarHBondContact O-N 3.46Å; W54-S57 PolarHBondContact O-N 3.48Å; S57-G59 VanDerWaalsContact C-N 3.33Å; S57-I60 PolarHBondContact O-N 3.25Å; S57-W61 WeakPolarHBondContact O-CB 3.41Å; S57-W61 PolarHBondContact O-N 3.39Å |
| 58 | W | 95.4 | Very high | 88.7 | Confident | 164 Ų | 164 | 108.2 Ų | 108.2 | 62% | 0.621 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -65 | -39.1 | 176.1 | -169.3 | -88.2 | 0 | 0 | 0 | 112.1 | W54 G55 V56 W61 N62 | W54-W58 WeakPolarHBondContact O-CB 3.41Å; W54-W58 PolarHBondContact O-N 3.28Å; G55-W58 PolarHBondContact O-N 2.95Å; V56-W58 VanDerWaalsContact C-N 3.3Å; V56-W58 PolarHBondContact O-N 3.14Å; W58-W61 PolarHBondContact O-N 3.44Å; W58-N62 PolarHBondContact NE1-ND2 2.88Å; W58-N62 PolarHBondContact O-N 3.27Å; W58-N62 PolarHBondContact O-ND2 3.4Å |
| 59 | G | 93.6 | Very high | 87 | Confident | 38 Ų | 38 | 107.4 Ų | 107.4 | 39% | 0.392 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -58.2 | -53.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.6 | G55 V56 S57 W61 N62 M63 | G55-G59 PolarHBondContact O-N 3.41Å; V56-G59 PolarHBondContact O-N 3.4Å; V56-G59 VanDerWaalsContact O-N 3.14Å; S57-G59 VanDerWaalsContact C-N 3.33Å; G59-W61 VanDerWaalsContact C-N 3.31Å; G59-W61 PolarHBondContact O-N 3.01Å; G59-N62 PolarHBondContact O-N 2.95Å; G59-M63 VanDerWaalsContact O-CG 3.29Å; G59-M63 WeakPolarHBondContact O-CG 3.44Å; G59-M63 PolarHBondContact O-N 3.23Å |
| 60 | I | 93.5 | Very high | 85.5 | Confident | 111 Ų | 111 | 109 Ų | 109 | 57% | 0.569 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -60.6 | -41.3 | 179.6 | -66.2 | 170 | 0 | 0 | 0 | 111.2 | V56 S57 N62 M63 | V56-I60 HydrophobicContact CG1-CD1 3.93Å; V56-I60 HydrophobicContact CG1-CG1 4.44Å; V56-I60 WeakPolarHBondContact O-CG1 3.38Å; V56-I60 PolarHBondContact O-N 3.18Å; S57-I60 PolarHBondContact O-N 3.25Å; I60-N62 PolarHBondContact O-N 2.88Å; I60-M63 HydrophobicContact CG1-SD 4.46Å; I60-M63 PolarHBondContact O-N 3.26Å |
| 61 | W | 91.2 | Very high | 83.8 | Confident | 209 Ų | 209 | 108.8 Ų | 108.8 | 79% | 0.792 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -58.4 | -36.7 | 178.9 | -174 | -74.7 | 0 | 0 | 0 | 112.8 | S57 W58 G59 | S57-W61 WeakPolarHBondContact O-CB 3.41Å; S57-W61 PolarHBondContact O-N 3.39Å; W58-W61 PolarHBondContact O-N 3.44Å; G59-W61 VanDerWaalsContact C-N 3.31Å; G59-W61 PolarHBondContact O-N 3.01Å |
| 62 | N | 87.9 | Confident | 81.7 | Confident | 94 Ų | 94 | 106.2 Ų | 106.2 | 50% | 0.503 | 56% | 0.56 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -101.9 | 15.9 | -175 | -66 | -82.7 | 0 | 0 | 0 | 113.2 | W58 G59 I60 D64 | W58-N62 PolarHBondContact NE1-ND2 2.88Å; W58-N62 PolarHBondContact O-N 3.27Å; W58-N62 PolarHBondContact O-ND2 3.4Å; G59-N62 PolarHBondContact O-N 2.95Å; I60-N62 PolarHBondContact O-N 2.88Å; N62-D64 PolarHBondContact O-N 3.33Å; N62-D64 VanDerWaalsContact O-N 3.08Å |
| 63 | M | 84.9 | Confident | 80 | Confident | 135 Ų | 135 | 111.8 Ų | 111.8 | 67% | 0.665 | 57% | 0.571 | S | S | * | * | trans | -69.3 | 106.7 | 171.4 | -67.4 | -176.1 | 70.1 | 0 | 0 | 108.9 | G59 I60 P65 | G59-M63 VanDerWaalsContact O-CG 3.29Å; G59-M63 WeakPolarHBondContact O-CG 3.44Å; G59-M63 PolarHBondContact O-N 3.23Å; I60-M63 HydrophobicContact CG1-SD 4.46Å; I60-M63 PolarHBondContact O-N 3.26Å; M63-P65 WeakPolarHBondContact O-CD 3.33Å | ||
| 64 | D | 78.2 | Confident | 78.2 | Confident | 103 Ų | 103 | 109.8 Ų | 109.8 | 55% | 0.551 | 57% | 0.571 | S | S | * | * | trans | -61 | 119.2 | 171.2 | -175.1 | 15.3 | 0 | 0 | 0 | 108 | N62 G66 | N62-D64 PolarHBondContact O-N 3.33Å; N62-D64 VanDerWaalsContact O-N 3.08Å; D64-G66 PolarHBondContact O-N 3.19Å | ||
| 65 | P | 71.1 | Confident | 76.5 | Confident | 104 Ų | 104 | 105.5 Ų | 105.5 | 68% | 0.675 | 57% | 0.565 | S | S | * | * | trans | -69.6 | 24.1 | -170.3 | 27 | -36.5 | 0 | 0 | 0 | 115.3 | M63 | M63-P65 WeakPolarHBondContact O-CD 3.33Š| ||
| 66 | G | 67.9 | Low | 74.5 | Confident | 36 Ų | 36 | 110.4 Ų | 110.4 | 37% | 0.371 | 58% | 0.578 | S | S | . | * | trans | 72.5 | 118.1 | 179.4 | 0 | 0 | 0 | 0 | 0 | 111.4 | D64 D68 | D64-G66 PolarHBondContact O-N 3.19Å; G66-D68 PolarHBondContact O-N 2.94Å; G66-D68 VanDerWaalsContact O-N 3.07Å | ||
| 67 | R | 63.7 | Low | 72.5 | Confident | 167 Ų | 167 | 112.2 Ų | 112.2 | 63% | 0.63 | 59% | 0.589 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.4 | 2.9 | 178.4 | -63.5 | -147.8 | 175.5 | 133.7 | 1.9 | 116 | Y72 | R67-Y72 HydrophobicContact CB-CD2 4.03Å; R67-Y72 HydrophobicContact CB-CE1 4.49Å; R67-Y72 HydrophobicContact CB-CE2 3.72Å; R67-Y72 VanDerWaalsContact CD-CZ 3.47Å; R67-Y72 WeakPolarHBondContact CD-OH 3.18Å; R67-Y72 HydrophobicContact CG-CD2 4.43Å; R67-Y72 HydrophobicContact CG-CE1 4.12Å; R67-Y72 HydrophobicContact CG-CE2 3.65Å; R67-Y72 VanDerWaalsContact CG-CZ 3.43Å; R67-Y72 VanDerWaalsContact CG-OH 3.3Å; R67-Y72 WeakPolarHBondContact CG-OH 3.3Å; R67-Y72 PolarHBondContact NE-OH 3.1Å; R67-Y72 VanDerWaalsContact NE-OH 3.1Å; R67-Y72 WeakPolarHBondContact O-CD2 3.29Å |
| 68 | D | 63.2 | Low | 70.8 | Confident | 162 Ų | 162 | 119.3 Ų | 119.3 | 87% | 0.866 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -101.4 | 0.6 | -175.1 | -66.3 | -27.4 | 0 | 0 | 0 | 113.5 | G66 | G66-D68 PolarHBondContact O-N 2.94Å; G66-D68 VanDerWaalsContact O-N 3.07Å |
| 69 | G | 61.4 | Low | 68.9 | Low | 33 Ų | 33 | 117.1 Ų | 117.1 | 34% | 0.34 | 61% | 0.612 | S | S | . | * | S | Bend | trans | -84 | 167.5 | 175.5 | 0 | 0 | 0 | 0 | 0 | 114.9 | I71 Y72 | G69-I71 PolarHBondContact O-N 3.16Å; G69-Y72 PolarHBondContact O-N 3.18Å |
| 70 | I | 65.3 | Low | 66.9 | Low | 140 Ų | 140 | 124.7 Ų | 124.7 | 72% | 0.718 | 63% | 0.634 | S | S | * | * | G | 310 helix | trans | -49.9 | -19.4 | 179.6 | -159.9 | 161.1 | 0 | 0 | 0 | 114.8 | Y72 R73 | I70-Y72 VanDerWaalsContact C-N 3.28Å; I70-Y72 PolarHBondContact O-N 3.32Å; I70-R73 PolarHBondContact O-N 2.84Å; I70-R73 VanDerWaalsContact O-N 3.16Å |
| 71 | I | 63.9 | Low | 65 | Low | 100 Ų | 100 | 128.4 Ų | 128.4 | 51% | 0.513 | 65% | 0.649 | S | S | . | * | G | 310 helix | trans | -61.5 | -31.3 | -178.9 | -52.4 | -179.3 | 0 | 0 | 0 | 112.3 | G69 T75 | G69-I71 PolarHBondContact O-N 3.16Å; I71-T75 PolarHBondContact O-OG1 2.75Å |
| 72 | Y | 53.3 | Low | 63.5 | Low | 62 Ų | 62 | 129.6 Ų | 129.6 | 24% | 0.243 | 67% | 0.671 | C | S | . | * | G | 310 helix | trans | -86.5 | -14.7 | 178.4 | -72.4 | -86.5 | 0 | 0 | 0 | 113.9 | R67 G69 I70 G74 T75 M76 | R67-Y72 HydrophobicContact CB-CD2 4.03Å; R67-Y72 HydrophobicContact CB-CE1 4.49Å; R67-Y72 HydrophobicContact CB-CE2 3.72Å; R67-Y72 VanDerWaalsContact CD-CZ 3.47Å; R67-Y72 WeakPolarHBondContact CD-OH 3.18Å; R67-Y72 HydrophobicContact CG-CD2 4.43Å; R67-Y72 HydrophobicContact CG-CE1 4.12Å; R67-Y72 HydrophobicContact CG-CE2 3.65Å; R67-Y72 VanDerWaalsContact CG-CZ 3.43Å; R67-Y72 VanDerWaalsContact CG-OH 3.3Å; R67-Y72 WeakPolarHBondContact CG-OH 3.3Å; R67-Y72 PolarHBondContact NE-OH 3.1Å; R67-Y72 VanDerWaalsContact NE-OH 3.1Å; R67-Y72 WeakPolarHBondContact O-CD2 3.29Å; G69-Y72 PolarHBondContact O-N 3.18Å; I70-Y72 VanDerWaalsContact C-N 3.28Å; I70-Y72 PolarHBondContact O-N 3.32Å; Y72-G74 VanDerWaalsContact C-N 3.31Å; Y72-T75 WeakPolarHBondContact CA-OG1 3.35Å; Y72-M76 VanDerWaalsContact O-CG 3.29Å; Y72-M76 WeakPolarHBondContact O-CG 3.29Å; Y72-M76 PolarHBondContact O-N 3.08Å |
| 73 | R | 61.7 | Low | 62.3 | Low | 209 Ų | 209 | 131.4 Ų | 131.4 | 79% | 0.789 | 68% | 0.679 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.3 | -25.5 | 174.7 | -54.5 | -175.7 | -172.8 | -171.8 | 1.3 | 111.9 | I70 | I70-R73 PolarHBondContact O-N 2.84Å; I70-R73 VanDerWaalsContact O-N 3.16Å |
| 74 | G | 59.5 | Low | 61.1 | Low | 60 Ų | 60 | 131.2 Ų | 131.2 | 62% | 0.619 | 68% | 0.68 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.7 | -14.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 115.4 | Y72 | Y72-G74 VanDerWaalsContact C-N 3.31Š|
| 75 | T | 61.3 | Low | 60.2 | Low | 89 Ų | 89 | 132.7 Ų | 132.7 | 55% | 0.546 | 69% | 0.687 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -111 | -11 | -174.9 | 46.5 | 0 | 0 | 0 | 0 | 114.2 | I71 Y72 T77 | I71-T75 PolarHBondContact O-OG1 2.75Å; Y72-T75 WeakPolarHBondContact CA-OG1 3.35Å; T75-T77 PolarHBondContact O-N 3.07Å |
| 76 | M | 53.6 | Low | 59.6 | Low | 144 Ų | 144 | 134.4 Ų | 134.4 | 71% | 0.709 | 69% | 0.688 | S | S | * | * | trans | -75.5 | 12.7 | 174.6 | -75.6 | -165.7 | -159.3 | 0 | 0 | 115.1 | Y72 R78 | Y72-M76 VanDerWaalsContact O-CG 3.29Å; Y72-M76 WeakPolarHBondContact O-CG 3.29Å; Y72-M76 PolarHBondContact O-N 3.08Å; M76-R78 PolarHBondContact O-N 3.2Å | ||
| 77 | T | 56.6 | Low | 59 | Low | 123 Ų | 123 | 140.6 Ų | 140.6 | 76% | 0.755 | 71% | 0.708 | S | S | * | * | trans | -72.9 | 63.3 | 160.6 | 56.7 | 0 | 0 | 0 | 0 | 109.7 | T75 | T75-T77 PolarHBondContact O-N 3.07Š| ||
| 78 | R | 59.4 | Low | 58.7 | Low | 222 Ų | 222 | 138.8 Ų | 138.8 | 84% | 0.838 | 71% | 0.713 | S | S | * | * | trans | -62 | 127.2 | 154.4 | -64.8 | -178.8 | 110 | -161.8 | 2 | 105.1 | M76 K80 | M76-R78 PolarHBondContact O-N 3.2Å; R78-K80 PolarHBondContact O-N 2.81Å | ||
| 79 | P | 56.1 | Low | 58.4 | Low | 118 Ų | 118 | 137.1 Ų | 137.1 | 77% | 0.766 | 70% | 0.702 | S | S | * | * | trans | -57.3 | 128.9 | 172.6 | -7.7 | 19.1 | 0 | 0 | 0 | 106.8 | Q81 | P79-Q81 PolarHBondContact O-N 3.03Š| ||
| 80 | K | 51.3 | Low | 58.2 | Low | 198 Ų | 198 | 145.2 Ų | 145.2 | 86% | 0.861 | 73% | 0.73 | S | S | * | * | trans | -54.6 | 115.5 | 165.6 | -98.3 | 174.3 | 167 | -178.8 | 0 | 106.3 | R78 | R78-K80 PolarHBondContact O-N 2.81Š| ||
| 81 | Q | 54.1 | Low | 57.6 | Low | 189 Ų | 189 | 145.6 Ų | 145.6 | 88% | 0.883 | 73% | 0.731 | S | S | * | * | trans | -83.4 | 124.3 | 157.4 | -90.3 | 178.3 | -48.9 | 0 | 0 | 106 | P79 | P79-Q81 PolarHBondContact O-N 3.03Š| ||
| 82 | D | 60.2 | Low | 57 | Low | 233 Ų | 233 | 149.7 Ų | 149.7 | 100% | 1.246 | 75% | 0.75 | S | S | * | * | trans | -57.9 | 0 | -177.7 | -57.1 | -55.2 | 0 | 0 | 0 | 113.4 |
Retrieved 82 of 82 residues in 208.7 ms
(Link to these results)