| 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 | 81.3 | Confident | 93.8 | Very high | 167 Ų | 167 | 91.5 Ų | 91.5 | 82% | 0.823 | 44% | 0.442 | S | S | * | . | 0 | 132.9 | 0 | -168.8 | 138.7 | 76.8 | 0 | 0 | 109 | E92 | M1-E92 HydrophobicContact CG-CG 4.25Å; M1-E92 WeakPolarHBondContact CG-OE1 3.43Å | |||
| 2 | V | 93.1 | Very high | 94 | Very high | 58 Ų | 58 | 84 Ų | 84 | 35% | 0.352 | 41% | 0.407 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.7 | 117.8 | 175.7 | 179.2 | 0 | 0 | 0 | 0 | 108.5 | V4 C88 H90 F91 E92 | V2-V4 HydrophobicContact CG1-CG2 4.49Å; V2-C88 HydrophobicContact CB-CB 4.4Å; V2-C88 HydrophobicContact CG2-CB 3.65Å; V2-H90 PolarHBondContact N-O 2.88Å; V2-F91 HydrophobicContact CB-CD2 4.46Å; V2-F91 HydrophobicContact CG1-CD2 4.3Å; V2-F91 WeakPolarHBondContact O-CA 3.38Å; V2-E92 PolarHBondContact O-N 3.32Å |
| 3 | N | 93.5 | Very high | 94 | Very high | 57 Ų | 57 | 91.2 Ų | 91.2 | 31% | 0.305 | 44% | 0.435 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.5 | 131.1 | 178.3 | -173.5 | 5.3 | 0 | 0 | 0 | 110.2 | E92 G95 D96 | N3-E92 HydrophobicContact CB-CG 3.74Å; N3-E92 WeakPolarHBondContact CB-OE1 3.38Å; N3-G95 WeakPolarHBondContact ND2-CA 3.44Å; N3-G95 PolarHBondContact ND2-O 3.25Å; N3-G95 PolarHBondContact OD1-N 3.24Å; N3-D96 PolarHBondContact ND2-O 3.29Å |
| 4 | V | 93.9 | Very high | 94.1 | Very high | 21 Ų | 21 | 96.3 Ų | 96.3 | 13% | 0.127 | 45% | 0.454 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.7 | 134.8 | 175.3 | 173.1 | 0 | 0 | 0 | 0 | 109.5 | V2 V23 L68 F91 E92 L93 G94 | V2-V4 HydrophobicContact CG1-CG2 4.49Å; V4-V23 HydrophobicContact CG1-CG1 4.12Å; V4-L68 HydrophobicContact CG1-CD1 3.91Å; V4-F91 HydrophobicContact CB-CE2 4.03Å; V4-F91 HydrophobicContact CB-CZ 4.23Å; V4-F91 HydrophobicContact CG2-CE2 3.65Å; V4-F91 HydrophobicContact CG2-CZ 4.32Å; V4-E92 PolarHBondContact N-O 3.36Å; V4-E92 VanDerWaalsContact N-O 3.08Å; V4-L93 HydrophobicContact CB-CD1 4.01Å; V4-L93 HydrophobicContact CG1-CD1 3.93Å; V4-L93 CarbonylContact O-C 3.53Å; V4-L93 WeakPolarHBondContact O-CA 3.45Å; V4-L93 WeakPolarHBondContact O-CD1 3.45Å; V4-G94 PolarHBondContact O-N 2.95Å |
| 5 | P | 95.3 | Very high | 94.1 | Very high | 75 Ų | 75 | 92.3 Ų | 92.3 | 49% | 0.487 | 44% | 0.441 | S | S | . | . | trans | -66.7 | 148.7 | 178.9 | 28.9 | -36.6 | 0 | 0 | 0 | 111.9 | T7 V23 | P5-T7 WeakPolarHBondContact CB-O 3.49Å; P5-T7 WeakPolarHBondContact CG-O 3.47Å; P5-T7 PolarHBondContact O-N 3.1Å; P5-V23 WeakPolarHBondContact O-CB 3.41Å; P5-V23 WeakPolarHBondContact O-CG2 3.42Å | ||
| 6 | K | 95.7 | Very high | 94.1 | Very high | 127 Ų | 127 | 89.9 Ų | 89.9 | 55% | 0.552 | 45% | 0.447 | S | S | * | . | S | Bend | trans | -67.9 | -16.8 | 175.5 | -71.6 | 175.8 | -178.7 | 171.2 | 0 | 113 | V23 L93 | K6-V23 PolarHBondContact O-N 3.23Å; K6-L93 VanDerWaalsContact CE-O 3.23Å; K6-L93 WeakPolarHBondContact CE-O 3.32Å; K6-L93 HydrophobicContact CG-CD2 4.24Å; K6-L93 HydrophobicContact CG-CG 4.03Å |
| 7 | T | 94.9 | Very high | 94.2 | Very high | 99 Ų | 99 | 91.8 Ų | 91.8 | 61% | 0.607 | 45% | 0.452 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -126.7 | 141.3 | 175.9 | 56.4 | 0 | 0 | 0 | 0 | 110.3 | P5 H21 | P5-T7 WeakPolarHBondContact CB-O 3.49Å; P5-T7 WeakPolarHBondContact CG-O 3.47Å; P5-T7 PolarHBondContact O-N 3.1Å; T7-H21 WeakPolarHBondContact CA-O 3.33Å |
| 8 | R | 95.1 | Very high | 94.3 | Very high | 107 Ų | 107 | 93 Ų | 93 | 40% | 0.404 | 46% | 0.456 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -145.2 | 128.1 | 177.4 | -177.4 | 176 | 176.6 | 178.4 | 0 | 110.5 | H21 V23 | R8-H21 PolarHBondContact N-O 3.29Å; R8-H21 WeakPolarHBondContact O-CB 3.41Å; R8-H21 PolarHBondContact O-N 3.03Å; R8-V23 HydrophobicContact CB-CG2 3.78Å |
| 9 | R | 96.3 | Very high | 94.4 | Very high | 188 Ų | 188 | 89.4 Ų | 89.4 | 71% | 0.709 | 44% | 0.438 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -78 | 123.9 | 168.5 | -66.3 | -173.3 | 73 | 150.1 | 1.6 | 109.3 | Q19 | R9-Q19 WeakPolarHBondContact CA-O 3.35Å |
| 10 | T | 96.6 | Very high | 94.5 | Very high | 18 Ų | 18 | 87.5 Ų | 87.5 | 11% | 0.11 | 43% | 0.433 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -155.6 | 163.1 | 177.7 | -168.6 | 0 | 0 | 0 | 0 | 110 | C12 H18 Q19 H21 L70 R81 | T10-C12 PolarHBondContact O-N 2.83Å; T10-H18 VanDerWaalsContact C-CD2 3.45Å; T10-H18 WeakPolarHBondContact O-CA 3.38Å; T10-Q19 PolarHBondContact N-O 3.28Å; T10-Q19 PolarHBondContact O-N 3.07Å; T10-Q19 VanDerWaalsContact O-O 3.11Å; T10-H21 HydrophobicContact CG2-CB 4.46Å; T10-H21 WeakPolarHBondContact CG2-ND1 3.39Å; T10-H21 PolarHBondContact O-CE1 3.42Å; T10-L70 HydrophobicContact CG2-CD1 4.21Å; T10-R81 PolarHBondContact OG1-NH2 2.87Å |
| 11 | F | 96.5 | Very high | 94.6 | Very high | 89 Ų | 89 | 83.4 Ų | 83.4 | 39% | 0.39 | 41% | 0.413 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -61.4 | 127 | 178.8 | -174.5 | -104.3 | 0 | 0 | 0 | 111.6 | K13 G16 H18 | F11-K13 HydrophobicContact CD1-CG 4.27Å; F11-K13 HydrophobicContact CE1-CB 4.46Å; F11-K13 HydrophobicContact CE1-CG 4Å; F11-G16 VanDerWaalsContact CE2-C 3.45Å; F11-G16 WeakPolarHBondContact CE2-O 3.5Å; F11-H18 PolarHBondContact N-CD2 3.02Å |
| 12 | C | 96.3 | Very high | 95.4 | Very high | 2 Ų | 2 | 81.6 Ų | 81.6 | 1% | 0.014 | 40% | 0.4 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -101.9 | 117 | 170.5 | 176.6 | 0 | 0 | 0 | 0 | 109.3 | T10 K14 C15 G16 K17 Q19 C77 S79 | T10-C12 PolarHBondContact O-N 2.83Å; C12-K14 VanDerWaalsContact C-N 3.32Å; C12-K14 PolarHBondContact O-N 2.98Å; C12-C15 HydrophobicContact CB-CB 3.99Å; C12-C15 PolarHBondContact O-N 3.19Å; C12-G16 PolarHBondContact O-N 2.99Å; C12-K17 PolarHBondContact N-O 2.81Å; C12-Q19 HydrophobicContact CB-CB 4.39Å; C12-C77 PolarHBondContact SG-SG 2.81Å; C12-S79 PolarHBondContact SG-OG 3.29Å |
| 13 | K | 94.1 | Very high | 95.6 | Very high | 178 Ų | 178 | 79 Ų | 79 | 77% | 0.774 | 38% | 0.384 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.8 | -39.3 | -179.4 | -69.2 | -171.7 | 174.6 | -168 | 0 | 113.3 | F11 | F11-K13 HydrophobicContact CD1-CG 4.27Å; F11-K13 HydrophobicContact CE1-CB 4.46Å; F11-K13 HydrophobicContact CE1-CG 4Å |
| 14 | K | 94.6 | Very high | 95.7 | Very high | 162 Ų | 162 | 78.3 Ų | 78.3 | 70% | 0.704 | 38% | 0.382 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.6 | -31.5 | 179.7 | -70.8 | -158.3 | -174.8 | -176 | 0 | 113.1 | C12 C77 | C12-K14 VanDerWaalsContact C-N 3.32Å; C12-K14 PolarHBondContact O-N 2.98Å; K14-C77 VanDerWaalsContact CB-SG 3.53Å |
| 15 | C | 94.2 | Very high | 95.8 | Very high | 37 Ų | 37 | 81.8 Ų | 81.8 | 25% | 0.25 | 40% | 0.397 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -90 | -12.3 | -180 | -59.4 | 0 | 0 | 0 | 0 | 112.9 | C12 K17 Q19 C77 | C12-C15 HydrophobicContact CB-CB 3.99Å; C12-C15 PolarHBondContact O-N 3.19Å; C15-K17 HydrophobicContact CB-CG 4.12Å; C15-K17 PolarHBondContact O-N 2.92Å; C15-K17 VanDerWaalsContact O-N 3.1Å; C15-Q19 HydrophobicContact CB-CG 4.23Å; C15-C77 VanDerWaalsContact SG-CB 3.56Å |
| 16 | G | 94.8 | Very high | 95.9 | Very high | 53 Ų | 53 | 83.4 Ų | 83.4 | 55% | 0.546 | 39% | 0.394 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 66 | 7.8 | -175 | 0 | 0 | 0 | 0 | 0 | 114.8 | F11 C12 | F11-G16 VanDerWaalsContact CE2-C 3.45Å; F11-G16 WeakPolarHBondContact CE2-O 3.5Å; C12-G16 PolarHBondContact O-N 2.99Å |
| 17 | K | 95.6 | Very high | 95.8 | Very high | 122 Ų | 122 | 85.4 Ų | 85.4 | 53% | 0.53 | 40% | 0.403 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -143.7 | 168 | -175.6 | 64.6 | -176.7 | 170.2 | 174.7 | 0 | 113.1 | C12 C15 Q19 | C12-K17 PolarHBondContact N-O 2.81Å; C15-K17 HydrophobicContact CB-CG 4.12Å; C15-K17 PolarHBondContact O-N 2.92Å; C15-K17 VanDerWaalsContact O-N 3.1Å; K17-Q19 VanDerWaalsContact CE-NE2 3.29Å; K17-Q19 HydrophobicContact CG-CG 4.23Å; K17-Q19 PolarHBondContact O-N 3.08Å |
| 18 | H | 96.3 | Very high | 95.8 | Very high | 114 Ų | 114 | 87.5 Ų | 87.5 | 53% | 0.528 | 40% | 0.404 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -75.5 | 113.2 | 176 | -77.5 | 82.4 | 0 | 0 | 0 | 111 | T10 F11 | T10-H18 VanDerWaalsContact C-CD2 3.45Å; T10-H18 WeakPolarHBondContact O-CA 3.38Å; F11-H18 PolarHBondContact N-CD2 3.02Å |
| 19 | Q | 95.6 | Very high | 95.9 | Very high | 25 Ų | 25 | 84.9 Ų | 84.9 | 12% | 0.117 | 41% | 0.41 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.4 | 155.5 | 178.8 | -71 | -67 | 26.3 | 0 | 0 | 111.7 | R9 T10 C12 C15 K17 H21 E74 | R9-Q19 WeakPolarHBondContact CA-O 3.35Å; T10-Q19 PolarHBondContact N-O 3.28Å; T10-Q19 PolarHBondContact O-N 3.07Å; T10-Q19 VanDerWaalsContact O-O 3.11Å; C12-Q19 HydrophobicContact CB-CB 4.39Å; C15-Q19 HydrophobicContact CB-CG 4.23Å; K17-Q19 VanDerWaalsContact CE-NE2 3.29Å; K17-Q19 HydrophobicContact CG-CG 4.23Å; K17-Q19 PolarHBondContact O-N 3.08Å; Q19-H21 PolarHBondContact O-CE1 3.35Å; Q19-H21 PolarHBondContact O-ND1 2.81Å; Q19-E74 PolarHBondContact NE2-OE2 3.42Å |
| 20 | P | 96.6 | Very high | 95.9 | Very high | 50 Ų | 50 | 85.8 Ų | 85.8 | 33% | 0.325 | 42% | 0.419 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -64.9 | 134.5 | 167.1 | 27.9 | -31.3 | 0 | 0 | 0 | 109.8 | V73 | P20-V73 HydrophobicContact CB-CG2 4.39Å; P20-V73 HydrophobicContact CG-CB 4.27Å; P20-V73 HydrophobicContact CG-CG2 4.48Å; P20-V73 VanDerWaalsContact O-CG2 3.31Å; P20-V73 WeakPolarHBondContact O-CG2 3.35Å; P20-V73 PolarHBondContact O-N 2.97Å; P20-V73 VanDerWaalsContact O-N 3.12Å |
| 21 | H | 97.2 | Very high | 95.9 | Very high | 2 Ų | 2 | 90 Ų | 90 | 1% | 0.009 | 44% | 0.441 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.7 | 136.3 | 175.2 | -67.1 | 64.7 | 0 | 0 | 0 | 109.9 | T7 R8 T10 Q19 L70 E71 | T7-H21 WeakPolarHBondContact CA-O 3.33Å; R8-H21 PolarHBondContact N-O 3.29Å; R8-H21 WeakPolarHBondContact O-CB 3.41Å; R8-H21 PolarHBondContact O-N 3.03Å; T10-H21 HydrophobicContact CG2-CB 4.46Å; T10-H21 WeakPolarHBondContact CG2-ND1 3.39Å; T10-H21 PolarHBondContact O-CE1 3.42Å; Q19-H21 PolarHBondContact O-CE1 3.35Å; Q19-H21 PolarHBondContact O-ND1 2.81Å; H21-L70 HydrophobicContact CB-CB 4.13Å; H21-E71 CarbonylContact C-O 3.44Å; H21-E71 WeakPolarHBondContact CA-O 3.48Å |
| 22 | K | 96.8 | Very high | 95.9 | Very high | 129 Ų | 129 | 89.4 Ų | 89.4 | 56% | 0.561 | 45% | 0.448 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -74.1 | 122.4 | 166 | -173.4 | 175.7 | -178.3 | 176.2 | 0 | 108.4 | T24 E71 | K22-T24 HydrophobicContact CG-CG2 4.49Å; K22-E71 PolarHBondContact N-O 3.43Å; K22-E71 PolarHBondContact O-N 2.99Å |
| 23 | V | 97.3 | Very high | 95.9 | Very high | 3 Ų | 3 | 94.2 Ų | 94.2 | 2% | 0.018 | 47% | 0.473 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.1 | 130.7 | 179.6 | -170.4 | 0 | 0 | 0 | 0 | 108.1 | V4 P5 K6 R8 L68 L70 L93 | V4-V23 HydrophobicContact CG1-CG1 4.12Å; P5-V23 WeakPolarHBondContact O-CB 3.41Å; P5-V23 WeakPolarHBondContact O-CG2 3.42Å; K6-V23 PolarHBondContact O-N 3.23Å; R8-V23 HydrophobicContact CB-CG2 3.78Å; V23-L68 HydrophobicContact CG1-CB 4.1Å; V23-L68 HydrophobicContact CG1-CD1 4.14Å; V23-L68 HydrophobicContact CG1-CD2 4.09Å; V23-L68 HydrophobicContact CG1-CG 4.34Å; V23-L70 HydrophobicContact CB-CD2 4.18Å; V23-L70 HydrophobicContact CG1-CD2 3.96Å; V23-L70 HydrophobicContact CG2-CD2 3.64Å; V23-L93 HydrophobicContact CB-CD1 4.27Å; V23-L93 HydrophobicContact CG1-CD1 3.81Å; V23-L93 WeakPolarHBondContact O-CD2 3.49Å |
| 24 | T | 96.5 | Very high | 96 | Very high | 43 Ų | 43 | 94.9 Ų | 94.9 | 26% | 0.264 | 47% | 0.472 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -135.1 | 155.5 | 173.4 | 54.5 | 0 | 0 | 0 | 0 | 109.9 | K22 L68 R69 | K22-T24 HydrophobicContact CG-CG2 4.49Å; T24-L68 CarbonylContact O-C 3.56Å; T24-L68 WeakPolarHBondContact O-CA 3.02Å; T24-R69 PolarHBondContact N-O 3.31Å; T24-R69 PolarHBondContact O-N 2.9Å; T24-R69 WeakPolarHBondContact OG1-CB 2.99Å; T24-R69 PolarHBondContact OG1-O 3.05Å |
| 25 | Q | 96.4 | Very high | 96.1 | Very high | 95 Ų | 95 | 89.5 Ų | 89.5 | 44% | 0.444 | 46% | 0.458 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -77.3 | 130.7 | 171.7 | -168.2 | -179.8 | 40.5 | 0 | 0 | 109.5 | K27 I66 | Q25-K27 PolarHBondContact O-N 3.36Å; Q25-I66 HydrophobicContact CG-CG2 4.09Å |
| 26 | Y | 96.6 | Very high | 96.3 | Very high | 108 Ų | 108 | 93.8 Ų | 93.8 | 42% | 0.424 | 47% | 0.474 | S | S | . | . | trans | -65.5 | 134 | 171.5 | 172.6 | -101.4 | 0 | 0 | 0 | 110.4 | K28 V67 M82 | Y26-K28 HydrophobicContact CE1-CB 4.49Å; Y26-V67 VanDerWaalsContact CB-O 3.24Å; Y26-V67 WeakPolarHBondContact CB-O 3.33Å; Y26-V67 HydrophobicContact CD1-CB 4.43Å; Y26-V67 HydrophobicContact CG-CB 4.4Å; Y26-V67 PolarHBondContact N-O 2.97Å; Y26-M82 HydrophobicContact CD2-CE 3.66Å; Y26-M82 HydrophobicContact CD2-SD 4.15Å; Y26-M82 HydrophobicContact CE2-CE 4.09Å | ||
| 27 | K | 94.5 | Very high | 96.4 | Very high | 170 Ų | 170 | 93.4 Ų | 93.4 | 74% | 0.739 | 47% | 0.471 | S | S | * | . | trans | -114.5 | 136.4 | 169.1 | -64.3 | -172.5 | 177.3 | -177.2 | 0 | 108.9 | Q25 G29 | Q25-K27 PolarHBondContact O-N 3.36Å; K27-G29 PolarHBondContact O-N 2.84Å | ||
| 28 | K | 94.9 | Very high | 96.5 | Very high | 142 Ų | 142 | 91.4 Ų | 91.4 | 62% | 0.617 | 46% | 0.462 | S | S | * | . | P | Polyproline II helix | trans | -65.9 | 130.1 | 170.2 | -168.9 | -167 | 171.9 | -164.2 | 0 | 108 | Y26 D31 | Y26-K28 HydrophobicContact CE1-CB 4.49Å; K28-D31 WeakPolarHBondContact CE-OD1 3.4Å; K28-D31 IonicContact NZ-OD1 2.78Å; K28-D31 PolarHBondContact NZ-OD1 2.8Å; K28-D31 IonicContact NZ-OD2 2.76Å; K28-D31 PolarHBondContact NZ-OD2 2.64Å |
| 29 | G | 95.8 | Very high | 96.6 | Very high | 52 Ų | 52 | 93.3 Ų | 93.3 | 54% | 0.536 | 46% | 0.464 | S | S | . | . | P | Polyproline II helix | trans | -72.9 | 172.4 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | K27 | K27-G29 PolarHBondContact O-N 2.84Š|
| 30 | K | 96.9 | Very high | 96.7 | Very high | 207 Ų | 207 | 98.4 Ų | 98.4 | 90% | 0.9 | 48% | 0.482 | S | S | * | . | P | Polyproline II helix | trans | -62.5 | 135.9 | 170.3 | -176.5 | 177.4 | 178.2 | 179.8 | 0 | 109.6 | ||
| 31 | D | 95.9 | Very high | 96.8 | Very high | 107 Ų | 107 | 99.6 Ų | 99.6 | 57% | 0.572 | 48% | 0.481 | S | S | * | . | P | Polyproline II helix | trans | -69.4 | 132.6 | 176.6 | -67.4 | -35.3 | 0 | 0 | 0 | 109.9 | K28 | K28-D31 WeakPolarHBondContact CE-OD1 3.4Å; K28-D31 IonicContact NZ-OD1 2.78Å; K28-D31 PolarHBondContact NZ-OD1 2.8Å; K28-D31 IonicContact NZ-OD2 2.76Å; K28-D31 PolarHBondContact NZ-OD2 2.64Å |
| 32 | S | 96.9 | Very high | 96.8 | Very high | 76 Ų | 76 | 102.5 Ų | 102.5 | 53% | 0.531 | 50% | 0.497 | S | S | . | . | P | Polyproline II helix | trans | -77.2 | 135.7 | 179.3 | 178 | 0 | 0 | 0 | 0 | 111.5 | Y34 | S32-Y34 PolarHBondContact OG-N 3.48Š|
| 33 | L | 96.3 | Very high | 96.8 | Very high | 103 Ų | 103 | 105.6 Ų | 105.6 | 54% | 0.539 | 51% | 0.505 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75.6 | -27.6 | 178.5 | -62.6 | 178.6 | 0 | 0 | 0 | 113.1 | A35 K38 | L33-A35 VanDerWaalsContact C-N 3.28Å; L33-A35 PolarHBondContact O-N 2.8Å; L33-K38 HydrophobicContact CD2-CG 4.27Å; L33-K38 WeakPolarHBondContact O-CG 3.36Å |
| 34 | Y | 96.1 | Very high | 96.8 | Very high | 192 Ų | 192 | 110.6 Ų | 110.6 | 75% | 0.753 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.8 | -6.7 | -174.9 | -57.4 | -76.6 | 0 | 0 | 0 | 113.5 | S32 Q36 R39 | S32-Y34 PolarHBondContact OG-N 3.48Å; Y34-Q36 PolarHBondContact O-N 2.8Å; Y34-R39 PolarHBondContact O-NE 2.92Å |
| 35 | A | 97.5 | Very high | 96.8 | Very high | 50 Ų | 50 | 111.4 Ų | 111.4 | 41% | 0.413 | 53% | 0.527 | S | S | . | . | S | Bend | trans | -56.8 | 135.9 | 174.2 | 0 | 0 | 0 | 0 | 0 | 110.4 | L33 G37 K38 R39 | L33-A35 VanDerWaalsContact C-N 3.28Å; L33-A35 PolarHBondContact O-N 2.8Å; A35-G37 PolarHBondContact O-N 3.12Å; A35-G37 VanDerWaalsContact O-N 3.12Å; A35-K38 PolarHBondContact O-N 3.42Å; A35-R39 PolarHBondContact O-N 3.21Å |
| 36 | Q | 98 | Very high | 96.8 | Very high | 126 Ų | 126 | 110.8 Ų | 110.8 | 59% | 0.589 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -53.2 | -39.4 | -175.3 | -168.8 | -166 | 30.1 | 0 | 0 | 112.6 | Y34 R40 | Y34-Q36 PolarHBondContact O-N 2.8Å; Q36-R40 WeakPolarHBondContact O-CB 3.41Å; Q36-R40 PolarHBondContact O-N 2.94Å |
| 37 | G | 97.3 | Very high | 96.8 | Very high | 46 Ų | 46 | 108.9 Ų | 108.9 | 47% | 0.474 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -63.5 | -39.7 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | A35 Y41 | A35-G37 PolarHBondContact O-N 3.12Å; A35-G37 VanDerWaalsContact O-N 3.12Å; G37-Y41 WeakPolarHBondContact O-CB 3.23Å; G37-Y41 PolarHBondContact O-N 2.91Å |
| 38 | K | 97.9 | Very high | 96.8 | Very high | 80 Ų | 80 | 112.4 Ų | 112.4 | 35% | 0.348 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -70.7 | -46.9 | 178 | -179.3 | 51.1 | 173.9 | 160.4 | 0 | 111 | L33 A35 R40 Y41 D42 | L33-K38 HydrophobicContact CD2-CG 4.27Å; L33-K38 WeakPolarHBondContact O-CG 3.36Å; A35-K38 PolarHBondContact O-N 3.42Å; K38-R40 VanDerWaalsContact C-N 3.31Å; K38-R40 PolarHBondContact O-N 3.48Å; K38-Y41 WeakPolarHBondContact O-CB 3.48Å; K38-Y41 PolarHBondContact O-N 2.79Å; K38-Y41 VanDerWaalsContact O-N 3.11Å; K38-D42 VanDerWaalsContact CD-OD2 3.27Å; K38-D42 WeakPolarHBondContact CD-OD2 3.15Å; K38-D42 WeakPolarHBondContact CE-OD1 3.31Å; K38-D42 WeakPolarHBondContact CE-OD2 3.44Å; K38-D42 VanDerWaalsContact NZ-CG 3.3Å; K38-D42 IonicContact NZ-OD1 2.64Å; K38-D42 PolarHBondContact NZ-OD1 2.82Å; K38-D42 IonicContact NZ-OD2 3.16Å; K38-D42 PolarHBondContact NZ-OD2 2.87Å; K38-D42 VanDerWaalsContact NZ-OD2 3.16Å; K38-D42 VanDerWaalsContact O-CG 3.32Å; K38-D42 PolarHBondContact O-N 2.82Å |
| 39 | R | 97.9 | Very high | 96.8 | Very high | 153 Ų | 153 | 109.4 Ų | 109.4 | 58% | 0.577 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -54.5 | -45 | 173.6 | -68.6 | -169 | -75 | 140.5 | -4.9 | 112.7 | Y34 A35 R43 | Y34-R39 PolarHBondContact O-NE 2.92Å; A35-R39 PolarHBondContact O-N 3.21Å; R39-R43 WeakPolarHBondContact O-CB 3.29Å; R39-R43 PolarHBondContact O-N 2.97Å; R39-R43 VanDerWaalsContact O-N 3.11Å |
| 40 | R | 98.1 | Very high | 96.9 | Very high | 132 Ų | 132 | 109.4 Ų | 109.4 | 50% | 0.498 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -65.9 | -42.2 | 177.3 | -173.5 | -172.8 | -63.3 | 130.5 | -0.5 | 112.1 | Q36 K38 K44 | Q36-R40 WeakPolarHBondContact O-CB 3.41Å; Q36-R40 PolarHBondContact O-N 2.94Å; K38-R40 VanDerWaalsContact C-N 3.31Å; K38-R40 PolarHBondContact O-N 3.48Å; R40-K44 WeakPolarHBondContact O-CB 3.42Å; R40-K44 PolarHBondContact O-N 3.19Å |
| 41 | Y | 97.5 | Very high | 96.9 | Very high | 76 Ų | 76 | 103.8 Ų | 103.8 | 30% | 0.298 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -61.8 | -47.4 | 177.9 | -177.9 | -81.1 | 0 | 0 | 0 | 111 | G37 K38 R43 K44 Q45 Q51 K53 | G37-Y41 WeakPolarHBondContact O-CB 3.23Å; G37-Y41 PolarHBondContact O-N 2.91Å; K38-Y41 WeakPolarHBondContact O-CB 3.48Å; K38-Y41 PolarHBondContact O-N 2.79Å; K38-Y41 VanDerWaalsContact O-N 3.11Å; Y41-R43 PolarHBondContact O-N 3.15Å; Y41-K44 WeakPolarHBondContact O-CB 3.32Å; Y41-K44 PolarHBondContact O-N 3.44Å; Y41-K44 VanDerWaalsContact O-N 3.09Å; Y41-Q45 HydrophobicContact CD1-CB 4.44Å; Y41-Q45 HydrophobicContact CE1-CB 4.23Å; Y41-Q45 HydrophobicContact CE1-CG 4.32Å; Y41-Q45 WeakPolarHBondContact O-CB 3.38Å; Y41-Q45 PolarHBondContact O-N 2.86Å; Y41-Q51 PolarHBondContact OH-NE2 3.03Å; Y41-Q51 PolarHBondContact OH-OE1 3.45Å; Y41-K53 HydrophobicContact CD2-CB 4.28Å; Y41-K53 HydrophobicContact CD2-CG 3.81Å; Y41-K53 HydrophobicContact CE2-CB 3.64Å; Y41-K53 HydrophobicContact CE2-CG 3.68Å |
| 42 | D | 97.1 | Very high | 96.9 | Very high | 63 Ų | 63 | 100.4 Ų | 100.4 | 34% | 0.337 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -65.2 | -42.1 | -177.5 | -66.6 | -20 | 0 | 0 | 0 | 111.7 | K38 K44 Q45 S46 | K38-D42 VanDerWaalsContact CD-OD2 3.27Å; K38-D42 WeakPolarHBondContact CD-OD2 3.15Å; K38-D42 WeakPolarHBondContact CE-OD1 3.31Å; K38-D42 WeakPolarHBondContact CE-OD2 3.44Å; K38-D42 VanDerWaalsContact NZ-CG 3.3Å; K38-D42 IonicContact NZ-OD1 2.64Å; K38-D42 PolarHBondContact NZ-OD1 2.82Å; K38-D42 IonicContact NZ-OD2 3.16Å; K38-D42 PolarHBondContact NZ-OD2 2.87Å; K38-D42 VanDerWaalsContact NZ-OD2 3.16Å; K38-D42 VanDerWaalsContact O-CG 3.32Å; K38-D42 PolarHBondContact O-N 2.82Å; D42-K44 VanDerWaalsContact C-N 3.29Å; D42-K44 PolarHBondContact O-N 2.79Å; D42-Q45 PolarHBondContact O-N 3.17Å; D42-S46 PolarHBondContact O-N 2.91Å |
| 43 | R | 96.9 | Very high | 96.9 | Very high | 194 Ų | 194 | 101.7 Ų | 101.7 | 73% | 0.732 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63.6 | -32.7 | 172.1 | -172.3 | 177.8 | 68.8 | -170.9 | 5.5 | 113.1 | R39 Y41 S46 | R39-R43 WeakPolarHBondContact O-CB 3.29Å; R39-R43 PolarHBondContact O-N 2.97Å; R39-R43 VanDerWaalsContact O-N 3.11Å; Y41-R43 PolarHBondContact O-N 3.15Å; R43-S46 PolarHBondContact O-OG 3.46Å |
| 44 | K | 97.1 | Very high | 96.9 | Very high | 108 Ų | 108 | 103 Ų | 103 | 47% | 0.47 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -73 | -36 | 175.7 | -165.9 | -173.8 | -179.1 | -160 | 0 | 111 | R40 Y41 D42 T52 | R40-K44 WeakPolarHBondContact O-CB 3.42Å; R40-K44 PolarHBondContact O-N 3.19Å; Y41-K44 WeakPolarHBondContact O-CB 3.32Å; Y41-K44 PolarHBondContact O-N 3.44Å; Y41-K44 VanDerWaalsContact O-N 3.09Å; D42-K44 VanDerWaalsContact C-N 3.29Å; D42-K44 PolarHBondContact O-N 2.79Å; K44-T52 HydrophobicContact CG-CG2 4.31Å; K44-T52 PolarHBondContact NZ-O 3.31Å; K44-T52 WeakPolarHBondContact O-CG2 3.44Å |
| 45 | Q | 97.3 | Very high | 97 | Very high | 60 Ų | 60 | 99.3 Ų | 99.3 | 28% | 0.28 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -78.7 | -19.8 | -175.4 | -168.8 | 71.2 | 6.7 | 0 | 0 | 113.2 | Y41 D42 G50 T52 | Y41-Q45 HydrophobicContact CD1-CB 4.44Å; Y41-Q45 HydrophobicContact CE1-CB 4.23Å; Y41-Q45 HydrophobicContact CE1-CG 4.32Å; Y41-Q45 WeakPolarHBondContact O-CB 3.38Å; Y41-Q45 PolarHBondContact O-N 2.86Å; D42-Q45 PolarHBondContact O-N 3.17Å; Q45-G50 PolarHBondContact NE2-O 2.9Å; Q45-T52 PolarHBondContact OE1-OG1 3.23Å |
| 46 | S | 96.1 | Very high | 97 | Very high | 82 Ų | 82 | 103.6 Ų | 103.6 | 57% | 0.573 | 54% | 0.538 | S | S | * | . | S | Bend | trans | -67.4 | 144.1 | 178.3 | 57.1 | 0 | 0 | 0 | 0 | 112.4 | D42 R43 | D42-S46 PolarHBondContact O-N 2.91Å; R43-S46 PolarHBondContact O-OG 3.46Å |
| 47 | G | 96.8 | Very high | 96.9 | Very high | 67 Ų | 67 | 108.1 Ų | 108.1 | 69% | 0.691 | 55% | 0.55 | S | S | * | * | S | Bend | trans | 95.6 | -158.7 | -178.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | ||
| 48 | Y | 95.1 | Very high | 96.9 | Very high | 245 Ų | 245 | 114.8 Ų | 114.8 | 96% | 0.961 | 57% | 0.566 | S | S | * | * | S | Bend | trans | -92.9 | 166.4 | 180 | -56.2 | -80.7 | 0 | 0 | 0 | 111.6 | ||
| 49 | G | 95.1 | Very high | 96.8 | Very high | 79 Ų | 79 | 119.1 Ų | 119.1 | 81% | 0.814 | 59% | 0.585 | S | S | * | * | S | Bend | trans | 107.3 | 2.5 | 178 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||
| 50 | G | 96 | Very high | 96.8 | Very high | 51 Ų | 51 | 116.1 Ų | 116.1 | 53% | 0.526 | 59% | 0.593 | S | S | . | * | S | Bend | trans | 72.2 | -143 | 169 | 0 | 0 | 0 | 0 | 0 | 114.4 | Q45 T52 | Q45-G50 PolarHBondContact NE2-O 2.9Å; G50-T52 PolarHBondContact O-N 3.5Å |
| 51 | Q | 97 | Very high | 96.8 | Very high | 90 Ų | 90 | 117.5 Ų | 117.5 | 42% | 0.421 | 60% | 0.602 | S | S | . | * | trans | -77.5 | 113.9 | -171.8 | 175.8 | 60.9 | 1.7 | 0 | 0 | 112.7 | Y41 K53 I55 | Y41-Q51 PolarHBondContact OH-NE2 3.03Å; Y41-Q51 PolarHBondContact OH-OE1 3.45Å; Q51-K53 WeakPolarHBondContact CG-O 3.24Å; Q51-K53 PolarHBondContact NE2-O 2.76Å; Q51-I55 HydrophobicContact CG-CD1 4.21Å; Q51-I55 HydrophobicContact CG-CG1 4.41Å | ||
| 52 | T | 96.7 | Very high | 96.7 | Very high | 36 Ų | 36 | 120.1 Ų | 120.1 | 22% | 0.221 | 63% | 0.626 | C | S | . | * | trans | -90.2 | -6.3 | -169 | 65.2 | 0 | 0 | 0 | 0 | 116.4 | K44 Q45 G50 | K44-T52 HydrophobicContact CG-CG2 4.31Å; K44-T52 PolarHBondContact NZ-O 3.31Å; K44-T52 WeakPolarHBondContact O-CG2 3.44Å; Q45-T52 PolarHBondContact OE1-OG1 3.23Å; G50-T52 PolarHBondContact O-N 3.5Å | ||
| 53 | K | 96.8 | Very high | 96.7 | Very high | 103 Ų | 103 | 118.6 Ų | 118.6 | 45% | 0.448 | 62% | 0.62 | S | S | . | * | S | Bend | trans | -137.8 | 143.1 | 179.4 | -69.6 | -67 | -175.9 | 177.2 | 0 | 110.7 | Y41 Q51 | Y41-K53 HydrophobicContact CD2-CB 4.28Å; Y41-K53 HydrophobicContact CD2-CG 3.81Å; Y41-K53 HydrophobicContact CE2-CB 3.64Å; Y41-K53 HydrophobicContact CE2-CG 3.68Å; Q51-K53 WeakPolarHBondContact CG-O 3.24Å; Q51-K53 PolarHBondContact NE2-O 2.76Å |
| 54 | P | 96.9 | Very high | 96.6 | Very high | 130 Ų | 130 | 117.8 Ų | 117.8 | 84% | 0.844 | 62% | 0.621 | S | S | * | * | trans | -66.3 | 137.6 | -174.4 | 26.3 | -34.4 | 0 | 0 | 0 | 112.2 | ||||
| 55 | I | 97.1 | Very high | 96.6 | Very high | 115 Ų | 115 | 119 Ų | 119 | 59% | 0.59 | 63% | 0.627 | S | S | * | * | trans | -98.4 | 123.6 | 171.9 | -59.3 | 172.8 | 0 | 0 | 0 | 108.1 | Q51 R57 | Q51-I55 HydrophobicContact CG-CD1 4.21Å; Q51-I55 HydrophobicContact CG-CG1 4.41Å; I55-R57 PolarHBondContact O-N 2.78Å | ||
| 56 | F | 97.4 | Very high | 96.5 | Very high | 140 Ų | 140 | 117.3 Ų | 117.3 | 61% | 0.614 | 62% | 0.619 | S | S | * | * | trans | -73.4 | 112.5 | 178.7 | -174.7 | -104 | 0 | 0 | 0 | 111.8 | K58 K59 | F56-K58 VanDerWaalsContact CE1-O 3.32Å; F56-K58 WeakPolarHBondContact CE1-O 3.11Å; F56-K58 HydrophobicContact CZ-CB 4.32Å; F56-K58 WeakPolarHBondContact CZ-O 3.47Å; F56-K59 HydrophobicContact CD1-CG 3.8Å; F56-K59 HydrophobicContact CE1-CB 4.42Å; F56-K59 HydrophobicContact CE1-CG 3.79Å | ||
| 57 | R | 97 | Very high | 96.6 | Very high | 221 Ų | 221 | 115.4 Ų | 115.4 | 83% | 0.834 | 60% | 0.604 | S | S | * | * | trans | -97 | -30.4 | -178.2 | -64.5 | -175 | 177 | -168.4 | -1 | 114.5 | I55 K59 | I55-R57 PolarHBondContact O-N 2.78Å; R57-K59 PolarHBondContact O-N 2.81Å | ||
| 58 | K | 96.8 | Very high | 96.6 | Very high | 185 Ų | 185 | 112.3 Ų | 112.3 | 80% | 0.804 | 57% | 0.572 | S | S | * | * | trans | -86.5 | 60.2 | -170.7 | -62.9 | -176.9 | 178.2 | -178 | 0 | 113.5 | F56 A60 | F56-K58 VanDerWaalsContact CE1-O 3.32Å; F56-K58 WeakPolarHBondContact CE1-O 3.11Å; F56-K58 HydrophobicContact CZ-CB 4.32Å; F56-K58 WeakPolarHBondContact CZ-O 3.47Å; K58-A60 PolarHBondContact O-N 2.82Å | ||
| 59 | K | 97 | Very high | 96.7 | Very high | 171 Ų | 171 | 104.6 Ų | 104.6 | 74% | 0.743 | 54% | 0.541 | S | S | * | . | trans | -78.2 | 116.5 | -179.4 | -65.4 | 175.3 | -173.5 | 168 | 0 | 111.6 | F56 R57 | F56-K59 HydrophobicContact CD1-CG 3.8Å; F56-K59 HydrophobicContact CE1-CB 4.42Å; F56-K59 HydrophobicContact CE1-CG 3.79Å; R57-K59 PolarHBondContact O-N 2.81Å | ||
| 60 | A | 97.5 | Very high | 96.8 | Very high | 90 Ų | 90 | 100.9 Ų | 100.9 | 74% | 0.744 | 50% | 0.502 | S | S | * | . | trans | -98.1 | -25.1 | 178 | 0 | 0 | 0 | 0 | 0 | 114.7 | K58 T62 | K58-A60 PolarHBondContact O-N 2.82Å; A60-T62 PolarHBondContact O-N 2.93Å | ||
| 61 | K | 96.8 | Very high | 96.8 | Very high | 161 Ų | 161 | 100.9 Ų | 100.9 | 70% | 0.7 | 49% | 0.488 | S | S | * | . | trans | -81.3 | 123.1 | -174.3 | -60.4 | -59.4 | -177.3 | -168.9 | 0 | 110.8 | ||||
| 62 | T | 96.6 | Very high | 96.9 | Very high | 131 Ų | 131 | 96.6 Ų | 96.6 | 80% | 0.804 | 47% | 0.469 | S | S | * | . | trans | -87.6 | -13.2 | 177.9 | 54.9 | 0 | 0 | 0 | 0 | 114 | A60 | A60-T62 PolarHBondContact O-N 2.93Š| ||
| 63 | T | 96.8 | Very high | 96.8 | Very high | 32 Ų | 32 | 99 Ų | 99 | 20% | 0.196 | 48% | 0.483 | C | S | . | . | trans | -124.6 | 174.1 | -178.9 | 58.1 | 0 | 0 | 0 | 0 | 111.2 | R87 K89 | T63-R87 VanDerWaalsContact C-NH1 3.26Å; T63-R87 PolarHBondContact O-NH1 3.01Å; T63-K89 HydrophobicContact CG2-CG 3.87Å | ||
| 64 | K | 94.7 | Very high | 96.6 | Very high | 177 Ų | 177 | 97.5 Ų | 97.5 | 77% | 0.77 | 48% | 0.477 | S | S | * | . | trans | -124.6 | 157.4 | 171.2 | -66.3 | 173.8 | -175.6 | 163.8 | 0 | 109.3 | I66 | K64-I66 PolarHBondContact O-N 3.11Š| ||
| 65 | K | 96.4 | Very high | 96.2 | Very high | 134 Ų | 134 | 95.3 Ų | 95.3 | 58% | 0.583 | 46% | 0.463 | S | S | * | . | trans | -75.1 | 122.4 | 166.3 | -73.6 | -175.4 | 178.1 | -178.7 | 0 | 107.2 | R87 | K65-R87 HydrophobicContact CG-CG 3.74Š| ||
| 66 | I | 96.4 | Very high | 95.9 | Very high | 23 Ų | 23 | 97.5 Ų | 97.5 | 12% | 0.118 | 48% | 0.476 | C | S | . | . | trans | -80.2 | 137.2 | 176.7 | -59.9 | 175.9 | 0 | 0 | 0 | 107.8 | Q25 K64 L68 I85 F91 | Q25-I66 HydrophobicContact CG-CG2 4.09Å; K64-I66 PolarHBondContact O-N 3.11Å; I66-L68 HydrophobicContact CG2-CD2 4.47Å; I66-I85 HydrophobicContact CB-CD1 3.95Å; I66-I85 HydrophobicContact CB-CG1 3.79Å; I66-I85 HydrophobicContact CG2-CD1 4.42Å; I66-I85 HydrophobicContact CG2-CG1 4.45Å; I66-I85 WeakPolarHBondContact O-CG1 3.49Å; I66-I85 PolarHBondContact O-N 3.41Å; I66-F91 HydrophobicContact CD1-CB 3.2Å; I66-F91 HydrophobicContact CD1-CD1 3.82Å; I66-F91 HydrophobicContact CD1-CD2 3.85Å; I66-F91 HydrophobicContact CD1-CG 3.33Å; I66-F91 HydrophobicContact CG2-CD1 4.32Å; I66-F91 HydrophobicContact CG2-CE1 4.23Å; I66-F91 HydrophobicContact CG2-CE2 4.48Å; I66-F91 HydrophobicContact CG2-CZ 4.33Å | ||
| 67 | V | 97.3 | Very high | 95.7 | Very high | 42 Ų | 42 | 91.7 Ų | 91.7 | 26% | 0.255 | 45% | 0.453 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.5 | 128.9 | 175.7 | -178.5 | 0 | 0 | 0 | 0 | 107.9 | Y26 M82 L83 A84 | Y26-V67 VanDerWaalsContact CB-O 3.24Å; Y26-V67 WeakPolarHBondContact CB-O 3.33Å; Y26-V67 HydrophobicContact CD1-CB 4.43Å; Y26-V67 HydrophobicContact CG-CB 4.4Å; Y26-V67 PolarHBondContact N-O 2.97Å; V67-M82 HydrophobicContact CG1-CB 3.84Å; V67-M82 HydrophobicContact CG1-CG 4.34Å; V67-M82 HydrophobicContact CG1-SD 4.08Å; V67-L83 WeakPolarHBondContact CA-O 3.38Å; V67-A84 HydrophobicContact CG2-CB 4.2Å |
| 68 | L | 97.2 | Very high | 95.6 | Very high | 3 Ų | 3 | 89 Ų | 89 | 2% | 0.016 | 44% | 0.443 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.9 | 133.1 | 174.2 | -56.1 | 176.1 | 0 | 0 | 0 | 108.7 | V4 V23 T24 I66 M82 L83 I85 F91 | V4-L68 HydrophobicContact CG1-CD1 3.91Å; V23-L68 HydrophobicContact CG1-CB 4.1Å; V23-L68 HydrophobicContact CG1-CD1 4.14Å; V23-L68 HydrophobicContact CG1-CD2 4.09Å; V23-L68 HydrophobicContact CG1-CG 4.34Å; T24-L68 CarbonylContact O-C 3.56Å; T24-L68 WeakPolarHBondContact O-CA 3.02Å; I66-L68 HydrophobicContact CG2-CD2 4.47Å; L68-M82 CarbonylContact O-C 3.56Å; L68-M82 WeakPolarHBondContact O-CA 3.5Å; L68-L83 PolarHBondContact N-O 3.09Å; L68-L83 PolarHBondContact O-N 3.21Å; L68-I85 HydrophobicContact CD1-CG2 3.96Å; L68-I85 HydrophobicContact CG-CG2 4.33Å; L68-F91 HydrophobicContact CD2-CE2 4.19Å; L68-F91 HydrophobicContact CD2-CZ 3.62Å |
| 69 | R | 97.1 | Very high | 95.5 | Very high | 83 Ų | 83 | 81.1 Ų | 81.1 | 31% | 0.313 | 41% | 0.411 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -97.3 | 114.9 | 168.8 | 175.7 | -178.9 | 174.3 | 127.9 | -22.2 | 108 | T24 K80 M82 | T24-R69 PolarHBondContact N-O 3.31Å; T24-R69 PolarHBondContact O-N 2.9Å; T24-R69 WeakPolarHBondContact OG1-CB 2.99Å; T24-R69 PolarHBondContact OG1-O 3.05Å; R69-K80 VanDerWaalsContact NH2-CD 3.25Å; R69-M82 HydrophobicContact CB-CE 4.28Å; R69-M82 HydrophobicContact CB-SD 3.79Å; R69-M82 HydrophobicContact CG-CE 4.17Å; R69-M82 HydrophobicContact CG-SD 4.16Å |
| 70 | L | 97.1 | Very high | 95.4 | Very high | 0 Ų | 0 | 78 Ų | 78 | 0% | 0 | 40% | 0.397 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -99.3 | 114.1 | 179 | -56.6 | 175.4 | 0 | 0 | 0 | 108.2 | T10 H21 V23 K80 R81 L83 | T10-L70 HydrophobicContact CG2-CD1 4.21Å; H21-L70 HydrophobicContact CB-CB 4.13Å; V23-L70 HydrophobicContact CB-CD2 4.18Å; V23-L70 HydrophobicContact CG1-CD2 3.96Å; V23-L70 HydrophobicContact CG2-CD2 3.64Å; L70-K80 CarbonylContact O-C 3.56Å; L70-K80 VanDerWaalsContact O-CA 3.29Å; L70-K80 WeakPolarHBondContact O-CA 2.98Å; L70-R81 PolarHBondContact N-O 3.46Å; L70-R81 PolarHBondContact O-N 2.64Å; L70-L83 HydrophobicContact CD1-CB 4.17Å; L70-L83 HydrophobicContact CD1-CD2 4.43Å |
| 71 | E | 97.3 | Very high | 95.3 | Very high | 51 Ų | 51 | 77.9 Ų | 77.9 | 24% | 0.238 | 38% | 0.377 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.2 | 120.9 | 178.1 | 179.8 | 160.9 | -163.1 | 0 | 0 | 109.8 | H21 K22 V73 S79 K80 | H21-E71 CarbonylContact C-O 3.44Å; H21-E71 WeakPolarHBondContact CA-O 3.48Å; K22-E71 PolarHBondContact N-O 3.43Å; K22-E71 PolarHBondContact O-N 2.99Å; E71-V73 PolarHBondContact O-N 3.12Å; E71-S79 WeakPolarHBondContact CA-O 3.34Å; E71-K80 HydrophobicContact CB-CG 4.15Å; E71-K80 HydrophobicContact CG-CG 4.2Å; E71-K80 WeakPolarHBondContact OE1-CE 3.39Å; E71-K80 IonicContact OE1-NZ 3.31Å; E71-K80 PolarHBondContact OE1-NZ 3.16Å; E71-K80 WeakPolarHBondContact OE2-CE 3.27Å |
| 72 | C | 97.2 | Very high | 95.3 | Very high | 1 Ų | 1 | 74.3 Ų | 74.3 | 1% | 0.007 | 37% | 0.365 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -62.1 | 130.3 | 176.9 | -171.4 | 0 | 0 | 0 | 0 | 109.8 | E74 C77 S79 | C72-E74 VanDerWaalsContact C-N 3.28Å; C72-C77 HydrophobicContact CB-CB 4.38Å; C72-S79 PolarHBondContact N-O 2.88Å |
| 73 | V | 95.6 | Very high | 95.3 | Very high | 86 Ų | 86 | 70.3 Ų | 70.3 | 52% | 0.521 | 34% | 0.338 | S | S | . | . | trans | -74.2 | -22.9 | -178.7 | 177.1 | 0 | 0 | 0 | 0 | 111.9 | P20 E71 P75 | P20-V73 HydrophobicContact CB-CG2 4.39Å; P20-V73 HydrophobicContact CG-CB 4.27Å; P20-V73 HydrophobicContact CG-CG2 4.48Å; P20-V73 VanDerWaalsContact O-CG2 3.31Å; P20-V73 WeakPolarHBondContact O-CG2 3.35Å; P20-V73 PolarHBondContact O-N 2.97Å; P20-V73 VanDerWaalsContact O-N 3.12Å; E71-V73 PolarHBondContact O-N 3.12Å; V73-P75 WeakPolarHBondContact O-CD 3.37Å | ||
| 74 | E | 93 | Very high | 95.3 | Very high | 71 Ų | 71 | 71.8 Ų | 71.8 | 33% | 0.332 | 35% | 0.354 | S | S | . | . | trans | -54.4 | 119.5 | 179.6 | -169.6 | 67.6 | -129.6 | 0 | 0 | 111 | Q19 C72 N76 C77 R78 | Q19-E74 PolarHBondContact NE2-OE2 3.42Å; C72-E74 VanDerWaalsContact C-N 3.28Å; E74-N76 VanDerWaalsContact C-N 3.26Å; E74-N76 PolarHBondContact O-N 2.98Å; E74-C77 HydrophobicContact CB-CB 3.9Å; E74-C77 HydrophobicContact CG-CB 4.24Å; E74-C77 PolarHBondContact O-N 3.41Å; E74-R78 PolarHBondContact O-N 3.36Å; E74-R78 VanDerWaalsContact O-N 3.15Å | ||
| 75 | P | 88.3 | Confident | 95.3 | Very high | 85 Ų | 85 | 65.2 Ų | 65.2 | 55% | 0.552 | 33% | 0.326 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.6 | -39 | -171.5 | -28.3 | 34.8 | 0 | 0 | 0 | 113.8 | V73 C77 | V73-P75 WeakPolarHBondContact O-CD 3.37Å; P75-C77 VanDerWaalsContact C-N 3.3Å; P75-C77 PolarHBondContact O-N 2.98Å |
| 76 | N | 91.4 | Very high | 95.3 | Very high | 161 Ų | 161 | 67.9 Ų | 67.9 | 86% | 0.861 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.2 | -12.9 | -177.6 | -63.1 | -13.5 | 0 | 0 | 0 | 113.1 | E74 | E74-N76 VanDerWaalsContact C-N 3.26Å; E74-N76 PolarHBondContact O-N 2.98Å |
| 77 | C | 93.4 | Very high | 95.3 | Very high | 17 Ų | 17 | 72.2 Ų | 72.2 | 12% | 0.115 | 35% | 0.353 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -101.8 | -57.8 | -174.6 | -178.8 | 0 | 0 | 0 | 0 | 112.6 | C12 K14 C15 C72 E74 P75 S79 | C12-C77 PolarHBondContact SG-SG 2.81Å; K14-C77 VanDerWaalsContact CB-SG 3.53Å; C15-C77 VanDerWaalsContact SG-CB 3.56Å; C72-C77 HydrophobicContact CB-CB 4.38Å; E74-C77 HydrophobicContact CB-CB 3.9Å; E74-C77 HydrophobicContact CG-CB 4.24Å; E74-C77 PolarHBondContact O-N 3.41Å; P75-C77 VanDerWaalsContact C-N 3.3Å; P75-C77 PolarHBondContact O-N 2.98Å; C77-S79 PolarHBondContact O-N 3.19Å; C77-S79 WeakPolarHBondContact SG-CB 3.48Å; C77-S79 PolarHBondContact SG-OG 3.48Å |
| 78 | R | 92.9 | Very high | 95.2 | Very high | 165 Ų | 165 | 71.3 Ų | 71.3 | 62% | 0.623 | 35% | 0.348 | S | S | * | . | trans | 39.5 | 28.3 | -173.4 | -63.6 | -177.8 | -179 | -166.7 | -1.5 | 114.7 | E74 | E74-R78 PolarHBondContact O-N 3.36Å; E74-R78 VanDerWaalsContact O-N 3.15Å | ||
| 79 | S | 95 | Very high | 95.1 | Very high | 20 Ų | 20 | 79.5 Ų | 79.5 | 14% | 0.14 | 38% | 0.383 | C | S | . | . | trans | -71.6 | 143.6 | -174.4 | 70.6 | 0 | 0 | 0 | 0 | 109.8 | C12 E71 C72 C77 | C12-S79 PolarHBondContact SG-OG 3.29Å; E71-S79 WeakPolarHBondContact CA-O 3.34Å; C72-S79 PolarHBondContact N-O 2.88Å; C77-S79 PolarHBondContact O-N 3.19Å; C77-S79 WeakPolarHBondContact SG-CB 3.48Å; C77-S79 PolarHBondContact SG-OG 3.48Å | ||
| 80 | K | 95.3 | Very high | 95 | Very high | 104 Ų | 104 | 81.6 Ų | 81.6 | 45% | 0.452 | 40% | 0.397 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.3 | 129.6 | -177.4 | -74.7 | 140.2 | 177.9 | 172.4 | 0 | 109.5 | R69 L70 E71 | R69-K80 VanDerWaalsContact NH2-CD 3.25Å; L70-K80 CarbonylContact O-C 3.56Å; L70-K80 VanDerWaalsContact O-CA 3.29Å; L70-K80 WeakPolarHBondContact O-CA 2.98Å; E71-K80 HydrophobicContact CB-CG 4.15Å; E71-K80 HydrophobicContact CG-CG 4.2Å; E71-K80 WeakPolarHBondContact OE1-CE 3.39Å; E71-K80 IonicContact OE1-NZ 3.31Å; E71-K80 PolarHBondContact OE1-NZ 3.16Å; E71-K80 WeakPolarHBondContact OE2-CE 3.27Å |
| 81 | R | 95.6 | Very high | 94.9 | Very high | 88 Ų | 88 | 83.6 Ų | 83.6 | 33% | 0.332 | 41% | 0.405 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -124.1 | 138.3 | 174.1 | -175.9 | 170.9 | 69.3 | 114.2 | -7.8 | 110.2 | T10 L70 | T10-R81 PolarHBondContact OG1-NH2 2.87Å; L70-R81 PolarHBondContact N-O 3.46Å; L70-R81 PolarHBondContact O-N 2.64Å |
| 82 | M | 96.8 | Very high | 94.7 | Very high | 87 Ų | 87 | 83.9 Ų | 83.9 | 43% | 0.429 | 41% | 0.407 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -93.5 | 135.9 | 174.7 | -61.9 | -59.6 | -177.6 | 0 | 0 | 110.4 | Y26 V67 L68 R69 | Y26-M82 HydrophobicContact CD2-CE 3.66Å; Y26-M82 HydrophobicContact CD2-SD 4.15Å; Y26-M82 HydrophobicContact CE2-CE 4.09Å; V67-M82 HydrophobicContact CG1-CB 3.84Å; V67-M82 HydrophobicContact CG1-CG 4.34Å; V67-M82 HydrophobicContact CG1-SD 4.08Å; L68-M82 CarbonylContact O-C 3.56Å; L68-M82 WeakPolarHBondContact O-CA 3.5Å; R69-M82 HydrophobicContact CB-CE 4.28Å; R69-M82 HydrophobicContact CB-SD 3.79Å; R69-M82 HydrophobicContact CG-CE 4.17Å; R69-M82 HydrophobicContact CG-SD 4.16Å |
| 83 | L | 95.9 | Very high | 94.5 | Very high | 46 Ų | 46 | 86.1 Ų | 86.1 | 24% | 0.241 | 42% | 0.419 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.7 | 114.3 | 174.5 | -177.8 | 69.6 | 0 | 0 | 0 | 109.8 | V67 L68 L70 | V67-L83 WeakPolarHBondContact CA-O 3.38Å; L68-L83 PolarHBondContact N-O 3.09Å; L68-L83 PolarHBondContact O-N 3.21Å; L70-L83 HydrophobicContact CD1-CB 4.17Å; L70-L83 HydrophobicContact CD1-CD2 4.43Å |
| 84 | A | 96.9 | Very high | 94.2 | Very high | 64 Ų | 64 | 83.8 Ų | 83.8 | 53% | 0.529 | 41% | 0.412 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.1 | 132.5 | 174.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | V67 | V67-A84 HydrophobicContact CG2-CB 4.2Å |
| 85 | I | 95.6 | Very high | 93.9 | Very high | 39 Ų | 39 | 81.7 Ų | 81.7 | 20% | 0.2 | 41% | 0.409 | C | S | . | . | P | Polyproline II helix | trans | -98.1 | 170.1 | 171.2 | 63.4 | 161.6 | 0 | 0 | 0 | 111.2 | I66 L68 F91 | I66-I85 HydrophobicContact CB-CD1 3.95Å; I66-I85 HydrophobicContact CB-CG1 3.79Å; I66-I85 HydrophobicContact CG2-CD1 4.42Å; I66-I85 HydrophobicContact CG2-CG1 4.45Å; I66-I85 WeakPolarHBondContact O-CG1 3.49Å; I66-I85 PolarHBondContact O-N 3.41Å; L68-I85 HydrophobicContact CD1-CG2 3.96Å; L68-I85 HydrophobicContact CG-CG2 4.33Å; I85-F91 HydrophobicContact CD1-CD2 3.91Å; I85-F91 HydrophobicContact CD1-CE2 3.96Å |
| 86 | K | 96.2 | Very high | 93.8 | Very high | 190 Ų | 190 | 85 Ų | 85 | 83% | 0.826 | 42% | 0.422 | S | S | * | . | P | Polyproline II helix | trans | -62.1 | 159.3 | 170.3 | -65.2 | -174.1 | -179.8 | -178.7 | 0 | 110.4 | ||
| 87 | R | 96.9 | Very high | 93.6 | Very high | 114 Ų | 114 | 86.3 Ų | 86.3 | 43% | 0.43 | 42% | 0.42 | S | S | . | . | P | Polyproline II helix | trans | -67.3 | 136.4 | 178.4 | -68.7 | 172.1 | 174.7 | -86.3 | 0.1 | 109.9 | T63 K65 | T63-R87 VanDerWaalsContact C-NH1 3.26Å; T63-R87 PolarHBondContact O-NH1 3.01Å; K65-R87 HydrophobicContact CG-CG 3.74Å |
| 88 | C | 95.4 | Very high | 93.3 | Very high | 23 Ų | 23 | 95.4 Ų | 95.4 | 16% | 0.155 | 46% | 0.458 | C | S | . | . | trans | -141.2 | 155.1 | 173.5 | 54.3 | 0 | 0 | 0 | 0 | 109.8 | V2 | V2-C88 HydrophobicContact CB-CB 4.4Å; V2-C88 HydrophobicContact CG2-CB 3.65Å | ||
| 89 | K | 95.3 | Very high | 93.1 | Very high | 174 Ų | 174 | 96.7 Ų | 96.7 | 76% | 0.757 | 46% | 0.463 | S | S | * | . | S | Bend | trans | -81 | -43 | 175.6 | -69.3 | -173.8 | 178 | -177.1 | 0 | 111.9 | T63 | T63-K89 HydrophobicContact CG2-CG 3.87Š|
| 90 | H | 94.1 | Very high | 92.9 | Very high | 128 Ų | 128 | 105.6 Ų | 105.6 | 59% | 0.593 | 50% | 0.499 | S | S | * | . | trans | -120.2 | 125.2 | -179.7 | -55.1 | -80 | 0 | 0 | 0 | 110 | V2 | V2-H90 PolarHBondContact N-O 2.88Š| ||
| 91 | F | 94.3 | Very high | 92.5 | Very high | 41 Ų | 41 | 104.7 Ų | 104.7 | 18% | 0.18 | 52% | 0.519 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -133.2 | 133.7 | 179.9 | 173.2 | -96.2 | 0 | 0 | 0 | 109.9 | V2 V4 I66 L68 I85 L93 | V2-F91 HydrophobicContact CB-CD2 4.46Å; V2-F91 HydrophobicContact CG1-CD2 4.3Å; V2-F91 WeakPolarHBondContact O-CA 3.38Å; V4-F91 HydrophobicContact CB-CE2 4.03Å; V4-F91 HydrophobicContact CB-CZ 4.23Å; V4-F91 HydrophobicContact CG2-CE2 3.65Å; V4-F91 HydrophobicContact CG2-CZ 4.32Å; I66-F91 HydrophobicContact CD1-CB 3.2Å; I66-F91 HydrophobicContact CD1-CD1 3.82Å; I66-F91 HydrophobicContact CD1-CD2 3.85Å; I66-F91 HydrophobicContact CD1-CG 3.33Å; I66-F91 HydrophobicContact CG2-CD1 4.32Å; I66-F91 HydrophobicContact CG2-CE1 4.23Å; I66-F91 HydrophobicContact CG2-CE2 4.48Å; I66-F91 HydrophobicContact CG2-CZ 4.33Å; L68-F91 HydrophobicContact CD2-CE2 4.19Å; L68-F91 HydrophobicContact CD2-CZ 3.62Å; I85-F91 HydrophobicContact CD1-CD2 3.91Å; I85-F91 HydrophobicContact CD1-CE2 3.96Å; F91-L93 HydrophobicContact CE1-CB 4.29Å; F91-L93 HydrophobicContact CZ-CB 4.47Å; F91-L93 HydrophobicContact CZ-CD1 4.17Å |
| 92 | E | 93.6 | Very high | 92 | Very high | 57 Ų | 57 | 106.5 Ų | 106.5 | 27% | 0.266 | 53% | 0.531 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -132.5 | 150.4 | 176.1 | 64.8 | -173.3 | 170.5 | 0 | 0 | 110.3 | M1 V2 N3 V4 | M1-E92 HydrophobicContact CG-CG 4.25Å; M1-E92 WeakPolarHBondContact CG-OE1 3.43Å; V2-E92 PolarHBondContact O-N 3.32Å; N3-E92 HydrophobicContact CB-CG 3.74Å; N3-E92 WeakPolarHBondContact CB-OE1 3.38Å; V4-E92 PolarHBondContact N-O 3.36Å; V4-E92 VanDerWaalsContact N-O 3.08Å |
| 93 | L | 92.4 | Very high | 91.5 | Very high | 49 Ų | 49 | 108.6 Ų | 108.6 | 26% | 0.257 | 55% | 0.549 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -119.4 | 109.5 | 179.7 | -169.6 | 79.9 | 0 | 0 | 0 | 109.8 | V4 K6 V23 F91 | V4-L93 HydrophobicContact CB-CD1 4.01Å; V4-L93 HydrophobicContact CG1-CD1 3.93Å; V4-L93 CarbonylContact O-C 3.53Å; V4-L93 WeakPolarHBondContact O-CA 3.45Å; V4-L93 WeakPolarHBondContact O-CD1 3.45Å; K6-L93 VanDerWaalsContact CE-O 3.23Å; K6-L93 WeakPolarHBondContact CE-O 3.32Å; K6-L93 HydrophobicContact CG-CD2 4.24Å; K6-L93 HydrophobicContact CG-CG 4.03Å; V23-L93 HydrophobicContact CB-CD1 4.27Å; V23-L93 HydrophobicContact CG1-CD1 3.81Å; V23-L93 WeakPolarHBondContact O-CD2 3.49Å; F91-L93 HydrophobicContact CE1-CB 4.29Å; F91-L93 HydrophobicContact CZ-CB 4.47Å; F91-L93 HydrophobicContact CZ-CD1 4.17Å |
| 94 | G | 89.2 | Confident | 91 | Very high | 37 Ų | 37 | 113 Ų | 113 | 38% | 0.381 | 57% | 0.571 | S | S | . | * | S | Bend | trans | 76.8 | 35.7 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.7 | V4 | V4-G94 PolarHBondContact O-N 2.95Š|
| 95 | G | 87.6 | Confident | 90.5 | Very high | 26 Ų | 26 | 118.7 Ų | 118.7 | 27% | 0.268 | 59% | 0.587 | S | S | . | * | P | Polyproline II helix | trans | -71.8 | 170.4 | 166.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | N3 | N3-G95 WeakPolarHBondContact ND2-CA 3.44Å; N3-G95 PolarHBondContact ND2-O 3.25Å; N3-G95 PolarHBondContact OD1-N 3.24Å |
| 96 | D | 86.1 | Confident | 90 | Very high | 154 Ų | 154 | 129.3 Ų | 129.3 | 82% | 0.824 | 63% | 0.632 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 146.5 | 180 | -69.2 | -45.7 | 0 | 0 | 0 | 112.3 | N3 | N3-D96 PolarHBondContact ND2-O 3.29Š|
| 97 | K | 87.3 | Confident | 89.7 | Confident | 189 Ų | 189 | 126.3 Ų | 126.3 | 82% | 0.822 | 62% | 0.622 | S | S | * | * | P | Polyproline II helix | trans | -72 | 137.4 | 169.8 | -67.3 | -179.3 | -176.5 | 174.1 | 0 | 108.1 | R99 | K97-R99 PolarHBondContact O-N 3.49Š|
| 98 | K | 87.5 | Confident | 89.3 | Confident | 208 Ų | 208 | 126.9 Ų | 126.9 | 90% | 0.904 | 63% | 0.632 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 128.6 | 172.6 | -64 | -170.9 | 175.7 | -169.2 | 0 | 109.6 | ||
| 99 | R | 89.3 | Confident | 88.9 | Confident | 193 Ų | 193 | 132.7 Ų | 132.7 | 73% | 0.728 | 66% | 0.659 | S | S | * | * | P | Polyproline II helix | trans | -76.7 | 144.6 | 173.9 | -63.8 | 176.8 | -178.8 | -178 | 4.1 | 109.2 | K97 Q102 | K97-R99 PolarHBondContact O-N 3.49Å; R99-Q102 HydrophobicContact CB-CG 4.04Å; R99-Q102 VanDerWaalsContact CD-CD 3.46Å |
| 100 | K | 90 | Very high | 88.6 | Confident | 206 Ų | 206 | 130.2 Ų | 130.2 | 90% | 0.896 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -86.8 | 140.2 | 176.9 | -66.4 | -175.2 | 178.4 | -177 | 0 | 109.4 | Q102 | K100-Q102 VanDerWaalsContact C-N 3.32Å; K100-Q102 PolarHBondContact O-N 3.11Å |
| 101 | G | 86.1 | Confident | 88.2 | Confident | 86 Ų | 86 | 130.4 Ų | 130.4 | 89% | 0.887 | 66% | 0.657 | S | S | * | * | S | Bend | trans | 71.7 | 14.3 | 169 | 0 | 0 | 0 | 0 | 0 | 116.5 | ||
| 102 | Q | 84.9 | Confident | 87.8 | Confident | 126 Ų | 126 | 136.3 Ų | 136.3 | 59% | 0.589 | 69% | 0.688 | S | S | * | * | P | Polyproline II helix | trans | -75.4 | 131.9 | 173.3 | -79.1 | -170 | -44.6 | 0 | 0 | 110.7 | R99 K100 | R99-Q102 HydrophobicContact CB-CG 4.04Å; R99-Q102 VanDerWaalsContact CD-CD 3.46Å; K100-Q102 VanDerWaalsContact C-N 3.32Å; K100-Q102 PolarHBondContact O-N 3.11Å |
| 103 | V | 87.2 | Confident | 87.4 | Confident | 131 Ų | 131 | 142 Ų | 142 | 79% | 0.794 | 72% | 0.719 | S | S | * | * | P | Polyproline II helix | trans | -65.4 | 145.5 | 166.5 | -67.6 | 0 | 0 | 0 | 0 | 109.7 | Q105 | V103-Q105 PolarHBondContact O-N 3.06Š|
| 104 | I | 86.2 | Confident | 87 | Confident | 137 Ų | 137 | 149.2 Ų | 149.2 | 70% | 0.703 | 75% | 0.754 | S | S | * | * | P | Polyproline II helix | trans | -70 | 116.9 | 175 | -60.9 | 172.8 | 0 | 0 | 0 | 106.8 | F106 | I104-F106 HydrophobicContact CG2-CE1 4.4Å; I104-F106 HydrophobicContact CG2-CZ 4.42Å |
| 105 | Q | 84.4 | Confident | 86.8 | Confident | 185 Ų | 185 | 158.5 Ų | 158.5 | 86% | 0.864 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -75.7 | 128.3 | 166.4 | -99.4 | 178.1 | -38.8 | 0 | 0 | 108.2 | V103 | V103-Q105 PolarHBondContact O-N 3.06Š|
| 106 | F | 85.4 | Confident | 86.8 | Confident | 261 Ų | 261 | 170.5 Ų | 170.5 | 100% | 1.145 | 83% | 0.832 | S | S | * | * | trans | -91.2 | 0 | 172.1 | -65.3 | -78.7 | 0 | 0 | 0 | 110.3 | I104 | I104-F106 HydrophobicContact CG2-CE1 4.4Å; I104-F106 HydrophobicContact CG2-CZ 4.42Å |
Retrieved 106 of 106 residues in 76.3 ms
(Link to these results)