| 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 | 77.7 | Confident | 92.7 | Very high | 91 Ų | 91 | 98.5 Ų | 98.5 | 45% | 0.448 | 48% | 0.481 | S | S | . | . | 0 | 151.7 | 0 | 173.3 | -177.8 | 87 | 0 | 0 | 110.6 | F4 F33 L48 P49 | M1-F4 HydrophobicContact CE-CE2 4.14Å; M1-F33 HydrophobicContact CG-CE1 4.45Å; M1-F33 HydrophobicContact SD-CE1 4.41Å; M1-L48 HydrophobicContact SD-CB 3.85Å; M1-L48 HydrophobicContact SD-CD2 4.21Å; M1-P49 HydrophobicContact CB-CG 4.49Å; M1-P49 WeakPolarHBondContact CB-O 3.24Å | |||
| 2 | K | 83.1 | Confident | 93.1 | Very high | 149 Ų | 149 | 93.6 Ų | 93.6 | 65% | 0.648 | 46% | 0.464 | S | S | * | . | P | Polyproline II helix | trans | -70.4 | 138.2 | 173.1 | -176.3 | 175 | 171.6 | -171.3 | 0 | 109.4 | L29 | K2-L29 HydrophobicContact CB-CD2 4.48Å; K2-L29 HydrophobicContact CD-CD1 4.06Å; K2-L29 HydrophobicContact CG-CD1 4.33Å |
| 3 | K | 89.1 | Confident | 93.3 | Very high | 149 Ų | 149 | 94.5 Ų | 94.5 | 65% | 0.648 | 48% | 0.481 | S | S | * | . | P | Polyproline II helix | trans | -66.1 | 143 | 176.3 | -170.4 | -175.1 | 168.2 | -172.5 | 0 | 109.6 | E6 | K3-E6 IonicContact NZ-OE1 2.69Å; K3-E6 PolarHBondContact NZ-OE1 3.25Å |
| 4 | F | 93.1 | Very high | 93.3 | Very high | 48 Ų | 48 | 93.1 Ų | 93.1 | 21% | 0.211 | 47% | 0.47 | C | S | . | . | P | Polyproline II helix | trans | -62.7 | 128.1 | 168.3 | -73.2 | -96.7 | 0 | 0 | 0 | 109.7 | M1 E6 M27 L29 | M1-F4 HydrophobicContact CE-CE2 4.14Å; F4-E6 PolarHBondContact O-N 3.03Å; F4-M27 HydrophobicContact CB-CB 4.33Å; F4-M27 HydrophobicContact CB-SD 4.29Å; F4-M27 HydrophobicContact CD1-CB 3.66Å; F4-M27 HydrophobicContact CE1-CB 4.2Å; F4-M27 HydrophobicContact CG-CB 4.09Å; F4-M27 HydrophobicContact CG-SD 4.28Å; F4-L29 HydrophobicContact CD1-CB 3.38Å; F4-L29 HydrophobicContact CD1-CD2 4.44Å; F4-L29 HydrophobicContact CD2-CD2 4.49Å; F4-L29 HydrophobicContact CE1-CB 3.41Å; F4-L29 VanDerWaalsContact CE1-CB 3.41Å; F4-L29 HydrophobicContact CE1-CD2 4.36Å; F4-L29 HydrophobicContact CE2-CD2 4.39Å; F4-L29 HydrophobicContact CG-CB 4.12Å; F4-L29 HydrophobicContact CZ-CB 4.15Å; F4-L29 HydrophobicContact CZ-CD2 4.32Å |
| 5 | P | 95 | Very high | 93.1 | Very high | 48 Ų | 48 | 97.2 Ų | 97.2 | 31% | 0.312 | 48% | 0.478 | S | S | . | . | P | Polyproline II helix | trans | -68.4 | 122.4 | 174.8 | 25.3 | -30.1 | 0 | 0 | 0 | 110.1 | S7 E8 N28 | P5-S7 PolarHBondContact O-N 3.49Å; P5-E8 HydrophobicContact CB-CG 4.26Å; P5-E8 HydrophobicContact CG-CB 3.94Å; P5-E8 HydrophobicContact CG-CG 3.7Å; P5-E8 PolarHBondContact O-N 3.04Å; P5-N28 WeakPolarHBondContact CD-O 3.35Å |
| 6 | E | 95.4 | Very high | 92.9 | Very high | 140 Ų | 140 | 91.9 Ų | 91.9 | 65% | 0.654 | 45% | 0.452 | S | S | * | . | G | 310 helix | trans | -61.3 | -29.7 | -178 | -68.9 | 171.5 | -152.7 | 0 | 0 | 112.4 | K3 F4 E8 T9 | K3-E6 IonicContact NZ-OE1 2.69Å; K3-E6 PolarHBondContact NZ-OE1 3.25Å; F4-E6 PolarHBondContact O-N 3.03Å; E6-E8 PolarHBondContact O-N 3.46Å; E6-T9 WeakPolarHBondContact O-CB 3.44Å; E6-T9 PolarHBondContact O-N 2.76Å; E6-T9 VanDerWaalsContact O-N 3.16Å |
| 7 | S | 96.7 | Very high | 92.6 | Very high | 91 Ų | 91 | 86.6 Ų | 86.6 | 64% | 0.636 | 43% | 0.426 | S | S | * | . | G | 310 helix | trans | -65.8 | -20.8 | 175.4 | 60.5 | 0 | 0 | 0 | 0 | 114 | P5 | P5-S7 PolarHBondContact O-N 3.49Š|
| 8 | E | 97 | Very high | 92.2 | Very high | 76 Ų | 76 | 88.2 Ų | 88.2 | 36% | 0.355 | 43% | 0.43 | S | S | . | . | G | 310 helix | trans | -95.5 | -1.2 | 176.6 | -60.1 | -53.4 | 131.3 | 0 | 0 | 113 | P5 E6 K10 N28 | P5-E8 HydrophobicContact CB-CG 4.26Å; P5-E8 HydrophobicContact CG-CB 3.94Å; P5-E8 HydrophobicContact CG-CG 3.7Å; P5-E8 PolarHBondContact O-N 3.04Å; E6-E8 PolarHBondContact O-N 3.46Å; E8-K10 PolarHBondContact O-N 2.81Å; E8-K10 IonicContact OE2-NZ 3.98Å; E8-K10 PolarHBondContact OE2-NZ 2.66Å; E8-N28 HydrophobicContact CB-CB 4.2Å |
| 9 | T | 97.3 | Very high | 91.9 | Very high | 41 Ų | 41 | 89.6 Ų | 89.6 | 25% | 0.252 | 44% | 0.444 | S | S | . | . | trans | -73.9 | 119 | 169.3 | -58.2 | 0 | 0 | 0 | 0 | 109.1 | E6 Q25 M26 M27 | E6-T9 WeakPolarHBondContact O-CB 3.44Å; E6-T9 PolarHBondContact O-N 2.76Å; E6-T9 VanDerWaalsContact O-N 3.16Å; T9-Q25 HydrophobicContact CG2-CB 4.02Å; T9-M26 WeakPolarHBondContact CA-O 3.48Å; T9-M27 HydrophobicContact CG2-CG 4.4Å | ||
| 10 | K | 97.6 | Very high | 91.7 | Very high | 113 Ų | 113 | 89.3 Ų | 89.3 | 49% | 0.491 | 44% | 0.444 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.3 | 153.5 | -175.3 | -65.3 | 171.2 | -170.6 | 152 | 0 | 110.3 | E8 C12 M26 | E8-K10 PolarHBondContact O-N 2.81Å; E8-K10 IonicContact OE2-NZ 3.98Å; E8-K10 PolarHBondContact OE2-NZ 2.66Å; K10-C12 PolarHBondContact O-N 3.24Å; K10-M26 PolarHBondContact N-O 3.36Å; K10-M26 PolarHBondContact O-N 3.18Å |
| 11 | E | 98 | Very high | 91.8 | Very high | 137 Ų | 137 | 88.7 Ų | 88.7 | 64% | 0.64 | 45% | 0.446 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -67.1 | 124.7 | 171.2 | -168.4 | 171.9 | 96.5 | 0 | 0 | 109.5 | P23 V24 | E11-P23 HydrophobicContact CG-CB 3.61Å; E11-V24 CarbonylContact C-O 3.59Å; E11-V24 WeakPolarHBondContact CA-O 3.5Å |
| 12 | C | 96.9 | Very high | 92.5 | Very high | 40 Ų | 40 | 88.9 Ų | 88.9 | 27% | 0.27 | 44% | 0.444 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.5 | 149 | -179.7 | -69.8 | 0 | 0 | 0 | 0 | 110.4 | K10 P23 V24 M26 | K10-C12 PolarHBondContact O-N 3.24Å; C12-P23 WeakPolarHBondContact O-CA 3.3Å; C12-V24 PolarHBondContact N-O 2.81Å; C12-V24 PolarHBondContact O-N 2.94Å; C12-M26 HydrophobicContact CB-CB 3.78Å; C12-M26 HydrophobicContact CB-CE 4.41Å; C12-M26 HydrophobicContact CB-CG 4.49Å; C12-M26 HydrophobicContact CB-SD 4.02Å |
| 13 | P | 96 | Very high | 93.1 | Very high | 106 Ų | 106 | 85.9 Ų | 85.9 | 69% | 0.688 | 44% | 0.44 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -68.4 | 133.8 | 174 | 27.6 | -33 | 0 | 0 | 0 | 111 | T21 | P13-T21 HydrophobicContact CB-CG2 3.55Å |
| 14 | F | 92.9 | Very high | 93.4 | Very high | 75 Ų | 75 | 81.2 Ų | 81.2 | 33% | 0.329 | 42% | 0.424 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.1 | 125.7 | 173.9 | -172.3 | -86.4 | 0 | 0 | 0 | 110.4 | I16 T21 K22 V24 M26 L72 | F14-I16 HydrophobicContact CD1-CG2 4.12Å; F14-I16 PolarHBondContact O-N 3.13Å; F14-T21 CarbonylContact O-C 3.58Å; F14-T21 VanDerWaalsContact O-CA 3.3Å; F14-T21 WeakPolarHBondContact O-CA 2.84Å; F14-K22 PolarHBondContact N-O 2.86Å; F14-K22 PolarHBondContact O-N 3.38Å; F14-V24 HydrophobicContact CB-CB 4.41Å; F14-V24 HydrophobicContact CB-CG1 3.84Å; F14-V24 HydrophobicContact CB-CG2 3.67Å; F14-V24 HydrophobicContact CD2-CG2 4.49Å; F14-V24 HydrophobicContact CG-CG1 4.45Å; F14-V24 HydrophobicContact CG-CG2 4.34Å; F14-M26 HydrophobicContact CD2-CE 4.15Å; F14-L72 HydrophobicContact CE1-CD1 3.74Å; F14-L72 HydrophobicContact CZ-CD1 3.97Å |
| 15 | R | 91.1 | Very high | 93.6 | Very high | 154 Ų | 154 | 84.8 Ų | 84.8 | 58% | 0.581 | 44% | 0.441 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -77.4 | 118.2 | 178.8 | -65.7 | -178.9 | -177.4 | 173.9 | -0.2 | 109.6 | D64 V65 | R15-D64 IonicContact NH1-OD1 2.8Å; R15-V65 HydrophobicContact CB-CG2 4.26Å |
| 16 | I | 89.3 | Confident | 93.7 | Very high | 12 Ų | 12 | 86.3 Ų | 86.3 | 6% | 0.062 | 45% | 0.445 | C | S | . | . | S | Bend | trans | -94.2 | -23.3 | 176.9 | 63.2 | 172.1 | 0 | 0 | 0 | 111.8 | F14 D20 K22 T70 E73 | F14-I16 HydrophobicContact CD1-CG2 4.12Å; F14-I16 PolarHBondContact O-N 3.13Å; I16-D20 HydrophobicContact CD1-CB 3.76Å; I16-D20 HydrophobicContact CG1-CB 3.53Å; I16-D20 WeakPolarHBondContact CG1-O 3.41Å; I16-D20 PolarHBondContact N-O 3.12Å; I16-K22 HydrophobicContact CD1-CD 3.84Å; I16-K22 HydrophobicContact CD1-CG 4.1Å; I16-T70 WeakPolarHBondContact O-CB 3.46Å; I16-T70 WeakPolarHBondContact O-CG2 3.32Å; I16-T70 PolarHBondContact O-N 3.03Å; I16-T70 PolarHBondContact O-OG1 3.34Å; I16-E73 HydrophobicContact CD1-CG 4.44Å |
| 17 | S | 87.6 | Confident | 93.8 | Very high | 3 Ų | 3 | 85.1 Ų | 85.1 | 2% | 0.021 | 44% | 0.441 | C | S | . | . | S | Bend | trans | -148.4 | -176.7 | 175.2 | 73.3 | 0 | 0 | 0 | 0 | 108.6 | T19 D20 E68 E73 | S17-T19 PolarHBondContact O-N 2.86Å; S17-T19 PolarHBondContact OG-N 2.79Å; S17-T19 PolarHBondContact OG-OG1 2.77Å; S17-D20 PolarHBondContact N-O 3.32Å; S17-D20 VanDerWaalsContact OG-CB 3.32Å; S17-D20 WeakPolarHBondContact OG-CB 3.42Å; S17-D20 PolarHBondContact OG-N 2.79Å; S17-D20 PolarHBondContact OG-OD2 3.14Å; S17-E68 WeakPolarHBondContact CB-O 3.17Å; S17-E73 WeakPolarHBondContact CB-OE1 3.48Å |
| 18 | K | 85.6 | Confident | 93.7 | Very high | 115 Ų | 115 | 85.5 Ų | 85.5 | 50% | 0.5 | 44% | 0.436 | S | S | . | . | S | Bend | trans | -61 | -30.5 | 172.8 | -71.9 | 179 | -173.6 | 150.1 | 0 | 113.4 | V65 E66 E68 | K18-V65 WeakPolarHBondContact CG-O 3.5Å; K18-E66 VanDerWaalsContact CE-C 3.46Å; K18-E66 WeakPolarHBondContact CE-O 3.28Å; K18-E66 PolarHBondContact NZ-O 3.49Å; K18-E68 IonicContact NZ-OE1 2.79Å; K18-E68 PolarHBondContact NZ-OE1 3.01Å |
| 19 | T | 87 | Confident | 93.5 | Very high | 114 Ų | 114 | 83 Ų | 83 | 70% | 0.699 | 43% | 0.425 | S | S | * | . | S | Bend | trans | -106.2 | -27.2 | -172.7 | 48.6 | 0 | 0 | 0 | 0 | 112.9 | S17 | S17-T19 PolarHBondContact O-N 2.86Å; S17-T19 PolarHBondContact OG-N 2.79Å; S17-T19 PolarHBondContact OG-OG1 2.77Å |
| 20 | D | 88.6 | Confident | 93.2 | Very high | 83 Ų | 83 | 89.8 Ų | 89.8 | 44% | 0.444 | 45% | 0.454 | S | S | . | . | trans | -109.1 | 134.1 | -168.7 | -58.9 | -65.4 | 0 | 0 | 0 | 112.2 | I16 S17 | I16-D20 HydrophobicContact CD1-CB 3.76Å; I16-D20 HydrophobicContact CG1-CB 3.53Å; I16-D20 WeakPolarHBondContact CG1-O 3.41Å; I16-D20 PolarHBondContact N-O 3.12Å; S17-D20 PolarHBondContact N-O 3.32Å; S17-D20 VanDerWaalsContact OG-CB 3.32Å; S17-D20 WeakPolarHBondContact OG-CB 3.42Å; S17-D20 PolarHBondContact OG-N 2.79Å; S17-D20 PolarHBondContact OG-OD2 3.14Å | ||
| 21 | T | 92.4 | Very high | 92.9 | Very high | 78 Ų | 78 | 86.9 Ų | 86.9 | 48% | 0.479 | 45% | 0.451 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.7 | 133.9 | 176.4 | -64.1 | 0 | 0 | 0 | 0 | 108.6 | P13 F14 | P13-T21 HydrophobicContact CB-CG2 3.55Å; F14-T21 CarbonylContact O-C 3.58Å; F14-T21 VanDerWaalsContact O-CA 3.3Å; F14-T21 WeakPolarHBondContact O-CA 2.84Å |
| 22 | K | 92.6 | Very high | 92.5 | Very high | 95 Ų | 95 | 87.3 Ų | 87.3 | 41% | 0.413 | 46% | 0.463 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.1 | 145.5 | 177 | -69.7 | -177.2 | 179.8 | 169.7 | 0 | 110.3 | F14 I16 | F14-K22 PolarHBondContact N-O 2.86Å; F14-K22 PolarHBondContact O-N 3.38Å; I16-K22 HydrophobicContact CD1-CD 3.84Å; I16-K22 HydrophobicContact CD1-CG 4.1Å |
| 23 | P | 96.6 | Very high | 92.1 | Very high | 86 Ų | 86 | 88.1 Ų | 88.1 | 56% | 0.558 | 46% | 0.462 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -68.5 | 134.8 | 170.2 | 28 | -31.9 | 0 | 0 | 0 | 109.9 | E11 C12 | E11-P23 HydrophobicContact CG-CB 3.61Å; C12-P23 WeakPolarHBondContact O-CA 3.3Å |
| 24 | V | 95.6 | Very high | 91.8 | Very high | 51 Ų | 51 | 87.4 Ų | 87.4 | 31% | 0.309 | 46% | 0.458 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.6 | 153.7 | 173.6 | -57.8 | 0 | 0 | 0 | 0 | 110 | E11 C12 F14 M26 | E11-V24 CarbonylContact C-O 3.59Å; E11-V24 WeakPolarHBondContact CA-O 3.5Å; C12-V24 PolarHBondContact N-O 2.81Å; C12-V24 PolarHBondContact O-N 2.94Å; F14-V24 HydrophobicContact CB-CB 4.41Å; F14-V24 HydrophobicContact CB-CG1 3.84Å; F14-V24 HydrophobicContact CB-CG2 3.67Å; F14-V24 HydrophobicContact CD2-CG2 4.49Å; F14-V24 HydrophobicContact CG-CG1 4.45Å; F14-V24 HydrophobicContact CG-CG2 4.34Å; V24-M26 HydrophobicContact CG2-CE 4.24Å; V24-M26 PolarHBondContact O-N 2.94Å |
| 25 | Q | 97.6 | Very high | 91.8 | Very high | 123 Ų | 123 | 89 Ų | 89 | 58% | 0.575 | 47% | 0.47 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -77.2 | 102.4 | 169.9 | -65.6 | -62.4 | -51.9 | 0 | 0 | 108.9 | T9 | T9-Q25 HydrophobicContact CG2-CB 4.02Å |
| 26 | M | 97 | Very high | 91.8 | Very high | 79 Ų | 79 | 83 Ų | 83 | 39% | 0.389 | 46% | 0.456 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.1 | 120.1 | -175.4 | -173.4 | 164 | -74.2 | 0 | 0 | 110.7 | T9 K10 C12 F14 V24 | T9-M26 WeakPolarHBondContact CA-O 3.48Å; K10-M26 PolarHBondContact N-O 3.36Å; K10-M26 PolarHBondContact O-N 3.18Å; C12-M26 HydrophobicContact CB-CB 3.78Å; C12-M26 HydrophobicContact CB-CE 4.41Å; C12-M26 HydrophobicContact CB-CG 4.49Å; C12-M26 HydrophobicContact CB-SD 4.02Å; F14-M26 HydrophobicContact CD2-CE 4.15Å; V24-M26 HydrophobicContact CG2-CE 4.24Å; V24-M26 PolarHBondContact O-N 2.94Å |
| 27 | M | 96.2 | Very high | 92 | Very high | 115 Ų | 115 | 87.5 Ų | 87.5 | 57% | 0.567 | 48% | 0.48 | S | S | * | . | trans | -77.2 | 144.5 | 174.4 | -58.2 | -175.8 | -67.2 | 0 | 0 | 110.6 | F4 T9 | F4-M27 HydrophobicContact CB-CB 4.33Å; F4-M27 HydrophobicContact CB-SD 4.29Å; F4-M27 HydrophobicContact CD1-CB 3.66Å; F4-M27 HydrophobicContact CE1-CB 4.2Å; F4-M27 HydrophobicContact CG-CB 4.09Å; F4-M27 HydrophobicContact CG-SD 4.28Å; T9-M27 HydrophobicContact CG2-CG 4.4Å | ||
| 28 | N | 94.3 | Very high | 92.1 | Very high | 99 Ų | 99 | 90.1 Ų | 90.1 | 53% | 0.529 | 49% | 0.493 | S | S | . | . | trans | -131.6 | 135.4 | 177.7 | -172.1 | -40.4 | 0 | 0 | 0 | 110.9 | P5 E8 | P5-N28 WeakPolarHBondContact CD-O 3.35Å; E8-N28 HydrophobicContact CB-CB 4.2Å | ||
| 29 | L | 92.8 | Very high | 92.3 | Very high | 24 Ų | 24 | 91 Ų | 91 | 13% | 0.126 | 50% | 0.504 | C | S | . | . | trans | -146.8 | 125.4 | 175.6 | 171.5 | 63.8 | 0 | 0 | 0 | 109.7 | K2 F4 A31 F33 | K2-L29 HydrophobicContact CB-CD2 4.48Å; K2-L29 HydrophobicContact CD-CD1 4.06Å; K2-L29 HydrophobicContact CG-CD1 4.33Å; F4-L29 HydrophobicContact CD1-CB 3.38Å; F4-L29 HydrophobicContact CD1-CD2 4.44Å; F4-L29 HydrophobicContact CD2-CD2 4.49Å; F4-L29 HydrophobicContact CE1-CB 3.41Å; F4-L29 VanDerWaalsContact CE1-CB 3.41Å; F4-L29 HydrophobicContact CE1-CD2 4.36Å; F4-L29 HydrophobicContact CE2-CD2 4.39Å; F4-L29 HydrophobicContact CG-CB 4.12Å; F4-L29 HydrophobicContact CZ-CB 4.15Å; F4-L29 HydrophobicContact CZ-CD2 4.32Å; L29-A31 HydrophobicContact CG-CB 4.33Å; L29-F33 HydrophobicContact CD2-CZ 3.92Å; L29-F33 HydrophobicContact CG-CZ 4.43Å | ||
| 30 | E | 92.2 | Very high | 92.4 | Very high | 183 Ų | 183 | 93.4 Ų | 93.4 | 86% | 0.855 | 51% | 0.512 | S | S | * | . | trans | -89.8 | 115.9 | 169.4 | -166.1 | 178.9 | 144.9 | 0 | 0 | 110.2 | ||||
| 31 | A | 90.4 | Very high | 92.2 | Very high | 53 Ų | 53 | 94.4 Ų | 94.4 | 44% | 0.438 | 52% | 0.516 | S | S | . | . | trans | -163.6 | 168.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | L29 F33 | L29-A31 HydrophobicContact CG-CB 4.33Å; A31-F33 HydrophobicContact CB-CD2 4.38Å; A31-F33 HydrophobicContact CB-CE2 3.63Å; A31-F33 HydrophobicContact CB-CZ 3.77Å; A31-F33 VanDerWaalsContact O-CD2 3.3Å; A31-F33 WeakPolarHBondContact O-CD2 3.43Å | ||
| 32 | T | 90.2 | Very high | 92 | Very high | 146 Ų | 146 | 93.9 Ų | 93.9 | 90% | 0.896 | 52% | 0.516 | S | S | * | . | trans | -83.8 | 125.9 | 173.3 | -48.5 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 33 | F | 88.7 | Confident | 92 | Very high | 57 Ų | 57 | 90.1 Ų | 90.1 | 25% | 0.25 | 50% | 0.501 | C | S | . | . | trans | -128.9 | 157 | 177.8 | -61.9 | -80.7 | 0 | 0 | 0 | 111.4 | M1 L29 A31 L35 I46 L48 | M1-F33 HydrophobicContact CG-CE1 4.45Å; M1-F33 HydrophobicContact SD-CE1 4.41Å; L29-F33 HydrophobicContact CD2-CZ 3.92Å; L29-F33 HydrophobicContact CG-CZ 4.43Å; A31-F33 HydrophobicContact CB-CD2 4.38Å; A31-F33 HydrophobicContact CB-CE2 3.63Å; A31-F33 HydrophobicContact CB-CZ 3.77Å; A31-F33 VanDerWaalsContact O-CD2 3.3Å; A31-F33 WeakPolarHBondContact O-CD2 3.43Å; F33-L35 PolarHBondContact O-N 3.34Å; F33-I46 HydrophobicContact CB-CD1 3.77Å; F33-I46 HydrophobicContact CB-CG1 3.96Å; F33-I46 HydrophobicContact CD2-CD1 4.2Å; F33-I46 HydrophobicContact CG-CD1 3.98Å; F33-I46 HydrophobicContact CG-CG1 4.48Å; F33-L48 HydrophobicContact CD1-CD2 3.53Å; F33-L48 HydrophobicContact CE1-CD2 3.41Å; F33-L48 VanDerWaalsContact CE1-CD2 3.41Å; F33-L48 HydrophobicContact CG-CD2 4.27Å; F33-L48 HydrophobicContact CZ-CD2 4.06Å | ||
| 34 | C | 90 | Very high | 91.9 | Very high | 90 Ų | 90 | 91.3 Ų | 91.3 | 61% | 0.608 | 50% | 0.498 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -73.2 | 107.6 | 166.1 | -63.7 | 0 | 0 | 0 | 0 | 108.5 | I46 E47 | C34-I46 WeakPolarHBondContact O-CA 3.21Å; C34-E47 HydrophobicContact CB-CB 4.44Å; C34-E47 PolarHBondContact O-N 2.69Å |
| 35 | L | 91.4 | Very high | 91.8 | Very high | 109 Ų | 109 | 91 Ų | 91 | 57% | 0.571 | 49% | 0.494 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -112.1 | 126.4 | 174.2 | -176.1 | 74.8 | 0 | 0 | 0 | 108.7 | F33 K44 I45 I46 | F33-L35 PolarHBondContact O-N 3.34Å; L35-K44 HydrophobicContact CD1-CB 4.48Å; L35-I45 CarbonylContact C-O 3.59Å; L35-I45 WeakPolarHBondContact CA-O 2.9Å; L35-I46 HydrophobicContact CD1-CB 3.97Å |
| 36 | G | 92.9 | Very high | 91.7 | Very high | 28 Ų | 28 | 87.3 Ų | 87.3 | 29% | 0.289 | 48% | 0.478 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.1 | 159.1 | 171.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | K44 I45 | G36-K44 WeakPolarHBondContact O-CA 3.33Å; G36-I45 PolarHBondContact N-O 3.16Å; G36-I45 PolarHBondContact O-N 3.38Å |
| 37 | N | 92.6 | Very high | 91.5 | Very high | 106 Ų | 106 | 87.1 Ų | 87.1 | 57% | 0.567 | 48% | 0.476 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -114.2 | 139.2 | 166.6 | -58.6 | -54.6 | 0 | 0 | 0 | 108.1 | ||
| 38 | I | 90.7 | Very high | 91.2 | Very high | 58 Ų | 58 | 82.6 Ų | 82.6 | 30% | 0.297 | 45% | 0.454 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112 | 89.7 | 174.9 | -47.5 | 173.8 | 0 | 0 | 0 | 106.1 | D40 I41 S42 C43 I45 | I38-D40 VanDerWaalsContact C-N 3.31Å; I38-D40 PolarHBondContact O-N 3Å; I38-I41 HydrophobicContact CB-CD1 4.33Å; I38-I41 HydrophobicContact CB-CG1 3.91Å; I38-I41 HydrophobicContact CD1-CD1 4.27Å; I38-I41 HydrophobicContact CG2-CD1 4Å; I38-I41 HydrophobicContact CG2-CG1 3.58Å; I38-I41 PolarHBondContact O-N 3.3Å; I38-S42 PolarHBondContact O-N 3.19Å; I38-C43 HydrophobicContact CB-CB 4.47Å; I38-C43 PolarHBondContact N-O 3.07Å; I38-C43 PolarHBondContact O-N 2.94Å; I38-C43 VanDerWaalsContact O-N 3.14Å; I38-I45 HydrophobicContact CD1-CB 4.24Å; I38-I45 HydrophobicContact CD1-CG2 4.25Å; I38-I45 HydrophobicContact CG1-CG2 4.17Å |
| 39 | D | 88.4 | Confident | 91 | Very high | 135 Ų | 135 | 79.5 Ų | 79.5 | 72% | 0.722 | 44% | 0.439 | S | S | * | . | G | 310 helix | trans | -62.7 | -37.6 | -170.6 | -65 | -32.7 | 0 | 0 | 0 | 112.2 | I41 S42 | D39-I41 PolarHBondContact O-N 3.39Å; D39-I41 VanDerWaalsContact O-N 3.12Å; D39-S42 PolarHBondContact O-N 2.79Å; D39-S42 VanDerWaalsContact O-N 3.13Å |
| 40 | D | 89 | Confident | 90.7 | Very high | 163 Ų | 163 | 82.6 Ų | 82.6 | 87% | 0.872 | 45% | 0.452 | S | S | * | . | G | 310 helix | trans | -57.1 | -29.7 | -179.3 | -68 | -11.9 | 0 | 0 | 0 | 113.9 | I38 | I38-D40 VanDerWaalsContact C-N 3.31Å; I38-D40 PolarHBondContact O-N 3Å |
| 41 | I | 85.8 | Confident | 90.2 | Very high | 104 Ų | 104 | 81.4 Ų | 81.4 | 53% | 0.533 | 45% | 0.446 | S | S | . | . | G | 310 helix | trans | -120.7 | 11.2 | 179.9 | 60.6 | 169.6 | 0 | 0 | 0 | 112.5 | I38 D39 C43 | I38-I41 HydrophobicContact CB-CD1 4.33Å; I38-I41 HydrophobicContact CB-CG1 3.91Å; I38-I41 HydrophobicContact CD1-CD1 4.27Å; I38-I41 HydrophobicContact CG2-CD1 4Å; I38-I41 HydrophobicContact CG2-CG1 3.58Å; I38-I41 PolarHBondContact O-N 3.3Å; D39-I41 PolarHBondContact O-N 3.39Å; D39-I41 VanDerWaalsContact O-N 3.12Å; I41-C43 HydrophobicContact CD1-CB 3.98Å; I41-C43 HydrophobicContact CG1-CB 3.92Å; I41-C43 PolarHBondContact O-N 3.22Å; I41-C43 PolarHBondContact O-SG 3.34Å; I41-C43 VanDerWaalsContact O-SG 3.34Å |
| 42 | S | 88.3 | Confident | 89.7 | Confident | 67 Ų | 67 | 85.2 Ų | 85.2 | 47% | 0.469 | 46% | 0.459 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 49.6 | 41.8 | -179 | -67.4 | 0 | 0 | 0 | 0 | 114 | I38 D39 K63 | I38-S42 PolarHBondContact O-N 3.19Å; D39-S42 PolarHBondContact O-N 2.79Å; D39-S42 VanDerWaalsContact O-N 3.13Å; S42-K63 WeakPolarHBondContact O-CB 3.3Å; S42-K63 PolarHBondContact O-N 3.46Å |
| 43 | C | 92.2 | Very high | 89.1 | Confident | 16 Ų | 16 | 86.6 Ų | 86.6 | 11% | 0.108 | 45% | 0.453 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.9 | 150 | 179.9 | -71.1 | 0 | 0 | 0 | 0 | 112 | I38 I41 V60 L61 P62 | I38-C43 HydrophobicContact CB-CB 4.47Å; I38-C43 PolarHBondContact N-O 3.07Å; I38-C43 PolarHBondContact O-N 2.94Å; I38-C43 VanDerWaalsContact O-N 3.14Å; I41-C43 HydrophobicContact CD1-CB 3.98Å; I41-C43 HydrophobicContact CG1-CB 3.92Å; I41-C43 PolarHBondContact O-N 3.22Å; I41-C43 PolarHBondContact O-SG 3.34Å; I41-C43 VanDerWaalsContact O-SG 3.34Å; C43-V60 HydrophobicContact CB-CG1 3.8Å; C43-L61 CarbonylContact C-O 3.57Å; C43-L61 WeakPolarHBondContact CA-O 3.42Å; C43-P62 VanDerWaalsContact SG-CA 3.57Å |
| 44 | K | 93.3 | Very high | 88.9 | Confident | 112 Ų | 112 | 92 Ų | 92 | 49% | 0.487 | 48% | 0.479 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.3 | 141.8 | 164.3 | -63.2 | -174.9 | 178.1 | 173.7 | 0 | 109.1 | L35 G36 V60 L61 | L35-K44 HydrophobicContact CD1-CB 4.48Å; G36-K44 WeakPolarHBondContact O-CA 3.33Å; K44-V60 CarbonylContact O-C 3.57Å; K44-V60 WeakPolarHBondContact O-CA 3.37Å; K44-L61 PolarHBondContact N-O 3.34Å; K44-L61 PolarHBondContact O-N 2.82Å |
| 45 | I | 94.3 | Very high | 88.9 | Confident | 44 Ų | 44 | 92.8 Ų | 92.8 | 23% | 0.226 | 48% | 0.476 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.6 | 132.7 | 172.9 | -172 | 170.4 | 0 | 0 | 0 | 110 | L35 G36 I38 L58 I59 V60 | L35-I45 CarbonylContact C-O 3.59Å; L35-I45 WeakPolarHBondContact CA-O 2.9Å; G36-I45 PolarHBondContact N-O 3.16Å; G36-I45 PolarHBondContact O-N 3.38Å; I38-I45 HydrophobicContact CD1-CB 4.24Å; I38-I45 HydrophobicContact CD1-CG2 4.25Å; I38-I45 HydrophobicContact CG1-CG2 4.17Å; I45-L58 HydrophobicContact CD1-CD2 4.29Å; I45-I59 CarbonylContact C-O 3.57Å; I45-I59 VanDerWaalsContact CA-O 3.28Å; I45-I59 WeakPolarHBondContact CA-O 3.43Å; I45-V60 HydrophobicContact CB-CG2 4.46Å; I45-V60 HydrophobicContact CD1-CG2 3.91Å; I45-V60 HydrophobicContact CG1-CG2 4.01Å |
| 46 | I | 94.6 | Very high | 88.8 | Confident | 45 Ų | 45 | 89.7 Ų | 89.7 | 23% | 0.231 | 46% | 0.464 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.8 | 137.2 | 174.6 | -173.3 | 169.8 | 0 | 0 | 0 | 110.1 | F33 C34 L35 L48 I59 | F33-I46 HydrophobicContact CB-CD1 3.77Å; F33-I46 HydrophobicContact CB-CG1 3.96Å; F33-I46 HydrophobicContact CD2-CD1 4.2Å; F33-I46 HydrophobicContact CG-CD1 3.98Å; F33-I46 HydrophobicContact CG-CG1 4.48Å; C34-I46 WeakPolarHBondContact O-CA 3.21Å; L35-I46 HydrophobicContact CD1-CB 3.97Å; I46-L48 HydrophobicContact CD1-CD2 4.23Å; I46-L48 HydrophobicContact CG1-CD2 4.28Å; I46-I59 HydrophobicContact CG2-CB 3.71Å; I46-I59 HydrophobicContact CG2-CD1 4.35Å; I46-I59 HydrophobicContact CG2-CG1 4.39Å; I46-I59 HydrophobicContact CG2-CG2 4.42Å; I46-I59 PolarHBondContact N-O 2.91Å; I46-I59 PolarHBondContact O-N 3.11Å |
| 47 | E | 92.5 | Very high | 88.8 | Confident | 75 Ų | 75 | 92.7 Ų | 92.7 | 35% | 0.35 | 47% | 0.471 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.5 | 125.9 | 173.6 | -171.1 | -170.3 | 174.4 | 0 | 0 | 111.1 | C34 S56 L58 | C34-E47 HydrophobicContact CB-CB 4.44Å; C34-E47 PolarHBondContact O-N 2.69Å; E47-S56 VanDerWaalsContact OE1-CB 3.24Å; E47-S56 WeakPolarHBondContact OE1-CB 3.33Å; E47-S56 PolarHBondContact OE1-OG 3.21Å; E47-L58 HydrophobicContact CB-CD2 3.76Å; E47-L58 HydrophobicContact CG-CD2 3.81Å |
| 48 | L | 91.1 | Very high | 88.7 | Confident | 20 Ų | 20 | 92.9 Ų | 92.9 | 11% | 0.105 | 47% | 0.472 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.4 | 98.1 | 175.3 | -60.9 | -177.3 | 0 | 0 | 0 | 109.7 | M1 F33 I46 M57 I59 | M1-L48 HydrophobicContact SD-CB 3.85Å; M1-L48 HydrophobicContact SD-CD2 4.21Å; F33-L48 HydrophobicContact CD1-CD2 3.53Å; F33-L48 HydrophobicContact CE1-CD2 3.41Å; F33-L48 VanDerWaalsContact CE1-CD2 3.41Å; F33-L48 HydrophobicContact CG-CD2 4.27Å; F33-L48 HydrophobicContact CZ-CD2 4.06Å; I46-L48 HydrophobicContact CD1-CD2 4.23Å; I46-L48 HydrophobicContact CG1-CD2 4.28Å; L48-M57 HydrophobicContact CB-CB 4.29Å; L48-M57 PolarHBondContact N-O 2.74Å; L48-M57 PolarHBondContact O-N 2.86Å; L48-I59 HydrophobicContact CD1-CD1 3.61Å; L48-I59 HydrophobicContact CG-CD1 4.45Å |
| 49 | P | 89.1 | Confident | 88.9 | Confident | 35 Ų | 35 | 93.4 Ų | 93.4 | 23% | 0.227 | 47% | 0.474 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -74.3 | 132.7 | -178.6 | 27.8 | -33.4 | 0 | 0 | 0 | 111.6 | M1 | M1-P49 HydrophobicContact CB-CG 4.49Å; M1-P49 WeakPolarHBondContact CB-O 3.24Å |
| 50 | F | 86.9 | Confident | 89 | Confident | 88 Ų | 88 | 90.6 Ų | 90.6 | 39% | 0.386 | 46% | 0.462 | S | S | . | . | trans | -69.3 | 179.1 | 172.8 | -76.6 | -94.6 | 0 | 0 | 0 | 112.2 | N52 K53 L55 M57 | F50-N52 PolarHBondContact O-N 2.8Å; F50-K53 PolarHBondContact O-N 2.93Å; F50-L55 HydrophobicContact CB-CB 4.13Å; F50-L55 WeakPolarHBondContact CB-O 3.45Å; F50-L55 HydrophobicContact CD2-CB 3.88Å; F50-L55 HydrophobicContact CD2-CD2 3.72Å; F50-L55 HydrophobicContact CD2-CG 3.76Å; F50-L55 HydrophobicContact CE2-CD2 3.74Å; F50-L55 HydrophobicContact CE2-CG 4.08Å; F50-L55 HydrophobicContact CG-CB 4.24Å; F50-L55 HydrophobicContact CG-CD2 4.23Å; F50-L55 HydrophobicContact CG-CG 4.48Å; F50-L55 HydrophobicContact CZ-CD2 4.31Å; F50-L55 PolarHBondContact N-O 2.89Å; F50-M57 HydrophobicContact CE2-CB 3.89Å; F50-M57 HydrophobicContact CZ-CE 4.1Å | ||
| 51 | Q | 81.6 | Confident | 89.2 | Confident | 158 Ų | 158 | 87.8 Ų | 87.8 | 74% | 0.738 | 45% | 0.446 | S | S | * | . | G | 310 helix | trans | -55.5 | 140 | 173.1 | -69.1 | -176.7 | -18.8 | 0 | 0 | 110.2 | K53 | Q51-K53 PolarHBondContact O-N 3.46Š|
| 52 | N | 79.9 | Confident | 89.4 | Confident | 134 Ų | 134 | 86.3 Ų | 86.3 | 72% | 0.717 | 44% | 0.443 | S | S | * | . | G | 310 helix | trans | 60.5 | 10.6 | -179.8 | -52.6 | -26.9 | 0 | 0 | 0 | 115.7 | F50 H54 | F50-N52 PolarHBondContact O-N 2.8Å; N52-H54 PolarHBondContact O-CD2 3.42Å; N52-H54 PolarHBondContact O-N 3.27Å |
| 53 | K | 78 | Confident | 89.4 | Confident | 175 Ų | 175 | 91.5 Ų | 91.5 | 76% | 0.761 | 46% | 0.457 | S | S | * | . | G | 310 helix | trans | 56.6 | 18.7 | 175.1 | -54.7 | -175.7 | 179.3 | -175.8 | 0 | 115.3 | F50 Q51 L55 | F50-K53 PolarHBondContact O-N 2.93Å; Q51-K53 PolarHBondContact O-N 3.46Å; K53-L55 VanDerWaalsContact C-N 3.28Å |
| 54 | H | 85.3 | Confident | 89 | Confident | 170 Ų | 170 | 95 Ų | 95 | 79% | 0.787 | 48% | 0.476 | S | S | * | . | S | Bend | trans | -76.8 | -18.3 | 175.7 | -67.8 | -66.8 | 0 | 0 | 0 | 113 | N52 | N52-H54 PolarHBondContact O-CD2 3.42Å; N52-H54 PolarHBondContact O-N 3.27Å |
| 55 | L | 89.6 | Confident | 88.4 | Confident | 106 Ų | 106 | 91.1 Ų | 91.1 | 56% | 0.555 | 46% | 0.461 | S | S | * | . | trans | -139.1 | 145.6 | 178 | -170.9 | 71.2 | 0 | 0 | 0 | 108.4 | F50 K53 | F50-L55 HydrophobicContact CB-CB 4.13Å; F50-L55 WeakPolarHBondContact CB-O 3.45Å; F50-L55 HydrophobicContact CD2-CB 3.88Å; F50-L55 HydrophobicContact CD2-CD2 3.72Å; F50-L55 HydrophobicContact CD2-CG 3.76Å; F50-L55 HydrophobicContact CE2-CD2 3.74Å; F50-L55 HydrophobicContact CE2-CG 4.08Å; F50-L55 HydrophobicContact CG-CB 4.24Å; F50-L55 HydrophobicContact CG-CD2 4.23Å; F50-L55 HydrophobicContact CG-CG 4.48Å; F50-L55 HydrophobicContact CZ-CD2 4.31Å; F50-L55 PolarHBondContact N-O 2.89Å; K53-L55 VanDerWaalsContact C-N 3.28Å | ||
| 56 | S | 89.5 | Confident | 87.3 | Confident | 44 Ų | 44 | 95.9 Ų | 95.9 | 31% | 0.308 | 48% | 0.482 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.5 | 138 | 170.5 | -69.6 | 0 | 0 | 0 | 0 | 109.4 | E47 | E47-S56 VanDerWaalsContact OE1-CB 3.24Å; E47-S56 WeakPolarHBondContact OE1-CB 3.33Å; E47-S56 PolarHBondContact OE1-OG 3.21Å |
| 57 | M | 91.5 | Very high | 86.2 | Confident | 92 Ų | 92 | 99.2 Ų | 99.2 | 45% | 0.453 | 50% | 0.5 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -89 | 126.9 | 166 | 179.6 | -179.5 | -68.4 | 0 | 0 | 108.1 | L48 F50 I59 | L48-M57 HydrophobicContact CB-CB 4.29Å; L48-M57 PolarHBondContact N-O 2.74Å; L48-M57 PolarHBondContact O-N 2.86Å; F50-M57 HydrophobicContact CE2-CB 3.89Å; F50-M57 HydrophobicContact CZ-CE 4.1Å; M57-I59 HydrophobicContact CG-CG1 4.04Å; M57-I59 HydrophobicContact SD-CD1 4.18Å; M57-I59 HydrophobicContact SD-CG1 4.12Å |
| 58 | L | 92.2 | Very high | 85 | Confident | 110 Ų | 110 | 102.2 Ų | 102.2 | 58% | 0.576 | 51% | 0.514 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -102.2 | 123.7 | 170 | -67.5 | 171.2 | 0 | 0 | 0 | 108 | I45 E47 | I45-L58 HydrophobicContact CD1-CD2 4.29Å; E47-L58 HydrophobicContact CB-CD2 3.76Å; E47-L58 HydrophobicContact CG-CD2 3.81Å |
| 59 | I | 93 | Very high | 84 | Confident | 68 Ų | 68 | 104 Ų | 104 | 35% | 0.349 | 53% | 0.528 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.6 | 118.7 | 175.1 | -57 | 174.3 | 0 | 0 | 0 | 107.1 | I45 I46 L48 M57 | I45-I59 CarbonylContact C-O 3.57Å; I45-I59 VanDerWaalsContact CA-O 3.28Å; I45-I59 WeakPolarHBondContact CA-O 3.43Å; I46-I59 HydrophobicContact CG2-CB 3.71Å; I46-I59 HydrophobicContact CG2-CD1 4.35Å; I46-I59 HydrophobicContact CG2-CG1 4.39Å; I46-I59 HydrophobicContact CG2-CG2 4.42Å; I46-I59 PolarHBondContact N-O 2.91Å; I46-I59 PolarHBondContact O-N 3.11Å; L48-I59 HydrophobicContact CD1-CD1 3.61Å; L48-I59 HydrophobicContact CG-CD1 4.45Å; M57-I59 HydrophobicContact CG-CG1 4.04Å; M57-I59 HydrophobicContact SD-CD1 4.18Å; M57-I59 HydrophobicContact SD-CG1 4.12Å |
| 60 | V | 92.4 | Very high | 83.3 | Confident | 77 Ų | 77 | 104.8 Ų | 104.8 | 47% | 0.467 | 53% | 0.533 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.2 | 119 | 172.2 | -174.9 | 0 | 0 | 0 | 0 | 107.4 | C43 K44 I45 | C43-V60 HydrophobicContact CB-CG1 3.8Å; K44-V60 CarbonylContact O-C 3.57Å; K44-V60 WeakPolarHBondContact O-CA 3.37Å; I45-V60 HydrophobicContact CB-CG2 4.46Å; I45-V60 HydrophobicContact CD1-CG2 3.91Å; I45-V60 HydrophobicContact CG1-CG2 4.01Å |
| 61 | L | 92 | Very high | 82.7 | Confident | 104 Ų | 104 | 103.9 Ų | 103.9 | 55% | 0.545 | 55% | 0.548 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.3 | 115.4 | -176.8 | -174.8 | 69.2 | 0 | 0 | 0 | 109.4 | C43 K44 | C43-L61 CarbonylContact C-O 3.57Å; C43-L61 WeakPolarHBondContact CA-O 3.42Å; K44-L61 PolarHBondContact N-O 3.34Å; K44-L61 PolarHBondContact O-N 2.82Å |
| 62 | P | 90.4 | Very high | 82.6 | Confident | 72 Ų | 72 | 101.3 Ų | 101.3 | 47% | 0.468 | 54% | 0.539 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -63.1 | 153 | 172.6 | 27.2 | -34.1 | 0 | 0 | 0 | 111.1 | C43 D64 | C43-P62 VanDerWaalsContact SG-CA 3.57Å; P62-D64 VanDerWaalsContact C-N 3.27Å; P62-D64 PolarHBondContact O-N 2.88Å |
| 63 | K | 87.3 | Confident | 82.1 | Confident | 176 Ų | 176 | 98.8 Ų | 98.8 | 77% | 0.765 | 52% | 0.523 | S | S | * | . | S | Bend | trans | -63.5 | -32.7 | -179.6 | -176.9 | 178.8 | 178.1 | -174.5 | 0 | 112.9 | S42 | S42-K63 WeakPolarHBondContact O-CB 3.3Å; S42-K63 PolarHBondContact O-N 3.46Å |
| 64 | D | 84.3 | Confident | 81.4 | Confident | 91 Ų | 91 | 102.6 Ų | 102.6 | 49% | 0.487 | 54% | 0.539 | S | S | . | . | S | Bend | trans | -146.4 | 168.1 | 176.6 | -147.2 | -14.6 | 0 | 0 | 0 | 111.3 | R15 P62 E66 | R15-D64 IonicContact NH1-OD1 2.8Å; P62-D64 VanDerWaalsContact C-N 3.27Å; P62-D64 PolarHBondContact O-N 2.88Å; D64-E66 PolarHBondContact O-N 2.62Å |
| 65 | V | 81.1 | Confident | 81.2 | Confident | 30 Ų | 30 | 99.3 Ų | 99.3 | 18% | 0.182 | 53% | 0.527 | C | S | . | . | trans | -87.7 | 92.1 | 173.8 | -177.4 | 0 | 0 | 0 | 0 | 108.2 | R15 K18 T70 | R15-V65 HydrophobicContact CB-CG2 4.26Å; K18-V65 WeakPolarHBondContact CG-O 3.5Å; V65-T70 HydrophobicContact CG1-CG2 3.62Å; V65-T70 HydrophobicContact CG2-CG2 4.47Å | ||
| 66 | E | 72.1 | Confident | 80.8 | Confident | 143 Ų | 143 | 98.9 Ų | 98.9 | 67% | 0.668 | 53% | 0.526 | S | S | * | . | trans | -87.6 | -21.6 | -178.7 | -66 | -173.4 | -172.6 | 0 | 0 | 113.4 | K18 D64 | K18-E66 VanDerWaalsContact CE-C 3.46Å; K18-E66 WeakPolarHBondContact CE-O 3.28Å; K18-E66 PolarHBondContact NZ-O 3.49Å; D64-E66 PolarHBondContact O-N 2.62Å | ||
| 67 | D | 70.5 | Confident | 80.3 | Confident | 115 Ų | 115 | 101.9 Ų | 101.9 | 62% | 0.615 | 54% | 0.538 | S | S | * | . | S | Bend | trans | -87.3 | 148.5 | -179.1 | -66.7 | -43.2 | 0 | 0 | 0 | 111.8 | S69 | D67-S69 WeakPolarHBondContact CB-O 3.36Å; D67-S69 PolarHBondContact O-N 3.46Å |
| 68 | E | 67.9 | Low | 79.6 | Confident | 138 Ų | 138 | 102.5 Ų | 102.5 | 65% | 0.645 | 54% | 0.543 | S | S | * | . | S | Bend | trans | -66.1 | -18.1 | 173.6 | -60.6 | -58.5 | 122.1 | 0 | 0 | 112 | S17 K18 | S17-E68 WeakPolarHBondContact CB-O 3.17Å; K18-E68 IonicContact NZ-OE1 2.79Å; K18-E68 PolarHBondContact NZ-OE1 3.01Å |
| 69 | S | 68.6 | Low | 78.9 | Confident | 57 Ų | 57 | 102.1 Ų | 102.1 | 40% | 0.399 | 54% | 0.541 | S | S | . | . | trans | -146.7 | 131.8 | 174.8 | -174.4 | 0 | 0 | 0 | 0 | 110.6 | D67 G71 E73 | D67-S69 WeakPolarHBondContact CB-O 3.36Å; D67-S69 PolarHBondContact O-N 3.46Å; S69-G71 VanDerWaalsContact C-N 3.34Å; S69-G71 PolarHBondContact OG-N 2.96Å; S69-E73 WeakPolarHBondContact CA-OE1 3.34Å; S69-E73 PolarHBondContact OG-OE1 3.32Å; S69-E73 PolarHBondContact OG-OE2 2.82Å | ||
| 70 | T | 74.4 | Confident | 77.9 | Confident | 53 Ų | 53 | 104.3 Ų | 104.3 | 33% | 0.325 | 55% | 0.553 | S | S | . | * | trans | -89.1 | 0.6 | 175.1 | 58.2 | 0 | 0 | 0 | 0 | 113.2 | I16 V65 L72 | I16-T70 WeakPolarHBondContact O-CB 3.46Å; I16-T70 WeakPolarHBondContact O-CG2 3.32Å; I16-T70 PolarHBondContact O-N 3.03Å; I16-T70 PolarHBondContact O-OG1 3.34Å; V65-T70 HydrophobicContact CG1-CG2 3.62Å; V65-T70 HydrophobicContact CG2-CG2 4.47Å; T70-L72 PolarHBondContact O-N 3.25Å; T70-L72 VanDerWaalsContact O-N 3.11Å; T70-L72 WeakPolarHBondContact OG1-CB 3.45Å; T70-L72 PolarHBondContact OG1-N 2.94Å | ||
| 71 | G | 75.9 | Confident | 76.9 | Confident | 68 Ų | 68 | 106.3 Ų | 106.3 | 70% | 0.701 | 56% | 0.56 | S | S | * | * | S | Bend | trans | 68.1 | 0.8 | -170.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | S69 | S69-G71 VanDerWaalsContact C-N 3.34Å; S69-G71 PolarHBondContact OG-N 2.96Å |
| 72 | L | 77.8 | Confident | 75.7 | Confident | 105 Ų | 105 | 106.5 Ų | 106.5 | 55% | 0.55 | 56% | 0.561 | S | S | . | * | trans | -88.1 | 5.6 | 173 | -57.3 | 173.5 | 0 | 0 | 0 | 112.2 | F14 T70 K74 | F14-L72 HydrophobicContact CE1-CD1 3.74Å; F14-L72 HydrophobicContact CZ-CD1 3.97Å; T70-L72 PolarHBondContact O-N 3.25Å; T70-L72 VanDerWaalsContact O-N 3.11Å; T70-L72 WeakPolarHBondContact OG1-CB 3.45Å; T70-L72 PolarHBondContact OG1-N 2.94Å; L72-K74 VanDerWaalsContact C-N 3.34Å; L72-K74 PolarHBondContact O-N 3.37Å | ||
| 73 | E | 71.2 | Confident | 74.5 | Confident | 80 Ų | 80 | 109.3 Ų | 109.3 | 37% | 0.374 | 57% | 0.569 | S | S | . | * | trans | -78.3 | 83.9 | 178.6 | -49 | -170.9 | 164.1 | 0 | 0 | 108.2 | I16 S17 S69 | I16-E73 HydrophobicContact CD1-CG 4.44Å; S17-E73 WeakPolarHBondContact CB-OE1 3.48Å; S69-E73 WeakPolarHBondContact CA-OE1 3.34Å; S69-E73 PolarHBondContact OG-OE1 3.32Å; S69-E73 PolarHBondContact OG-OE2 2.82Å | ||
| 74 | K | 63 | Low | 73.3 | Confident | 256 Ų | 256 | 103.3 Ų | 103.3 | 100% | 1.113 | 55% | 0.551 | S | S | * | * | trans | -65.6 | 0 | 167 | -98.6 | -171.7 | 176.8 | -177.2 | 0 | 111.7 | L72 | L72-K74 VanDerWaalsContact C-N 3.34Å; L72-K74 PolarHBondContact O-N 3.37Å |
Retrieved 74 of 74 residues in 412.2 ms
(Link to these results)