| 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 | 47 | Very low | 48.4 | Very low | 214 Ų | 214 | 111.2 Ų | 111.2 | 100% | 1.054 | 52% | 0.515 | S | S | * | . | 0 | 117.7 | 0 | -89.7 | -171.1 | -175.4 | 0 | 0 | 107.6 | |||||
| 2 | C | 47.3 | Very low | 48 | Very low | 10 Ų | 10 | 111.2 Ų | 111.2 | 7% | 0.068 | 52% | 0.519 | C | S | . | . | P | Polyproline II helix | trans | -96.6 | 143.2 | 178.3 | 56.9 | 0 | 0 | 0 | 0 | 111.8 | E6 V8 C19 R58 | C2-E6 VanDerWaalsContact CA-OE2 3.29Å; C2-E6 WeakPolarHBondContact CA-OE2 3.46Å; C2-E6 HydrophobicContact CB-CB 4.31Å; C2-V8 HydrophobicContact CB-CG1 3.52Å; C2-V8 HydrophobicContact CB-CG2 4.23Å; C2-C19 HydrophobicContact CB-CB 3.98Å; C2-C19 WeakPolarHBondContact CB-SG 3.27Å; C2-C19 WeakPolarHBondContact SG-CB 3.45Å; C2-C19 CovalentContact SG-SG 2.01Å; C2-C19 PolarHBondContact SG-SG 3.35Å; C2-R58 PolarHBondContact O-NH1 2.61Å |
| 3 | R | 49.2 | Very low | 47.8 | Very low | 196 Ų | 196 | 106.2 Ų | 106.2 | 74% | 0.74 | 51% | 0.505 | S | S | * | . | P | Polyproline II helix | trans | -67.2 | 149.7 | 173.4 | -62.4 | 179.6 | 177.5 | -178.9 | -0.9 | 109.5 | E5 E6 C19 | R3-E5 PolarHBondContact O-N 2.9Å; R3-E6 HydrophobicContact CB-CB 4.16Å; R3-E6 PolarHBondContact N-OE2 3.26Å; R3-E6 WeakPolarHBondContact O-CB 3.3Å; R3-E6 PolarHBondContact O-N 3.44Å; R3-C19 VanDerWaalsContact O-CB 3.3Å; R3-C19 WeakPolarHBondContact O-CB 3.29Å |
| 4 | P | 48.2 | Very low | 47.8 | Very low | 70 Ų | 70 | 101.2 Ų | 101.2 | 46% | 0.455 | 50% | 0.495 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -48.7 | 139.6 | 166.3 | -23.6 | 33.7 | 0 | 0 | 0 | 109.5 | E6 | P4-E6 PolarHBondContact O-N 3.16Å; P4-E6 VanDerWaalsContact O-N 3.12Å |
| 5 | E | 46.8 | Very low | 47.3 | Very low | 93 Ų | 93 | 98.9 Ų | 98.9 | 44% | 0.435 | 49% | 0.485 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 68.8 | -1.8 | -177.9 | -51 | 163 | -172.9 | 0 | 0 | 115.2 | R3 V7 C19 A36 K37 | R3-E5 PolarHBondContact O-N 2.9Å; E5-V7 PolarHBondContact O-N 3.32Å; E5-C19 PolarHBondContact N-O 3.44Å; E5-A36 WeakPolarHBondContact OE1-CA 3.2Å; E5-A36 PolarHBondContact OE1-N 3.32Å; E5-K37 PolarHBondContact OE1-N 3.46Å |
| 6 | E | 46.1 | Very low | 46.9 | Very low | 81 Ų | 81 | 97.3 Ų | 97.3 | 38% | 0.379 | 49% | 0.485 | S | S | . | . | trans | -70.7 | 124.3 | 172.1 | -166.6 | 179.7 | 170.5 | 0 | 0 | 109.3 | C2 R3 P4 V8 C19 | C2-E6 VanDerWaalsContact CA-OE2 3.29Å; C2-E6 WeakPolarHBondContact CA-OE2 3.46Å; C2-E6 HydrophobicContact CB-CB 4.31Å; R3-E6 HydrophobicContact CB-CB 4.16Å; R3-E6 PolarHBondContact N-OE2 3.26Å; R3-E6 WeakPolarHBondContact O-CB 3.3Å; R3-E6 PolarHBondContact O-N 3.44Å; P4-E6 PolarHBondContact O-N 3.16Å; P4-E6 VanDerWaalsContact O-N 3.12Å; E6-V8 HydrophobicContact CB-CG1 4.39Å; E6-V8 HydrophobicContact CG-CG1 3.79Å; E6-V8 PolarHBondContact O-N 3.44Å; E6-C19 PolarHBondContact O-N 2.88Å | ||
| 7 | V | 47.1 | Very low | 46.8 | Very low | 93 Ų | 93 | 91.8 Ų | 91.8 | 56% | 0.564 | 46% | 0.458 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -80.1 | 111.3 | 167.1 | -177.7 | 0 | 0 | 0 | 0 | 107.5 | E5 P16 V17 I18 | E5-V7 PolarHBondContact O-N 3.32Å; V7-P16 HydrophobicContact CG1-CB 3.68Å; V7-V17 WeakPolarHBondContact CA-O 3.36Å; V7-I18 HydrophobicContact CG2-CG1 4.19Å |
| 8 | V | 49.8 | Very low | 46.8 | Very low | 37 Ų | 37 | 88.4 Ų | 88.4 | 22% | 0.224 | 44% | 0.441 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.5 | 147.4 | 176.4 | -65.2 | 0 | 0 | 0 | 0 | 110.7 | C2 E6 D10 V17 | C2-V8 HydrophobicContact CB-CG1 3.52Å; C2-V8 HydrophobicContact CB-CG2 4.23Å; E6-V8 HydrophobicContact CB-CG1 4.39Å; E6-V8 HydrophobicContact CG-CG1 3.79Å; E6-V8 PolarHBondContact O-N 3.44Å; V8-D10 PolarHBondContact O-N 3.45Å; V8-V17 HydrophobicContact CG2-CB 4.41Å; V8-V17 PolarHBondContact N-O 3.21Å; V8-V17 PolarHBondContact O-N 3.39Å |
| 9 | K | 50.6 | Low | 46.9 | Very low | 162 Ų | 162 | 84 Ų | 84 | 70% | 0.704 | 42% | 0.419 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -77.4 | 116 | 170.2 | -166.7 | 174 | -174.9 | 176.7 | 0 | 108.5 | R11 G14 | K9-R11 PolarHBondContact O-N 3.07Å; K9-G14 WeakPolarHBondContact CE-O 3.47Å |
| 10 | D | 51.1 | Low | 46.9 | Very low | 21 Ų | 21 | 80 Ų | 80 | 11% | 0.112 | 40% | 0.4 | C | S | . | . | trans | -63.2 | 128.9 | 171.5 | 173.1 | 35.6 | 0 | 0 | 0 | 109.3 | V8 I12 S13 G14 L15 V17 | V8-D10 PolarHBondContact O-N 3.45Å; D10-I12 PolarHBondContact O-N 2.88Å; D10-I12 PolarHBondContact OD1-N 3.02Å; D10-S13 WeakPolarHBondContact CB-OG 3.4Å; D10-S13 VanDerWaalsContact OD2-CB 3.26Å; D10-S13 WeakPolarHBondContact OD2-CB 3.25Å; D10-S13 PolarHBondContact OD2-N 3.21Å; D10-S13 PolarHBondContact OD2-OG 3.06Å; D10-G14 WeakPolarHBondContact O-CA 3.25Å; D10-G14 PolarHBondContact O-N 3.03Å; D10-L15 PolarHBondContact N-O 3.34Å; D10-V17 HydrophobicContact CB-CG2 3.71Å | ||
| 11 | R | 49.7 | Very low | 46.7 | Very low | 246 Ų | 246 | 81.4 Ų | 81.4 | 93% | 0.928 | 41% | 0.406 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.2 | -22.4 | -176.2 | -69 | -174.7 | 178.8 | -172.9 | -1.4 | 112.3 | K9 | K9-R11 PolarHBondContact O-N 3.07Š|
| 12 | I | 43.6 | Very low | 46.6 | Very low | 111 Ų | 111 | 74 Ų | 74 | 57% | 0.569 | 37% | 0.366 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.6 | -51.2 | -178.8 | -58.3 | 112 | 0 | 0 | 0 | 112 | D10 | D10-I12 PolarHBondContact O-N 2.88Å; D10-I12 PolarHBondContact OD1-N 3.02Å |
| 13 | S | 44.5 | Very low | 46.3 | Very low | 47 Ų | 47 | 78 Ų | 78 | 33% | 0.329 | 38% | 0.382 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -81.2 | -20.7 | 179.1 | 62.2 | 0 | 0 | 0 | 0 | 113.2 | D10 L15 | D10-S13 WeakPolarHBondContact CB-OG 3.4Å; D10-S13 VanDerWaalsContact OD2-CB 3.26Å; D10-S13 WeakPolarHBondContact OD2-CB 3.25Å; D10-S13 PolarHBondContact OD2-N 3.21Å; D10-S13 PolarHBondContact OD2-OG 3.06Å; S13-L15 PolarHBondContact O-N 3.39Å; S13-L15 WeakPolarHBondContact OG-CB 3.47Å; S13-L15 PolarHBondContact OG-N 3.11Å |
| 14 | G | 48.6 | Very low | 45.9 | Very low | 36 Ų | 36 | 75.3 Ų | 75.3 | 37% | 0.371 | 38% | 0.378 | S | S | . | . | trans | 71.3 | 4.5 | -170.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | K9 D10 | K9-G14 WeakPolarHBondContact CE-O 3.47Å; D10-G14 WeakPolarHBondContact O-CA 3.25Å; D10-G14 PolarHBondContact O-N 3.03Å | ||
| 15 | L | 39.4 | Very low | 45.3 | Very low | 67 Ų | 67 | 75.2 Ų | 75.2 | 35% | 0.351 | 38% | 0.379 | S | S | . | . | trans | -91.3 | 153.5 | -174.8 | -62.5 | 175.9 | 0 | 0 | 0 | 111.9 | D10 S13 E62 | D10-L15 PolarHBondContact N-O 3.34Å; S13-L15 PolarHBondContact O-N 3.39Å; S13-L15 WeakPolarHBondContact OG-CB 3.47Å; S13-L15 PolarHBondContact OG-N 3.11Å; L15-E62 HydrophobicContact CD1-CG 4.11Å; L15-E62 WeakPolarHBondContact CD1-OE1 3.3Å | ||
| 16 | P | 40.8 | Very low | 44.8 | Very low | 73 Ų | 73 | 76.7 Ų | 76.7 | 47% | 0.474 | 38% | 0.384 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.5 | 133.4 | 170.9 | 29.6 | -33.2 | 0 | 0 | 0 | 110.1 | V7 | V7-P16 HydrophobicContact CG1-CB 3.68Å |
| 17 | V | 45.3 | Very low | 44.3 | Very low | 4 Ų | 4 | 82.8 Ų | 82.8 | 2% | 0.024 | 41% | 0.413 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.1 | 133.1 | -178.6 | 170.5 | 0 | 0 | 0 | 0 | 109 | V7 V8 D10 A60 F61 | V7-V17 WeakPolarHBondContact CA-O 3.36Å; V8-V17 HydrophobicContact CG2-CB 4.41Å; V8-V17 PolarHBondContact N-O 3.21Å; V8-V17 PolarHBondContact O-N 3.39Å; D10-V17 HydrophobicContact CB-CG2 3.71Å; V17-A60 HydrophobicContact CG1-CB 3.19Å; V17-F61 VanDerWaalsContact CA-O 3.3Å; V17-F61 WeakPolarHBondContact CA-O 3.11Å |
| 18 | I | 46.7 | Very low | 43.6 | Very low | 30 Ų | 30 | 84.9 Ų | 84.9 | 15% | 0.154 | 41% | 0.414 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.9 | 130.8 | 173.3 | -62.8 | 172.6 | 0 | 0 | 0 | 109.5 | V7 L35 F61 L63 | V7-I18 HydrophobicContact CG2-CG1 4.19Å; I18-L35 HydrophobicContact CG2-CD2 3.74Å; I18-F61 PolarHBondContact N-O 3.42Å; I18-F61 PolarHBondContact O-N 3.11Å; I18-L63 HydrophobicContact CD1-CD1 3.37Å; I18-L63 HydrophobicContact CD1-CG 4.1Å; I18-L63 HydrophobicContact CG1-CD1 3.94Å |
| 19 | C | 49.2 | Very low | 43 | Very low | 5 Ų | 5 | 87.4 Ų | 87.4 | 3% | 0.034 | 42% | 0.424 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.1 | 121.1 | 173.4 | -66.6 | 0 | 0 | 0 | 0 | 111.8 | C2 R3 E5 E6 | C2-C19 HydrophobicContact CB-CB 3.98Å; C2-C19 WeakPolarHBondContact CB-SG 3.27Å; C2-C19 WeakPolarHBondContact SG-CB 3.45Å; C2-C19 CovalentContact SG-SG 2.01Å; C2-C19 PolarHBondContact SG-SG 3.35Å; R3-C19 VanDerWaalsContact O-CB 3.3Å; R3-C19 WeakPolarHBondContact O-CB 3.29Å; E5-C19 PolarHBondContact N-O 3.44Å; E6-C19 PolarHBondContact O-N 2.88Å |
| 20 | G | 48 | Very low | 42.1 | Very low | 4 Ų | 4 | 83.2 Ų | 83.2 | 4% | 0.041 | 41% | 0.406 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.8 | 167 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.2 | V59 | G20-V59 PolarHBondContact N-O 3.39Å |
| 21 | Q | 42.3 | Very low | 41.3 | Very low | 109 Ų | 109 | 82.4 Ų | 82.4 | 51% | 0.509 | 40% | 0.401 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.6 | 132.7 | 173.2 | -176.5 | 171.8 | -2.4 | 0 | 0 | 110.3 | ||
| 22 | R | 44.2 | Very low | 40.5 | Very low | 59 Ų | 59 | 72.3 Ų | 72.3 | 22% | 0.223 | 37% | 0.366 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.5 | 133 | 175.4 | -180 | 177.2 | -169.3 | -154.7 | 5 | 111 | L31 Y53 G54 | R22-L31 HydrophobicContact CB-CD1 3.87Å; R22-L31 HydrophobicContact CB-CG 4.25Å; R22-L31 HydrophobicContact CG-CD1 3.54Å; R22-L31 HydrophobicContact CG-CG 3.89Å; R22-Y53 PolarHBondContact NH1-O 3.04Å; R22-G54 PolarHBondContact NH1-O 3.35Å |
| 23 | F | 41.5 | Very low | 40 | Very low | 93 Ų | 93 | 67.1 Ų | 67.1 | 41% | 0.408 | 34% | 0.339 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.2 | 131.9 | 166.9 | -65.7 | -96.1 | 0 | 0 | 0 | 110.5 | S25 I32 | F23-S25 PolarHBondContact O-N 3.32Å; F23-I32 HydrophobicContact CB-CB 4.35Å; F23-I32 HydrophobicContact CD2-CG2 4.32Å; F23-I32 PolarHBondContact N-O 3.29Å |
| 24 | E | 39.8 | Very low | 39.5 | Very low | 141 Ų | 141 | 66.4 Ų | 66.4 | 66% | 0.659 | 33% | 0.334 | S | S | * | . | trans | -80.4 | 102.8 | 171.1 | -71.5 | -177.9 | 145.4 | 0 | 0 | 109 | P55 | E24-P55 HydrophobicContact CG-CB 4.2Å; E24-P55 WeakPolarHBondContact OE1-CB 3.4Å; E24-P55 VanDerWaalsContact OE1-CD 3.24Å; E24-P55 WeakPolarHBondContact OE1-CD 3.42Å; E24-P55 WeakPolarHBondContact OE1-CG 3.04Å | ||
| 25 | S | 37.3 | Very low | 38.7 | Very low | 67 Ų | 67 | 67 Ų | 67 | 47% | 0.469 | 33% | 0.329 | S | S | . | . | trans | -152.3 | 12.9 | 170.9 | 56.7 | 0 | 0 | 0 | 0 | 116.9 | F23 I32 | F23-S25 PolarHBondContact O-N 3.32Å; S25-I32 VanDerWaalsContact OG-CD1 3.27Å; S25-I32 WeakPolarHBondContact OG-CD1 3.1Å | ||
| 26 | F | 35.4 | Very low | 38.3 | Very low | 124 Ų | 124 | 66.6 Ų | 66.6 | 54% | 0.544 | 33% | 0.334 | S | S | . | . | trans | -137.5 | 124.9 | 172.1 | -66.8 | -75.8 | 0 | 0 | 0 | 111 | K28 F30 I32 | F26-K28 WeakPolarHBondContact CB-O 3.38Å; F26-K28 PolarHBondContact O-N 3.27Å; F26-F30 HydrophobicContact CB-CB 4.38Å; F26-F30 HydrophobicContact CB-CD2 4.35Å; F26-F30 HydrophobicContact CD2-CB 4.16Å; F26-F30 HydrophobicContact CG-CB 4.48Å; F26-I32 HydrophobicContact CD2-CD1 4.06Å; F26-I32 HydrophobicContact CE2-CD1 3.53Å; F26-I32 HydrophobicContact CE2-CG1 4.23Å | ||
| 27 | E | 34.5 | Very low | 37.8 | Very low | 209 Ų | 209 | 72.3 Ų | 72.3 | 98% | 0.977 | 35% | 0.352 | S | S | * | . | S | Bend | trans | -64.7 | 4.7 | 172.6 | -68.5 | -178.8 | 152.2 | 0 | 0 | 113 | ||
| 28 | K | 33.5 | Very low | 36.9 | Very low | 137 Ų | 137 | 78.9 Ų | 78.9 | 60% | 0.596 | 38% | 0.382 | S | S | * | . | S | Bend | trans | -142.2 | 133.6 | 175.6 | -63.7 | -173.8 | 178.6 | -175.3 | 0 | 110 | F26 F30 | F26-K28 WeakPolarHBondContact CB-O 3.38Å; F26-K28 PolarHBondContact O-N 3.27Å; K28-F30 VanDerWaalsContact C-N 3.3Å; K28-F30 WeakPolarHBondContact O-CD2 3.24Å; K28-F30 PolarHBondContact O-N 2.93Å |
| 29 | E | 36.6 | Very low | 36.2 | Very low | 91 Ų | 91 | 81.9 Ų | 81.9 | 43% | 0.425 | 40% | 0.404 | S | S | . | . | S | Bend | trans | 3.6 | 36.8 | 168.5 | -54.8 | -169.9 | 130.5 | 0 | 0 | 123.3 | V48 E50 | E29-V48 PolarHBondContact O-N 3.39Å; E29-E50 WeakPolarHBondContact OE1-CG 3.11Å |
| 30 | F | 32.4 | Very low | 35.2 | Very low | 74 Ų | 74 | 84.8 Ų | 84.8 | 33% | 0.325 | 42% | 0.424 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -115.6 | 136.1 | 173.9 | -61.2 | -76.1 | 0 | 0 | 0 | 111.6 | F26 K28 L45 | F26-F30 HydrophobicContact CB-CB 4.38Å; F26-F30 HydrophobicContact CB-CD2 4.35Å; F26-F30 HydrophobicContact CD2-CB 4.16Å; F26-F30 HydrophobicContact CG-CB 4.48Å; K28-F30 VanDerWaalsContact C-N 3.3Å; K28-F30 WeakPolarHBondContact O-CD2 3.24Å; K28-F30 PolarHBondContact O-N 2.93Å; F30-L45 HydrophobicContact CD1-CD2 4.05Å; F30-L45 HydrophobicContact CE1-CD2 4.31Å |
| 31 | L | 33.3 | Very low | 34.4 | Very low | 4 Ų | 4 | 89.5 Ų | 89.5 | 2% | 0.021 | 46% | 0.457 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.9 | 112.6 | 168.7 | -169.2 | 136.8 | 0 | 0 | 0 | 108.6 | R22 V33 A46 V48 V59 W70 | R22-L31 HydrophobicContact CB-CD1 3.87Å; R22-L31 HydrophobicContact CB-CG 4.25Å; R22-L31 HydrophobicContact CG-CD1 3.54Å; R22-L31 HydrophobicContact CG-CG 3.89Å; L31-V33 HydrophobicContact CD2-CB 4.48Å; L31-V33 HydrophobicContact CD2-CG2 3.27Å; L31-A46 PolarHBondContact N-O 3.14Å; L31-A46 PolarHBondContact O-N 2.94Å; L31-V48 HydrophobicContact CB-CG2 3.36Å; L31-V48 HydrophobicContact CD1-CG2 4.46Å; L31-V48 HydrophobicContact CG-CG2 4.48Å; L31-V59 HydrophobicContact CD1-CG1 4.1Å; L31-V59 HydrophobicContact CD2-CG1 4.35Å; L31-V59 HydrophobicContact CD2-CG2 4Å; L31-W70 HydrophobicContact CB-CH2 4.18Å; L31-W70 HydrophobicContact CB-CZ2 4.39Å; L31-W70 HydrophobicContact CD1-CH2 4.26Å; L31-W70 HydrophobicContact CD2-CH2 3.55Å; L31-W70 HydrophobicContact CD2-CZ2 4.3Å; L31-W70 HydrophobicContact CD2-CZ3 4.48Å; L31-W70 HydrophobicContact CG-CH2 4.18Å |
| 32 | I | 33.1 | Very low | 33.9 | Very low | 34 Ų | 34 | 88.9 Ų | 88.9 | 17% | 0.174 | 46% | 0.456 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -81.2 | 124.8 | 169 | -63.7 | 166.2 | 0 | 0 | 0 | 107.3 | F23 S25 F26 A43 | F23-I32 HydrophobicContact CB-CB 4.35Å; F23-I32 HydrophobicContact CD2-CG2 4.32Å; F23-I32 PolarHBondContact N-O 3.29Å; S25-I32 VanDerWaalsContact OG-CD1 3.27Å; S25-I32 WeakPolarHBondContact OG-CD1 3.1Å; F26-I32 HydrophobicContact CD2-CD1 4.06Å; F26-I32 HydrophobicContact CE2-CD1 3.53Å; F26-I32 HydrophobicContact CE2-CG1 4.23Å; I32-A43 HydrophobicContact CG2-CB 4.17Å |
| 33 | V | 34.6 | Very low | 33.3 | Very low | 1 Ų | 1 | 89.2 Ų | 89.2 | 1% | 0.006 | 47% | 0.472 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.7 | 108.7 | 173.5 | -170.5 | 0 | 0 | 0 | 0 | 106.5 | L31 L35 L44 F61 | L31-V33 HydrophobicContact CD2-CB 4.48Å; L31-V33 HydrophobicContact CD2-CG2 3.27Å; V33-L35 HydrophobicContact CG1-CD2 4.38Å; V33-L44 PolarHBondContact N-O 3.33Å; V33-L44 PolarHBondContact O-N 3.24Å; V33-F61 HydrophobicContact CB-CE2 4.21Å; V33-F61 HydrophobicContact CB-CZ 4.03Å; V33-F61 HydrophobicContact CG1-CD2 4.23Å; V33-F61 HydrophobicContact CG1-CE2 3.43Å; V33-F61 VanDerWaalsContact CG1-CE2 3.43Å; V33-F61 HydrophobicContact CG1-CZ 3.77Å; V33-F61 HydrophobicContact CG2-CE1 3.83Å; V33-F61 HydrophobicContact CG2-CE2 3.77Å; V33-F61 HydrophobicContact CG2-CZ 3.14Å |
| 34 | S | 32.5 | Very low | 33.1 | Very low | 33 Ų | 33 | 87 Ų | 87 | 23% | 0.231 | 47% | 0.465 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -80.5 | 119.8 | 165.9 | -162.7 | 0 | 0 | 0 | 0 | 107.8 | ||
| 35 | L | 32.8 | Very low | 32.8 | Very low | 49 Ų | 49 | 84.8 Ų | 84.8 | 26% | 0.257 | 46% | 0.457 | S | S | . | . | trans | -92.3 | 124.3 | 159.6 | -62 | 175 | 0 | 0 | 0 | 105.5 | I18 V33 L44 | I18-L35 HydrophobicContact CG2-CD2 3.74Å; V33-L35 HydrophobicContact CG1-CD2 4.38Å; L35-L44 HydrophobicContact CD1-CD1 3.6Å; L35-L44 HydrophobicContact CG-CD1 4.46Å | ||
| 36 | A | 30.3 | Very low | 32.7 | Very low | 57 Ų | 57 | 82.4 Ų | 82.4 | 47% | 0.471 | 44% | 0.441 | S | S | . | . | S | Bend | trans | 97.3 | 126.8 | 175 | 0 | 0 | 0 | 0 | 0 | 118.6 | E5 E38 | E5-A36 WeakPolarHBondContact OE1-CA 3.2Å; E5-A36 PolarHBondContact OE1-N 3.32Å; A36-E38 PolarHBondContact O-N 2.98Å |
| 37 | K | 30.4 | Very low | 32.6 | Very low | 194 Ų | 194 | 79.7 Ų | 79.7 | 84% | 0.843 | 44% | 0.437 | S | S | * | . | S | Bend | trans | -7.8 | -16.9 | 154 | -125.7 | 172.6 | 179 | -179 | 0 | 122 | E5 | E5-K37 PolarHBondContact OE1-N 3.46Š|
| 38 | E | 27.2 | Very low | 32.5 | Very low | 141 Ų | 141 | 70.5 Ų | 70.5 | 66% | 0.659 | 40% | 0.395 | S | S | * | . | S | Bend | trans | -147.3 | 139.6 | 176.2 | -72.5 | -177.3 | 163.2 | 0 | 0 | 108.1 | A36 S40 | A36-E38 PolarHBondContact O-N 2.98Å; E38-S40 PolarHBondContact O-N 3.17Å |
| 39 | P | 30.8 | Very low | 32.4 | Very low | 94 Ų | 94 | 67.1 Ų | 67.1 | 61% | 0.61 | 39% | 0.389 | S | S | * | . | S | Bend | trans | -70 | 27.7 | -170 | 28.9 | -35.1 | 0 | 0 | 0 | 115.2 | L156 | P39-L156 HydrophobicContact CG-CD1 4.05Å; P39-L156 HydrophobicContact CG-CD2 4.4Å |
| 40 | S | 28.6 | Very low | 32.2 | Very low | 66 Ų | 66 | 69.8 Ų | 69.8 | 46% | 0.462 | 40% | 0.401 | S | S | . | . | S | Bend | trans | -129.1 | 91.3 | -173 | 56.1 | 0 | 0 | 0 | 0 | 111 | E38 | E38-S40 PolarHBondContact O-N 3.17Š|
| 41 | S | 30.4 | Very low | 32.1 | Very low | 103 Ų | 103 | 70.7 Ų | 70.7 | 72% | 0.72 | 41% | 0.405 | S | S | * | . | S | Bend | 161.4 | -30.4 | 127.1 | 59.2 | 0 | 0 | 0 | 0 | 113.8 | |||
| 42 | D | 32.8 | Very low | 31.9 | Very low | 95 Ų | 95 | 74.8 Ų | 74.8 | 51% | 0.508 | 44% | 0.44 | S | S | . | . | trans | -137.6 | 80.5 | -168.5 | -62.5 | -63.3 | 0 | 0 | 0 | 112.5 | ||||
| 43 | A | 31.8 | Very low | 32 | Very low | 67 Ų | 67 | 76.2 Ų | 76.2 | 55% | 0.554 | 44% | 0.443 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -87.4 | 123 | 169.3 | 0 | 0 | 0 | 0 | 0 | 109.9 | I32 | I32-A43 HydrophobicContact CG2-CB 4.17Å |
| 44 | L | 37.3 | Very low | 31.9 | Very low | 47 Ų | 47 | 77.7 Ų | 77.7 | 25% | 0.246 | 46% | 0.459 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.8 | 122.4 | 170.6 | -77.5 | 162.9 | 0 | 0 | 0 | 109.1 | V33 L35 Y68 | V33-L44 PolarHBondContact N-O 3.33Å; V33-L44 PolarHBondContact O-N 3.24Å; L35-L44 HydrophobicContact CD1-CD1 3.6Å; L35-L44 HydrophobicContact CG-CD1 4.46Å; L44-Y68 HydrophobicContact CD1-CD1 4.08Å; L44-Y68 HydrophobicContact CD1-CE1 3.73Å; L44-Y68 HydrophobicContact CD1-CE2 4.23Å; L44-Y68 HydrophobicContact CD1-CG 4.48Å; L44-Y68 HydrophobicContact CD2-CD2 3.98Å; L44-Y68 HydrophobicContact CD2-CE2 3.69Å |
| 45 | L | 32.5 | Very low | 31.9 | Very low | 94 Ų | 94 | 80.2 Ų | 80.2 | 49% | 0.492 | 48% | 0.475 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -84.7 | 121.8 | 170.6 | -146.1 | 98.2 | 0 | 0 | 0 | 108.4 | F30 | F30-L45 HydrophobicContact CD1-CD2 4.05Å; F30-L45 HydrophobicContact CE1-CD2 4.31Å |
| 46 | A | 35.3 | Very low | 31.9 | Very low | 16 Ų | 16 | 81 Ų | 81 | 13% | 0.132 | 49% | 0.494 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -130.8 | 125.2 | 179.8 | 0 | 0 | 0 | 0 | 0 | 109.6 | L31 W70 | L31-A46 PolarHBondContact N-O 3.14Å; L31-A46 PolarHBondContact O-N 2.94Å; A46-W70 HydrophobicContact CB-CH2 4.42Å; A46-W70 HydrophobicContact CB-CZ2 3.31Å |
| 47 | S | 33.7 | Very low | 32.3 | Very low | 67 Ų | 67 | 81 Ų | 81 | 47% | 0.469 | 49% | 0.487 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -70.3 | 135.8 | 176.9 | 67.2 | 0 | 0 | 0 | 0 | 109.5 | W70 | S47-W70 PolarHBondContact O-NE1 3.48Å |
| 48 | V | 32.9 | Very low | 32.5 | Very low | 16 Ų | 16 | 77.5 Ų | 77.5 | 10% | 0.097 | 47% | 0.468 | C | S | . | . | trans | -115.8 | 123.2 | -179.3 | -175.2 | 0 | 0 | 0 | 0 | 109.3 | E29 L31 Y53 W70 | E29-V48 PolarHBondContact O-N 3.39Å; L31-V48 HydrophobicContact CB-CG2 3.36Å; L31-V48 HydrophobicContact CD1-CG2 4.46Å; L31-V48 HydrophobicContact CG-CG2 4.48Å; V48-Y53 HydrophobicContact CB-CE2 4.44Å; V48-Y53 HydrophobicContact CG1-CD2 3.98Å; V48-Y53 HydrophobicContact CG1-CE1 4.23Å; V48-Y53 HydrophobicContact CG1-CE2 3.11Å; V48-Y53 WeakPolarHBondContact CG1-OH 3.14Å; V48-W70 HydrophobicContact CG2-CH2 4Å; V48-W70 HydrophobicContact CG2-CZ2 3.68Å | ||
| 49 | S | 32.1 | Very low | 33.1 | Very low | 67 Ų | 67 | 71.3 Ų | 71.3 | 47% | 0.469 | 44% | 0.44 | S | S | . | . | trans | -72.9 | 140.2 | 170.5 | 58.2 | 0 | 0 | 0 | 0 | 110.7 | F51 Y53 | S49-F51 PolarHBondContact O-N 3.26Å; S49-Y53 PolarHBondContact O-OH 3.31Å; S49-Y53 VanDerWaalsContact O-OH 3.08Å | ||
| 50 | E | 31.1 | Very low | 33.3 | Very low | 146 Ų | 146 | 67.5 Ų | 67.5 | 68% | 0.682 | 42% | 0.416 | S | S | * | . | S | Bend | trans | -35 | 97.2 | 175.5 | -67.8 | -176.6 | 153.3 | 0 | 0 | 113.8 | E29 | E29-E50 WeakPolarHBondContact OE1-CG 3.11Š|
| 51 | F | 31.3 | Very low | 33.8 | Very low | 94 Ų | 94 | 65 Ų | 65 | 41% | 0.412 | 40% | 0.397 | S | S | . | . | trans | -137.8 | 155.9 | 156.6 | -72.5 | -84.9 | 0 | 0 | 0 | 107.5 | S49 Y53 | S49-F51 PolarHBondContact O-N 3.26Å; F51-Y53 HydrophobicContact CB-CE1 4.16Å; F51-Y53 HydrophobicContact CB-CE2 3.93Å; F51-Y53 WeakPolarHBondContact CB-OH 3.04Å; F51-Y53 WeakPolarHBondContact O-CD2 2.74Å; F51-Y53 WeakPolarHBondContact O-CE2 3.3Å; F51-Y53 PolarHBondContact O-N 2.93Å; F51-Y53 VanDerWaalsContact O-N 3.11Å | ||
| 52 | A | 28.4 | Very low | 33.9 | Very low | 90 Ų | 90 | 60.6 Ų | 60.6 | 74% | 0.744 | 37% | 0.365 | S | S | * | . | trans | -66.8 | 111.9 | -176.7 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 53 | Y | 35.5 | Very low | 33.7 | Very low | 63 Ų | 63 | 60.3 Ų | 60.3 | 25% | 0.247 | 36% | 0.363 | C | S | . | . | trans | -121.7 | 118.5 | -177.4 | -54.1 | -75 | 0 | 0 | 0 | 112.5 | R22 V48 S49 F51 L73 | R22-Y53 PolarHBondContact NH1-O 3.04Å; V48-Y53 HydrophobicContact CB-CE2 4.44Å; V48-Y53 HydrophobicContact CG1-CD2 3.98Å; V48-Y53 HydrophobicContact CG1-CE1 4.23Å; V48-Y53 HydrophobicContact CG1-CE2 3.11Å; V48-Y53 WeakPolarHBondContact CG1-OH 3.14Å; S49-Y53 PolarHBondContact O-OH 3.31Å; S49-Y53 VanDerWaalsContact O-OH 3.08Å; F51-Y53 HydrophobicContact CB-CE1 4.16Å; F51-Y53 HydrophobicContact CB-CE2 3.93Å; F51-Y53 WeakPolarHBondContact CB-OH 3.04Å; F51-Y53 WeakPolarHBondContact O-CD2 2.74Å; F51-Y53 WeakPolarHBondContact O-CE2 3.3Å; F51-Y53 PolarHBondContact O-N 2.93Å; F51-Y53 VanDerWaalsContact O-N 3.11Å; Y53-L73 HydrophobicContact CE1-CD1 3.82Å; Y53-L73 HydrophobicContact CE1-CD2 4.39Å | ||
| 54 | G | 31.3 | Very low | 33.7 | Very low | 33 Ų | 33 | 60.9 Ų | 60.9 | 34% | 0.34 | 35% | 0.354 | S | S | . | . | trans | -90 | 167 | 165.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | R22 N57 | R22-G54 PolarHBondContact NH1-O 3.35Å; G54-N57 PolarHBondContact N-ND2 3.16Å; G54-N57 PolarHBondContact O-ND2 3.36Å | ||
| 55 | P | 33.2 | Very low | 33.2 | Very low | 86 Ų | 86 | 65 Ų | 65 | 56% | 0.558 | 38% | 0.384 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.1 | 148.1 | 166.3 | 18.3 | -26.9 | 0 | 0 | 0 | 111.7 | E24 N57 | E24-P55 HydrophobicContact CG-CB 4.2Å; E24-P55 WeakPolarHBondContact OE1-CB 3.4Å; E24-P55 VanDerWaalsContact OE1-CD 3.24Å; E24-P55 WeakPolarHBondContact OE1-CD 3.42Å; E24-P55 WeakPolarHBondContact OE1-CG 3.04Å; P55-N57 VanDerWaalsContact C-N 3.34Å; P55-N57 PolarHBondContact O-N 3.25Å |
| 56 | G | 32.4 | Very low | 32.8 | Very low | 64 Ų | 64 | 67.7 Ų | 67.7 | 66% | 0.66 | 40% | 0.398 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 84.6 | -0 | 177.8 | 0 | 0 | 0 | 0 | 0 | 115.8 | R58 | G56-R58 PolarHBondContact O-N 3.18Š|
| 57 | N | 39.9 | Very low | 32.6 | Very low | 59 Ų | 59 | 71.3 Ų | 71.3 | 32% | 0.316 | 41% | 0.412 | S | S | . | . | trans | -68.1 | 129.7 | 174.1 | -76.5 | -18 | 0 | 0 | 0 | 111.5 | G54 P55 | G54-N57 PolarHBondContact N-ND2 3.16Å; G54-N57 PolarHBondContact O-ND2 3.36Å; P55-N57 VanDerWaalsContact C-N 3.34Å; P55-N57 PolarHBondContact O-N 3.25Å | ||
| 58 | R | 34.3 | Very low | 32.4 | Very low | 120 Ų | 120 | 75 Ų | 75 | 45% | 0.453 | 42% | 0.417 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -86.9 | 140 | 177.8 | -61.6 | -175.2 | -170.2 | -179.3 | 6 | 110.1 | C2 G56 | C2-R58 PolarHBondContact O-NH1 2.61Å; G56-R58 PolarHBondContact O-N 3.18Å |
| 59 | V | 39.3 | Very low | 32.4 | Very low | 10 Ų | 10 | 80.6 Ų | 80.6 | 6% | 0.061 | 44% | 0.436 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -123.5 | 146 | -177.4 | -76.2 | 0 | 0 | 0 | 0 | 110.4 | G20 L31 F61 W70 | G20-V59 PolarHBondContact N-O 3.39Å; L31-V59 HydrophobicContact CD1-CG1 4.1Å; L31-V59 HydrophobicContact CD2-CG1 4.35Å; L31-V59 HydrophobicContact CD2-CG2 4Å; V59-F61 HydrophobicContact CB-CE2 4.02Å; V59-F61 HydrophobicContact CB-CZ 3.96Å; V59-F61 HydrophobicContact CG2-CE2 3.6Å; V59-F61 HydrophobicContact CG2-CZ 3.71Å; V59-W70 HydrophobicContact CB-CH2 4.41Å; V59-W70 HydrophobicContact CB-CZ3 3.75Å; V59-W70 HydrophobicContact CG1-CH2 4.1Å; V59-W70 HydrophobicContact CG1-CZ3 3.57Å |
| 60 | A | 34.8 | Very low | 32.4 | Very low | 15 Ų | 15 | 82 Ų | 82 | 12% | 0.124 | 43% | 0.431 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.1 | 126.3 | -174.7 | 0 | 0 | 0 | 0 | 0 | 109.5 | V17 I71 | V17-A60 HydrophobicContact CG1-CB 3.19Å; A60-I71 WeakPolarHBondContact CB-O 3.29Å; A60-I71 PolarHBondContact O-N 3.33Å |
| 61 | F | 39.2 | Very low | 32.2 | Very low | 13 Ų | 13 | 76.5 Ų | 76.5 | 6% | 0.057 | 41% | 0.406 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.6 | 130.9 | 178.4 | -60 | -80.3 | 0 | 0 | 0 | 111.1 | V17 I18 V33 V59 W70 | V17-F61 VanDerWaalsContact CA-O 3.3Å; V17-F61 WeakPolarHBondContact CA-O 3.11Å; I18-F61 PolarHBondContact N-O 3.42Å; I18-F61 PolarHBondContact O-N 3.11Å; V33-F61 HydrophobicContact CB-CE2 4.21Å; V33-F61 HydrophobicContact CB-CZ 4.03Å; V33-F61 HydrophobicContact CG1-CD2 4.23Å; V33-F61 HydrophobicContact CG1-CE2 3.43Å; V33-F61 VanDerWaalsContact CG1-CE2 3.43Å; V33-F61 HydrophobicContact CG1-CZ 3.77Å; V33-F61 HydrophobicContact CG2-CE1 3.83Å; V33-F61 HydrophobicContact CG2-CE2 3.77Å; V33-F61 HydrophobicContact CG2-CZ 3.14Å; V59-F61 HydrophobicContact CB-CE2 4.02Å; V59-F61 HydrophobicContact CB-CZ 3.96Å; V59-F61 HydrophobicContact CG2-CE2 3.6Å; V59-F61 HydrophobicContact CG2-CZ 3.71Å; F61-W70 HydrophobicContact CE1-CD2 4.16Å; F61-W70 AromaticContact CE1-CE3 3.95Å; F61-W70 HydrophobicContact CE1-CE3 3.95Å; F61-W70 HydrophobicContact CE1-CH2 4.02Å; F61-W70 HydrophobicContact CE1-CZ2 4.2Å; F61-W70 AromaticContact CE1-CZ3 3.89Å; F61-W70 HydrophobicContact CE1-CZ3 3.89Å; F61-W70 HydrophobicContact CZ-CE3 4.33Å; F61-W70 AromaticContact CZ-CH2 3.99Å; F61-W70 HydrophobicContact CZ-CH2 3.99Å; F61-W70 AromaticContact CZ-CZ3 3.86Å; F61-W70 HydrophobicContact CZ-CZ3 3.86Å |
| 62 | E | 32.2 | Very low | 32.2 | Very low | 11 Ų | 11 | 77.7 Ų | 77.7 | 5% | 0.051 | 41% | 0.408 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.6 | 120.2 | 166.3 | -171 | -168.8 | -170.6 | 0 | 0 | 109.1 | L15 Q64 R69 I71 | L15-E62 HydrophobicContact CD1-CG 4.11Å; L15-E62 WeakPolarHBondContact CD1-OE1 3.3Å; E62-Q64 HydrophobicContact CG-CG 4.05Å; E62-Q64 PolarHBondContact O-N 3.27Å; E62-Q64 PolarHBondContact OE1-NE2 2.77Å; E62-R69 HydrophobicContact CB-CB 4.46Å; E62-R69 PolarHBondContact N-O 3.27Å; E62-R69 VanDerWaalsContact N-O 3.08Å; E62-R69 PolarHBondContact O-N 2.74Å; E62-I71 HydrophobicContact CB-CB 4.21Å; E62-I71 HydrophobicContact CB-CD1 3.58Å; E62-I71 HydrophobicContact CB-CG1 3.63Å; E62-I71 HydrophobicContact CG-CD1 3.71Å; E62-I71 HydrophobicContact CG-CG1 4.33Å; E62-I71 WeakPolarHBondContact OE2-CD1 3.16Å |
| 63 | L | 29.5 | Very low | 32.2 | Very low | 88 Ų | 88 | 77.3 Ų | 77.3 | 46% | 0.461 | 39% | 0.393 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -83.3 | 101 | 169.2 | -83.1 | 162.3 | 0 | 0 | 0 | 108.8 | I18 Y68 | I18-L63 HydrophobicContact CD1-CD1 3.37Å; I18-L63 HydrophobicContact CD1-CG 4.1Å; I18-L63 HydrophobicContact CG1-CD1 3.94Å; L63-Y68 HydrophobicContact CD2-CD1 4.47Å; L63-Y68 HydrophobicContact CD2-CE1 3.84Å |
| 64 | Q | 30.9 | Very low | 31.8 | Very low | 79 Ų | 79 | 80.5 Ų | 80.5 | 37% | 0.369 | 41% | 0.413 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100 | 150.5 | 161.1 | -64.7 | -162.5 | -9.2 | 0 | 0 | 109.7 | E62 L66 H67 | E62-Q64 HydrophobicContact CG-CG 4.05Å; E62-Q64 PolarHBondContact O-N 3.27Å; E62-Q64 PolarHBondContact OE1-NE2 2.77Å; Q64-L66 PolarHBondContact O-N 3.25Å; Q64-H67 PolarHBondContact N-O 3.37Å; Q64-H67 PolarHBondContact O-N 3.38Å |
| 65 | P | 26.4 | Very low | 31.5 | Very low | 133 Ų | 133 | 84.3 Ų | 84.3 | 86% | 0.864 | 43% | 0.432 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.5 | -12.1 | -171.2 | -25.8 | 32.9 | 0 | 0 | 0 | 116.5 | ||
| 66 | L | 25.5 | Very low | 31.1 | Very low | 151 Ų | 151 | 89 Ų | 89 | 79% | 0.791 | 45% | 0.449 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -143.3 | 3.3 | -176.8 | -74.2 | 165 | 0 | 0 | 0 | 113.9 | Q64 | Q64-L66 PolarHBondContact O-N 3.25Š|
| 67 | H | 30.8 | Very low | 30.7 | Very low | 93 Ų | 93 | 92 Ų | 92 | 43% | 0.431 | 45% | 0.448 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -149.8 | 127.1 | -174 | -57.7 | 100.2 | 0 | 0 | 0 | 110.9 | Q64 R69 | Q64-H67 PolarHBondContact N-O 3.37Å; Q64-H67 PolarHBondContact O-N 3.38Å; H67-R69 PolarHBondContact O-N 2.86Å |
| 68 | Y | 29.5 | Very low | 29.8 | Very low | 144 Ų | 144 | 94.2 Ų | 94.2 | 57% | 0.565 | 48% | 0.475 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -80.4 | 113.3 | 160.3 | -65.5 | -78.6 | 0 | 0 | 0 | 107.4 | L44 L63 | L44-Y68 HydrophobicContact CD1-CD1 4.08Å; L44-Y68 HydrophobicContact CD1-CE1 3.73Å; L44-Y68 HydrophobicContact CD1-CE2 4.23Å; L44-Y68 HydrophobicContact CD1-CG 4.48Å; L44-Y68 HydrophobicContact CD2-CD2 3.98Å; L44-Y68 HydrophobicContact CD2-CE2 3.69Å; L63-Y68 HydrophobicContact CD2-CD1 4.47Å; L63-Y68 HydrophobicContact CD2-CE1 3.84Å |
| 69 | R | 32.1 | Very low | 29.5 | Very low | 133 Ų | 133 | 92 Ų | 92 | 50% | 0.502 | 48% | 0.478 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110 | 132.5 | 174.4 | -165.8 | 179 | -174.3 | -178.1 | 3.2 | 108.8 | E62 H67 I71 | E62-R69 HydrophobicContact CB-CB 4.46Å; E62-R69 PolarHBondContact N-O 3.27Å; E62-R69 VanDerWaalsContact N-O 3.08Å; E62-R69 PolarHBondContact O-N 2.74Å; H67-R69 PolarHBondContact O-N 2.86Å; R69-I71 PolarHBondContact O-N 3.09Å |
| 70 | W | 31.8 | Very low | 28.7 | Very low | 96 Ų | 96 | 101.7 Ų | 101.7 | 36% | 0.364 | 52% | 0.519 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -64.8 | 119.8 | 169.3 | -76.4 | 102.1 | 0 | 0 | 0 | 109.8 | L31 A46 S47 V48 V59 F61 | L31-W70 HydrophobicContact CB-CH2 4.18Å; L31-W70 HydrophobicContact CB-CZ2 4.39Å; L31-W70 HydrophobicContact CD1-CH2 4.26Å; L31-W70 HydrophobicContact CD2-CH2 3.55Å; L31-W70 HydrophobicContact CD2-CZ2 4.3Å; L31-W70 HydrophobicContact CD2-CZ3 4.48Å; L31-W70 HydrophobicContact CG-CH2 4.18Å; A46-W70 HydrophobicContact CB-CH2 4.42Å; A46-W70 HydrophobicContact CB-CZ2 3.31Å; S47-W70 PolarHBondContact O-NE1 3.48Å; V48-W70 HydrophobicContact CG2-CH2 4Å; V48-W70 HydrophobicContact CG2-CZ2 3.68Å; V59-W70 HydrophobicContact CB-CH2 4.41Å; V59-W70 HydrophobicContact CB-CZ3 3.75Å; V59-W70 HydrophobicContact CG1-CH2 4.1Å; V59-W70 HydrophobicContact CG1-CZ3 3.57Å; F61-W70 HydrophobicContact CE1-CD2 4.16Å; F61-W70 AromaticContact CE1-CE3 3.95Å; F61-W70 HydrophobicContact CE1-CE3 3.95Å; F61-W70 HydrophobicContact CE1-CH2 4.02Å; F61-W70 HydrophobicContact CE1-CZ2 4.2Å; F61-W70 AromaticContact CE1-CZ3 3.89Å; F61-W70 HydrophobicContact CE1-CZ3 3.89Å; F61-W70 HydrophobicContact CZ-CE3 4.33Å; F61-W70 AromaticContact CZ-CH2 3.99Å; F61-W70 HydrophobicContact CZ-CH2 3.99Å; F61-W70 AromaticContact CZ-CZ3 3.86Å; F61-W70 HydrophobicContact CZ-CZ3 3.86Å |
| 71 | I | 28.8 | Very low | 28.3 | Very low | 31 Ų | 31 | 110.5 Ų | 110.5 | 16% | 0.159 | 55% | 0.55 | C | S | . | . | trans | -122.1 | 103.6 | 169.9 | -69.7 | -160.2 | 0 | 0 | 0 | 108.9 | A60 E62 R69 | A60-I71 WeakPolarHBondContact CB-O 3.29Å; A60-I71 PolarHBondContact O-N 3.33Å; E62-I71 HydrophobicContact CB-CB 4.21Å; E62-I71 HydrophobicContact CB-CD1 3.58Å; E62-I71 HydrophobicContact CB-CG1 3.63Å; E62-I71 HydrophobicContact CG-CD1 3.71Å; E62-I71 HydrophobicContact CG-CG1 4.33Å; E62-I71 WeakPolarHBondContact OE2-CD1 3.16Å; R69-I71 PolarHBondContact O-N 3.09Å | ||
| 72 | R | 30.3 | Very low | 27.7 | Very low | 119 Ų | 119 | 118.9 Ų | 118.9 | 45% | 0.449 | 59% | 0.589 | S | S | . | * | trans | 61.6 | 126.9 | 155.1 | -102.7 | -176.5 | 169.2 | 152.3 | -2.6 | 119.6 | ||||
| 73 | L | 27.5 | Very low | 27.3 | Very low | 83 Ų | 83 | 122.6 Ų | 122.6 | 44% | 0.435 | 62% | 0.621 | S | S | . | * | P | Polyproline II helix | trans | -72.5 | 128.1 | 152.6 | -73.5 | 126.8 | 0 | 0 | 0 | 110.1 | Y53 | Y53-L73 HydrophobicContact CE1-CD1 3.82Å; Y53-L73 HydrophobicContact CE1-CD2 4.39Å |
| 74 | L | 27.1 | Very low | 27.3 | Very low | 129 Ų | 129 | 122 Ų | 122 | 68% | 0.675 | 63% | 0.625 | S | S | * | * | S | Bend | trans | -67.7 | 144.9 | 162.6 | -70.1 | 161.5 | 0 | 0 | 0 | 108.6 | ||
| 75 | P | 26 | Very low | 27.2 | Very low | 113 Ų | 113 | 126 Ų | 126 | 73% | 0.734 | 64% | 0.643 | S | S | * | * | S | Bend | -92.8 | 140.9 | -117.6 | 33.2 | -34.9 | 0 | 0 | 0 | 114.9 | |||
| 76 | M | 23.7 | Very low | 27.2 | Very low | 184 Ų | 184 | 124 Ų | 124 | 91% | 0.906 | 63% | 0.631 | S | S | * | * | S | Bend | trans | -156.4 | -2.5 | 149.1 | -90.4 | -147.6 | 74.6 | 0 | 0 | 116.7 | ||
| 77 | I | 24.6 | Very low | 27.3 | Very low | 127 Ų | 127 | 122.1 Ų | 122.1 | 65% | 0.651 | 63% | 0.626 | S | S | * | * | trans | -140 | 127.6 | -176.3 | -51.3 | 177.7 | 0 | 0 | 0 | 110.4 | ||||
| 78 | A | 21.8 | Very low | 27.1 | Very low | 106 Ų | 106 | 124.2 Ų | 124.2 | 88% | 0.876 | 64% | 0.636 | S | S | * | * | trans | -71.7 | 124.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 79 | S | 26.7 | Very low | 27 | Very low | 73 Ų | 73 | 124 Ų | 124 | 51% | 0.51 | 64% | 0.644 | S | S | . | * | trans | -138.3 | 141.2 | 170.4 | 45.9 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 80 | K | 24 | Very low | 26.6 | Very low | 215 Ų | 215 | 125.2 Ų | 125.2 | 94% | 0.935 | 66% | 0.656 | S | S | * | * | trans | -77.7 | 143.7 | -173.7 | -131.6 | 176.4 | 179.5 | -176 | 0 | 109.7 | ||||
| 81 | W | 26.7 | Very low | 26.2 | Very low | 200 Ų | 200 | 131.7 Ų | 131.7 | 76% | 0.758 | 68% | 0.682 | S | S | * | * | trans | -87.3 | 130.7 | 177.2 | -69.7 | 80.6 | 0 | 0 | 0 | 110.8 | ||||
| 82 | E | 25.1 | Very low | 25.9 | Very low | 189 Ų | 189 | 136.6 Ų | 136.6 | 88% | 0.883 | 71% | 0.707 | S | S | * | * | trans | -115.5 | 128.9 | 157.7 | -72.4 | -173.5 | 171.8 | 0 | 0 | 108.4 | ||||
| 83 | A | 25.6 | Very low | 25.5 | Very low | 88 Ų | 88 | 134.7 Ų | 134.7 | 73% | 0.727 | 72% | 0.724 | S | S | * | * | trans | -79.9 | 122.1 | -179.8 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 84 | S | 28.4 | Very low | 25.3 | Very low | 77 Ų | 77 | 133.9 Ų | 133.9 | 54% | 0.538 | 74% | 0.736 | S | S | . | * | trans | -106.2 | 126.7 | 162.5 | 71 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 85 | H | 28.6 | Very low | 25.1 | Very low | 162 Ų | 162 | 134.3 Ų | 134.3 | 75% | 0.75 | 74% | 0.744 | S | S | * | * | trans | -103.3 | 110.2 | 174.3 | -65.7 | -76.8 | 0 | 0 | 0 | 107.8 | V87 | H85-V87 HydrophobicContact CB-CG2 4.31Å; H85-V87 PolarHBondContact O-N 2.93Å | ||
| 86 | C | 27.6 | Very low | 25 | Very low | 90 Ų | 90 | 137.6 Ų | 137.6 | 61% | 0.608 | 75% | 0.749 | S | S | * | * | trans | -86.5 | 101.8 | 164.4 | -72.9 | 0 | 0 | 0 | 0 | 107.8 | ||||
| 87 | V | 26.8 | Very low | 25 | Very low | 113 Ų | 113 | 138.5 Ų | 138.5 | 69% | 0.685 | 75% | 0.752 | S | S | * | * | trans | -93.1 | 142.8 | 171.8 | -166 | 0 | 0 | 0 | 0 | 107.6 | H85 | H85-V87 HydrophobicContact CB-CG2 4.31Å; H85-V87 PolarHBondContact O-N 2.93Å | ||
| 88 | Q | 27.4 | Very low | 25.1 | Very low | 136 Ų | 136 | 137.3 Ų | 137.3 | 64% | 0.636 | 75% | 0.752 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -49 | 140.8 | -178.2 | -69.9 | 172 | -23.2 | 0 | 0 | 112.9 | ||
| 89 | N | 26 | Very low | 25.1 | Very low | 140 Ų | 140 | 136.5 Ų | 136.5 | 75% | 0.749 | 75% | 0.745 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 83.1 | 18.7 | 162.3 | -55.7 | -29.1 | 0 | 0 | 0 | 120.8 | Y91 | N89-Y91 PolarHBondContact O-N 2.97Š|
| 90 | E | 24.5 | Very low | 25 | Very low | 158 Ų | 158 | 143.6 Ų | 143.6 | 74% | 0.738 | 76% | 0.762 | S | S | * | * | trans | -95.5 | 104.8 | 176.8 | -71.7 | -173.7 | 166 | 0 | 0 | 113.7 | ||||
| 91 | Y | 22.9 | Very low | 25 | Very low | 232 Ų | 232 | 136.2 Ų | 136.2 | 91% | 0.91 | 75% | 0.748 | S | S | * | * | trans | -75.9 | 118.2 | 155.1 | -80 | -99.2 | 0 | 0 | 0 | 108.1 | N89 | N89-Y91 PolarHBondContact O-N 2.97Š| ||
| 92 | I | 23.7 | Very low | 24.9 | Very low | 135 Ų | 135 | 132.4 Ų | 132.4 | 69% | 0.692 | 74% | 0.741 | S | S | * | * | trans | -125.4 | 94.6 | 164.3 | -55.5 | 179.8 | 0 | 0 | 0 | 107.8 | ||||
| 93 | G | 21 | Very low | 24.9 | Very low | 79 Ų | 79 | 130.8 Ų | 130.8 | 81% | 0.814 | 73% | 0.732 | S | S | * | * | trans | -72.3 | 144.1 | 158 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 94 | G | 22.6 | Very low | 25 | Very low | 65 Ų | 65 | 132.7 Ų | 132.7 | 67% | 0.67 | 73% | 0.729 | S | S | * | * | trans | 158.6 | 98.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 95 | T | 23.2 | Very low | 25 | Very low | 138 Ų | 138 | 137.3 Ų | 137.3 | 85% | 0.847 | 74% | 0.741 | S | S | * | * | trans | -73.6 | 122.4 | 162.5 | 45.6 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 96 | E | 24.2 | Very low | 25 | Very low | 183 Ų | 183 | 132.9 Ų | 132.9 | 86% | 0.855 | 73% | 0.728 | S | S | * | * | trans | -168.4 | 129.1 | 151.1 | -107.7 | 169.6 | -153 | 0 | 0 | 106 | P98 | E96-P98 WeakPolarHBondContact O-CD 3.36Š| ||
| 97 | E | 24 | Very low | 24.9 | Very low | 203 Ų | 203 | 135.5 Ų | 135.5 | 95% | 0.949 | 74% | 0.735 | S | S | * | * | trans | -50.4 | 131.9 | -178.9 | -65.7 | 175.6 | 139.5 | 0 | 0 | 111.7 | ||||
| 98 | P | 26 | Very low | 24.9 | Very low | 102 Ų | 102 | 134.7 Ų | 134.7 | 66% | 0.662 | 73% | 0.73 | S | S | * | * | trans | -127.7 | 124.9 | 148.8 | 18.9 | 3.4 | 0 | 0 | 0 | 109.3 | E96 Y100 | E96-P98 WeakPolarHBondContact O-CD 3.36Å; P98-Y100 PolarHBondContact O-N 3.47Å; P98-Y100 VanDerWaalsContact O-N 3.12Å | ||
| 99 | A | 23.1 | Very low | 24.7 | Very low | 89 Ų | 89 | 133.2 Ų | 133.2 | 74% | 0.736 | 74% | 0.741 | S | S | * | * | S | Bend | trans | -42.3 | 118.4 | 165.5 | 0 | 0 | 0 | 0 | 0 | 110.3 | ||
| 100 | Y | 23.5 | Very low | 24.6 | Very low | 221 Ų | 221 | 131.2 Ų | 131.2 | 87% | 0.867 | 73% | 0.727 | S | S | * | * | S | Bend | trans | 55.2 | 79.9 | 167.2 | -53.9 | -85.3 | 0 | 0 | 0 | 115.7 | P98 | P98-Y100 PolarHBondContact O-N 3.47Å; P98-Y100 VanDerWaalsContact O-N 3.12Å |
| 101 | G | 23.3 | Very low | 24.6 | Very low | 61 Ų | 61 | 132.1 Ų | 132.1 | 63% | 0.629 | 73% | 0.729 | S | S | * | * | trans | -161.5 | 105.7 | 169 | 0 | 0 | 0 | 0 | 0 | 113.1 | ||||
| 102 | L | 25.4 | Very low | 24.6 | Very low | 119 Ų | 119 | 126.9 Ų | 126.9 | 62% | 0.623 | 72% | 0.723 | S | S | * | * | P | Polyproline II helix | trans | -71.9 | 123.2 | 175.5 | -89.3 | 152.1 | 0 | 0 | 0 | 111.1 | ||
| 103 | K | 25.6 | Very low | 24.6 | Very low | 156 Ų | 156 | 123.9 Ų | 123.9 | 68% | 0.678 | 73% | 0.725 | S | S | * | * | P | Polyproline II helix | trans | -90.5 | 130 | 167.4 | -77.5 | -177.5 | 179.2 | 175.1 | 0 | 110.3 | ||
| 104 | L | 27.2 | Very low | 24.7 | Very low | 128 Ų | 128 | 129.6 Ų | 129.6 | 67% | 0.67 | 73% | 0.728 | S | S | * | * | P | Polyproline II helix | trans | -79.8 | 129.4 | 170.4 | -87.8 | 137.4 | 0 | 0 | 0 | 110.3 | ||
| 105 | H | 28.3 | Very low | 24.8 | Very low | 173 Ų | 173 | 134.5 Ų | 134.5 | 80% | 0.801 | 73% | 0.734 | S | S | * | * | P | Polyproline II helix | trans | -103.3 | 122.7 | 172.1 | -68.9 | -87.9 | 0 | 0 | 0 | 110.5 | ||
| 106 | C | 28 | Very low | 24.8 | Very low | 69 Ų | 69 | 133 Ų | 133 | 47% | 0.466 | 73% | 0.726 | S | S | . | * | trans | -96.8 | 114.5 | 169 | -71.5 | 0 | 0 | 0 | 0 | 109.9 | V108 | C106-V108 PolarHBondContact O-N 3.45Š| ||
| 107 | L | 26.1 | Very low | 24.7 | Very low | 146 Ų | 146 | 130.1 Ų | 130.1 | 76% | 0.764 | 73% | 0.725 | S | S | * | * | trans | -81.1 | 109.6 | 167.8 | -87.7 | 154.9 | 0 | 0 | 0 | 109 | ||||
| 108 | V | 25.9 | Very low | 24.7 | Very low | 96 Ų | 96 | 125.9 Ų | 125.9 | 58% | 0.582 | 72% | 0.715 | S | S | * | * | trans | -101.7 | 116.7 | 175.5 | -178.9 | 0 | 0 | 0 | 0 | 109.2 | C106 Q110 | C106-V108 PolarHBondContact O-N 3.45Å; V108-Q110 HydrophobicContact CG1-CG 4.02Å | ||
| 109 | A | 24.6 | Very low | 24.6 | Very low | 104 Ų | 104 | 131 Ų | 131 | 86% | 0.86 | 73% | 0.726 | S | S | * | * | trans | -91.9 | 111.5 | 161.9 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 110 | Q | 23.7 | Very low | 24.7 | Very low | 99 Ų | 99 | 133.2 Ų | 133.2 | 46% | 0.463 | 73% | 0.725 | S | S | . | * | trans | -113.8 | 145.2 | 163.5 | -85.4 | -168 | 12.4 | 0 | 0 | 106.8 | V108 | V108-Q110 HydrophobicContact CG1-CG 4.02Š| ||
| 111 | K | 24.1 | Very low | 24.7 | Very low | 176 Ų | 176 | 126.2 Ų | 126.2 | 77% | 0.765 | 71% | 0.708 | S | S | * | * | cis | -179.8 | -169.2 | 40.7 | -129 | 174.5 | -173.1 | 176.6 | 0 | 106 | ||||
| 112 | P | 23.7 | Very low | 24.8 | Very low | 122 Ų | 122 | 127.5 Ų | 127.5 | 79% | 0.792 | 71% | 0.708 | S | S | * | * | -118 | 148.9 | -66.7 | 29 | -9.3 | 0 | 0 | 0 | 112.8 | |||||
| 113 | G | 23.3 | Very low | 24.8 | Very low | 72 Ų | 72 | 127 Ų | 127 | 74% | 0.742 | 70% | 0.7 | S | S | * | * | trans | 130.6 | 88.3 | 163.7 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 114 | F | 23.2 | Very low | 24.8 | Very low | 199 Ų | 199 | 124.2 Ų | 124.2 | 87% | 0.873 | 69% | 0.692 | S | S | * | * | trans | 46.8 | 100.6 | 149.6 | -94.1 | -97.9 | 0 | 0 | 0 | 121.1 | ||||
| 115 | H | 23.8 | Very low | 24.8 | Very low | 169 Ų | 169 | 123 Ų | 123 | 78% | 0.782 | 68% | 0.682 | S | S | * | * | trans | 34.3 | 152.2 | 131.4 | -71.3 | -53 | 0 | 0 | 0 | 124 | ||||
| 116 | P | 23.5 | Very low | 24.8 | Very low | 105 Ų | 105 | 117.5 Ų | 117.5 | 68% | 0.682 | 66% | 0.658 | S | S | * | * | S | Bend | cis | -139.5 | 103.1 | -27.9 | 34.5 | -13.3 | 0 | 0 | 0 | 112.1 | ||
| 117 | C | 22.1 | Very low | 24.7 | Very low | 123 Ų | 123 | 118 Ų | 118 | 83% | 0.831 | 67% | 0.667 | S | S | * | * | trans | -169.1 | 97 | 156.1 | -108.7 | 0 | 0 | 0 | 0 | 106.9 | K119 | C117-K119 PolarHBondContact O-N 3.37Š| ||
| 118 | P | 24.9 | Very low | 24.8 | Very low | 114 Ų | 114 | 113.3 Ų | 113.3 | 74% | 0.74 | 64% | 0.643 | S | S | * | * | trans | -69.8 | 108 | 174.1 | 27.9 | -27.7 | 0 | 0 | 0 | 107.2 | I120 | P118-I120 HydrophobicContact CB-CG1 4.44Å; P118-I120 PolarHBondContact O-N 2.76Å | ||
| 119 | K | 23.2 | Very low | 24.9 | Very low | 209 Ų | 209 | 114.5 Ų | 114.5 | 91% | 0.909 | 65% | 0.652 | S | S | * | * | trans | -57.5 | 99.2 | 152 | -84.8 | -177.7 | 174 | 180 | 0 | 105.8 | C117 S121 | C117-K119 PolarHBondContact O-N 3.37Å; K119-S121 PolarHBondContact O-N 2.88Å; K119-S121 VanDerWaalsContact O-N 3.09Å | ||
| 120 | I | 24.9 | Very low | 24.9 | Very low | 137 Ų | 137 | 118.9 Ų | 118.9 | 70% | 0.703 | 65% | 0.646 | S | S | * | * | trans | -72.4 | 101.9 | 172.6 | -60.8 | 173.5 | 0 | 0 | 0 | 105.6 | P118 S122 | P118-I120 HydrophobicContact CB-CG1 4.44Å; P118-I120 PolarHBondContact O-N 2.76Å; I120-S122 PolarHBondContact O-N 3.41Å | ||
| 121 | S | 23.9 | Very low | 25.1 | Very low | 74 Ų | 74 | 117.5 Ų | 117.5 | 52% | 0.517 | 64% | 0.639 | S | S | . | * | trans | -78.9 | 110.6 | 158.5 | 75.7 | 0 | 0 | 0 | 0 | 106.5 | K119 K123 | K119-S121 PolarHBondContact O-N 2.88Å; K119-S121 VanDerWaalsContact O-N 3.09Å; S121-K123 PolarHBondContact O-N 3Å | ||
| 122 | S | 25.5 | Very low | 25.1 | Very low | 88 Ų | 88 | 114.5 Ų | 114.5 | 62% | 0.615 | 64% | 0.64 | S | S | * | * | trans | -67.2 | 96.8 | 179.6 | -27.5 | 0 | 0 | 0 | 0 | 109.3 | I120 | I120-S122 PolarHBondContact O-N 3.41Š| ||
| 123 | K | 25.5 | Very low | 25 | Very low | 109 Ų | 109 | 116.3 Ų | 116.3 | 47% | 0.474 | 64% | 0.636 | S | S | . | * | trans | -94.5 | 111.2 | 165.3 | -72.4 | -172.6 | 177.8 | -175 | 0 | 107.6 | S121 F125 | S121-K123 PolarHBondContact O-N 3Å; K123-F125 HydrophobicContact CB-CD2 4.28Å; K123-F125 HydrophobicContact CB-CE2 3.59Å; K123-F125 HydrophobicContact CB-CZ 3.93Å; K123-F125 HydrophobicContact CD-CZ 4.23Å; K123-F125 VanDerWaalsContact O-CD2 3.29Å; K123-F125 WeakPolarHBondContact O-CD2 3.14Å; K123-F125 PolarHBondContact O-N 2.97Å | ||
| 124 | L | 26.5 | Very low | 25.2 | Very low | 96 Ų | 96 | 117.5 Ų | 117.5 | 50% | 0.503 | 63% | 0.631 | S | S | . | * | trans | -75.8 | 117.7 | 170.4 | -174.4 | 72.6 | 0 | 0 | 0 | 107.9 | I126 I137 | L124-I126 HydrophobicContact CD2-CD1 4.01Å; L124-I126 HydrophobicContact CD2-CG1 4.13Å; L124-I126 HydrophobicContact CG-CG1 4.17Å; L124-I137 HydrophobicContact CD2-CD1 4.39Å | ||
| 125 | F | 27.2 | Very low | 25.3 | Very low | 103 Ų | 103 | 109.8 Ų | 109.8 | 45% | 0.452 | 60% | 0.598 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -101.3 | 113.6 | 172.9 | -66.4 | -87.9 | 0 | 0 | 0 | 108.5 | K123 | K123-F125 HydrophobicContact CB-CD2 4.28Å; K123-F125 HydrophobicContact CB-CE2 3.59Å; K123-F125 HydrophobicContact CB-CZ 3.93Å; K123-F125 HydrophobicContact CD-CZ 4.23Å; K123-F125 VanDerWaalsContact O-CD2 3.29Å; K123-F125 WeakPolarHBondContact O-CD2 3.14Å; K123-F125 PolarHBondContact O-N 2.97Å |
| 126 | I | 26.4 | Very low | 25.4 | Very low | 58 Ų | 58 | 107.8 Ų | 107.8 | 30% | 0.297 | 59% | 0.592 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -103.2 | 109.4 | 169.1 | -56.2 | 177.2 | 0 | 0 | 0 | 106.2 | L124 I137 V166 | L124-I126 HydrophobicContact CD2-CD1 4.01Å; L124-I126 HydrophobicContact CD2-CG1 4.13Å; L124-I126 HydrophobicContact CG-CG1 4.17Å; I126-I137 HydrophobicContact CD1-CD1 4.24Å; I126-V166 HydrophobicContact CD1-CG1 4.48Å |
| 127 | A | 27.2 | Very low | 25.6 | Very low | 80 Ų | 80 | 105.7 Ų | 105.7 | 66% | 0.661 | 57% | 0.574 | S | S | * | * | trans | -89.2 | 112.5 | 170.5 | 0 | 0 | 0 | 0 | 0 | 108.5 | P129 | A127-P129 WeakPolarHBondContact O-CD 3.5Š| ||
| 128 | D | 28.4 | Very low | 25.7 | Very low | 47 Ų | 47 | 102 Ų | 102 | 25% | 0.251 | 56% | 0.556 | S | S | . | * | trans | -84.8 | 113.9 | 167.2 | -178.5 | -6.2 | 0 | 0 | 0 | 108 | R130 K131 | D128-R130 PolarHBondContact O-N 2.93Å; D128-R130 WeakPolarHBondContact OD1-CB 2.92Å; D128-R130 PolarHBondContact OD1-N 2.99Å; D128-K131 HydrophobicContact CB-CB 4.22Å; D128-K131 HydrophobicContact CB-CD 4.35Å; D128-K131 HydrophobicContact CB-CG 4.28Å; D128-K131 PolarHBondContact O-N 3.18Å; D128-K131 VanDerWaalsContact O-O 3.12Å | ||
| 129 | P | 26.9 | Very low | 25.7 | Very low | 120 Ų | 120 | 101.1 Ų | 101.1 | 78% | 0.779 | 55% | 0.546 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.5 | -7.9 | 179.7 | 25.2 | -32.9 | 0 | 0 | 0 | 113.7 | A127 | A127-P129 WeakPolarHBondContact O-CD 3.5Š|
| 130 | R | 26.2 | Very low | 25.9 | Very low | 197 Ų | 197 | 98.1 Ų | 98.1 | 74% | 0.743 | 54% | 0.539 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -95 | -3.4 | 174.4 | -60.3 | -176.6 | -116.6 | -177.7 | 1.4 | 113.7 | D128 | D128-R130 PolarHBondContact O-N 2.93Å; D128-R130 WeakPolarHBondContact OD1-CB 2.92Å; D128-R130 PolarHBondContact OD1-N 2.99Å |
| 131 | K | 26.5 | Very low | 25.9 | Very low | 70 Ų | 70 | 99.9 Ų | 99.9 | 30% | 0.304 | 54% | 0.542 | S | S | . | . | trans | -124.4 | 121.5 | -179.3 | -63.5 | -177.7 | -176.8 | -179.6 | 0 | 109.6 | D128 F133 S170 | D128-K131 HydrophobicContact CB-CB 4.22Å; D128-K131 HydrophobicContact CB-CD 4.35Å; D128-K131 HydrophobicContact CB-CG 4.28Å; D128-K131 PolarHBondContact O-N 3.18Å; D128-K131 VanDerWaalsContact O-O 3.12Å; K131-F133 PolarHBondContact O-N 3.29Å; K131-S170 PolarHBondContact NZ-O 3.43Å | ||
| 132 | S | 23.6 | Very low | 25.9 | Very low | 113 Ų | 113 | 104.2 Ų | 104.2 | 79% | 0.79 | 56% | 0.559 | S | S | * | * | S | Bend | trans | -65.3 | 8.3 | -179.8 | -19.4 | 0 | 0 | 0 | 0 | 114.6 | ||
| 133 | F | 23.5 | Very low | 25.7 | Very low | 159 Ų | 159 | 108.6 Ų | 108.6 | 70% | 0.697 | 57% | 0.57 | S | S | * | * | S | Bend | trans | -132.2 | 131.7 | -169.6 | -61.1 | -79 | 0 | 0 | 0 | 110.9 | K131 I135 | K131-F133 PolarHBondContact O-N 3.29Å; F133-I135 PolarHBondContact O-N 3.39Å |
| 134 | P | 26.2 | Very low | 25.6 | Very low | 98 Ų | 98 | 109 Ų | 109 | 64% | 0.636 | 59% | 0.586 | S | S | * | * | trans | -65.1 | 125.6 | 169.8 | 26.7 | -31.4 | 0 | 0 | 0 | 109.8 | I136 | P134-I136 PolarHBondContact O-N 2.76Š| ||
| 135 | I | 26.2 | Very low | 25.4 | Very low | 37 Ų | 37 | 110.7 Ų | 110.7 | 19% | 0.19 | 60% | 0.6 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -76 | 110.2 | 169.7 | -59.8 | 175.8 | 0 | 0 | 0 | 107.2 | F133 I137 | F133-I135 PolarHBondContact O-N 3.39Å; I135-I137 HydrophobicContact CG2-CG1 4.15Å; I135-I137 PolarHBondContact O-N 2.99Å |
| 136 | I | 25.9 | Very low | 25.2 | Very low | 126 Ų | 126 | 112.4 Ų | 112.4 | 65% | 0.646 | 61% | 0.61 | S | S | * | * | E | Extended strand (participates in β ladder) | trans | -84.3 | 105.9 | 172.3 | -59.2 | 172.9 | 0 | 0 | 0 | 107.2 | P134 G138 | P134-I136 PolarHBondContact O-N 2.76Å; I136-G138 PolarHBondContact O-N 3.28Å |
| 137 | I | 27.2 | Very low | 25 | Very low | 62 Ų | 62 | 120.9 Ų | 120.9 | 32% | 0.318 | 64% | 0.64 | S | S | . | * | trans | -84 | 107.8 | 166.4 | -56.6 | 177.7 | 0 | 0 | 0 | 106.9 | L124 I126 I135 | L124-I137 HydrophobicContact CD2-CD1 4.39Å; I126-I137 HydrophobicContact CD1-CD1 4.24Å; I135-I137 HydrophobicContact CG2-CG1 4.15Å; I135-I137 PolarHBondContact O-N 2.99Å | ||
| 138 | G | 23.4 | Very low | 24.8 | Very low | 44 Ų | 44 | 126.4 Ų | 126.4 | 45% | 0.454 | 64% | 0.643 | S | S | . | * | trans | -72.5 | 159.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.3 | I136 D140 | I136-G138 PolarHBondContact O-N 3.28Å; G138-D140 VanDerWaalsContact C-N 3.26Å; G138-D140 PolarHBondContact O-N 2.83Å | ||
| 139 | N | 25.6 | Very low | 24.5 | Very low | 97 Ų | 97 | 134.4 Ų | 134.4 | 52% | 0.519 | 68% | 0.676 | S | S | . | * | S | Bend | trans | -76.6 | 51.3 | -174.5 | -83.3 | -16.1 | 0 | 0 | 0 | 114.3 | F141 | N139-F141 VanDerWaalsContact C-N 3.33Å; N139-F141 PolarHBondContact O-N 3.41Å |
| 140 | D | 26.8 | Very low | 24.4 | Very low | 145 Ų | 145 | 133.5 Ų | 133.5 | 78% | 0.775 | 67% | 0.672 | S | S | * | * | trans | -91.1 | 14.3 | 179.4 | -70.2 | -21.7 | 0 | 0 | 0 | 114.6 | G138 | G138-D140 VanDerWaalsContact C-N 3.26Å; G138-D140 PolarHBondContact O-N 2.83Å | ||
| 141 | F | 26.2 | Very low | 24.2 | Very low | 174 Ų | 174 | 129.2 Ų | 129.2 | 76% | 0.763 | 67% | 0.67 | S | S | * | * | trans | -116.7 | 54 | 179 | -77 | -85.6 | 0 | 0 | 0 | 113.2 | N139 | N139-F141 VanDerWaalsContact C-N 3.33Å; N139-F141 PolarHBondContact O-N 3.41Å | ||
| 142 | L | 23 | Very low | 24.1 | Very low | 166 Ų | 166 | 136.4 Ų | 136.4 | 87% | 0.869 | 70% | 0.695 | S | S | * | * | trans | -131.3 | 58.7 | 162.6 | -87.2 | 166.8 | 0 | 0 | 0 | 109.5 | ||||
| 143 | Q | 22 | Very low | 24 | Very low | 180 Ų | 180 | 140.1 Ų | 140.1 | 84% | 0.841 | 70% | 0.7 | S | S | * | * | trans | -120.1 | 131.6 | 160.5 | -73.6 | -172 | 0.3 | 0 | 0 | 108.4 | ||||
| 144 | S | 22.1 | Very low | 24 | Very low | 117 Ų | 117 | 140.3 Ų | 140.3 | 82% | 0.818 | 71% | 0.707 | S | S | * | * | trans | 68 | 74 | 178.9 | 76.2 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 145 | V | 23.7 | Very low | 23.8 | Very low | 132 Ų | 132 | 144.6 Ų | 144.6 | 80% | 0.8 | 72% | 0.715 | S | S | * | * | trans | -132.9 | 98.3 | 137.3 | -174.2 | 0 | 0 | 0 | 0 | 107.9 | Y147 | V145-Y147 PolarHBondContact O-N 3.49Š| ||
| 146 | E | 22.7 | Very low | 23.7 | Very low | 139 Ų | 139 | 147.9 Ų | 147.9 | 65% | 0.65 | 73% | 0.733 | S | S | * | * | trans | -61.2 | 119 | 174 | -144.4 | -174.7 | 152.5 | 0 | 0 | 108.7 | R148 | E146-R148 VanDerWaalsContact C-N 3.35Å; E146-R148 PolarHBondContact O-N 3.34Å; E146-R148 IonicContact OE1-CZ 3.37Å; E146-R148 IonicContact OE1-NE 3.02Å; E146-R148 PolarHBondContact OE1-NE 3.48Å; E146-R148 IonicContact OE1-NH2 2.88Å; E146-R148 PolarHBondContact OE1-NH2 3.46Å | ||
| 147 | Y | 21.3 | Very low | 23.6 | Very low | 236 Ų | 236 | 147 Ų | 147 | 93% | 0.925 | 74% | 0.737 | S | S | * | * | trans | -65.7 | 91.5 | 172.4 | -93.6 | -98.8 | 0 | 0 | 0 | 109.5 | V145 | V145-Y147 PolarHBondContact O-N 3.49Š| ||
| 148 | R | 23 | Very low | 23.6 | Very low | 195 Ų | 195 | 149.1 Ų | 149.1 | 74% | 0.736 | 75% | 0.748 | S | S | * | * | trans | -116.9 | 105 | 166.1 | -72.3 | -166.5 | -172.9 | -163 | 5.2 | 110.9 | E146 S150 | E146-R148 VanDerWaalsContact C-N 3.35Å; E146-R148 PolarHBondContact O-N 3.34Å; E146-R148 IonicContact OE1-CZ 3.37Å; E146-R148 IonicContact OE1-NE 3.02Å; E146-R148 PolarHBondContact OE1-NE 3.48Å; E146-R148 IonicContact OE1-NH2 2.88Å; E146-R148 PolarHBondContact OE1-NH2 3.46Å; R148-S150 PolarHBondContact O-N 3.21Å | ||
| 149 | K | 23.6 | Very low | 23.7 | Very low | 216 Ų | 216 | 152.6 Ų | 152.6 | 94% | 0.939 | 76% | 0.755 | S | S | * | * | S | Bend | trans | 1.5 | 96.1 | 156.8 | -67.8 | 177.4 | 174.5 | 178.2 | 0 | 116.3 | ||
| 150 | S | 23.1 | Very low | 23.8 | Very low | 101 Ų | 101 | 156 Ų | 156 | 71% | 0.706 | 77% | 0.768 | S | S | * | * | trans | 168.7 | 130 | 136.8 | -179.2 | 0 | 0 | 0 | 0 | 108.8 | R148 W152 | R148-S150 PolarHBondContact O-N 3.21Å; S150-W152 PolarHBondContact O-N 3.41Å | ||
| 151 | P | 23.6 | Very low | 24 | Very low | 106 Ų | 106 | 151.8 Ų | 151.8 | 69% | 0.688 | 75% | 0.746 | S | S | * | * | S | Bend | trans | -87 | 12.5 | -163.3 | 1.8 | 16 | 0 | 0 | 0 | 116.9 | ||
| 152 | W | 23.2 | Very low | 24.1 | Very low | 221 Ų | 221 | 149.5 Ų | 149.5 | 84% | 0.837 | 74% | 0.741 | S | S | * | * | S | Bend | trans | -146.3 | 75.6 | -167.9 | -52.3 | 98.5 | 0 | 0 | 0 | 112.3 | S150 | S150-W152 PolarHBondContact O-N 3.41Š|
| 153 | E | 21.8 | Very low | 24.5 | Very low | 192 Ų | 192 | 149.5 Ų | 149.5 | 90% | 0.897 | 73% | 0.734 | S | S | * | * | trans | 168.3 | 102.9 | 155.8 | -101.6 | 173.7 | 170.9 | 0 | 0 | 109.6 | ||||
| 154 | I | 24.4 | Very low | 24.7 | Very low | 163 Ų | 163 | 147.2 Ų | 147.2 | 84% | 0.836 | 72% | 0.723 | S | S | * | * | trans | -131 | 115.6 | 160.2 | -60 | -178.8 | 0 | 0 | 0 | 108.6 | ||||
| 155 | K | 21.9 | Very low | 25.1 | Very low | 188 Ų | 188 | 148.9 Ų | 148.9 | 82% | 0.817 | 71% | 0.712 | S | S | * | * | trans | -66.3 | 128.3 | 175.5 | -76 | 173.3 | 172.6 | 174.6 | 0 | 110.4 | C157 | K155-C157 PolarHBondContact O-N 3.01Å; K155-C157 VanDerWaalsContact O-N 3.14Å | ||
| 156 | L | 23.8 | Very low | 25.4 | Very low | 106 Ų | 106 | 146 Ų | 146 | 56% | 0.555 | 69% | 0.694 | S | S | * | * | trans | -67.9 | 100.5 | 167 | -81.4 | 151.6 | 0 | 0 | 0 | 109.7 | P39 I159 | P39-L156 HydrophobicContact CG-CD1 4.05Å; P39-L156 HydrophobicContact CG-CD2 4.4Å; L156-I159 HydrophobicContact CD2-CD1 4.35Å | ||
| 157 | C | 22.5 | Very low | 25.6 | Very low | 108 Ų | 108 | 145 Ų | 145 | 73% | 0.73 | 69% | 0.693 | S | S | * | * | trans | -103.7 | 133.1 | 164 | -69.2 | 0 | 0 | 0 | 0 | 108.9 | K155 | K155-C157 PolarHBondContact O-N 3.01Å; K155-C157 VanDerWaalsContact O-N 3.14Å | ||
| 158 | D | 27.1 | Very low | 25.9 | Very low | 105 Ų | 105 | 139.4 Ų | 139.4 | 56% | 0.561 | 67% | 0.674 | S | S | * | * | trans | 76.6 | 49.8 | 160.9 | -72 | -7.3 | 0 | 0 | 0 | 121.6 | Q160 N161 | D158-Q160 PolarHBondContact O-N 3.12Å; D158-N161 HydrophobicContact CB-CB 4.18Å; D158-N161 PolarHBondContact O-N 2.95Å; D158-N161 PolarHBondContact OD2-ND2 2.63Å | ||
| 159 | I | 26.5 | Very low | 26.1 | Very low | 117 Ų | 117 | 132.3 Ų | 132.3 | 60% | 0.6 | 66% | 0.655 | S | S | * | * | H | α-helix | trans | -63 | -21.2 | 161.7 | -67.8 | 174.8 | 0 | 0 | 0 | 112.4 | L156 | L156-I159 HydrophobicContact CD2-CD1 4.35Å |
| 160 | Q | 27.6 | Very low | 26.3 | Very low | 169 Ų | 169 | 124.4 Ų | 124.4 | 79% | 0.79 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -70.9 | -31.6 | 175.8 | -80.7 | -178.3 | -29.2 | 0 | 0 | 113.3 | D158 L162 | D158-Q160 PolarHBondContact O-N 3.12Å; Q160-L162 VanDerWaalsContact C-N 3.29Å; Q160-L162 PolarHBondContact O-N 3.48Å |
| 161 | N | 30.3 | Very low | 26.3 | Very low | 57 Ų | 57 | 125.3 Ų | 125.3 | 31% | 0.305 | 62% | 0.621 | S | S | . | * | H | α-helix | trans | -73.8 | -17.1 | 179.3 | -84.8 | -37.9 | 0 | 0 | 0 | 113.8 | D158 R165 | D158-N161 HydrophobicContact CB-CB 4.18Å; D158-N161 PolarHBondContact O-N 2.95Å; D158-N161 PolarHBondContact OD2-ND2 2.63Å; N161-R165 WeakPolarHBondContact O-CB 3Å; N161-R165 VanDerWaalsContact O-CG 3.25Å; N161-R165 WeakPolarHBondContact O-CG 3Å; N161-R165 PolarHBondContact O-N 2.73Å |
| 162 | L | 29.6 | Very low | 26.6 | Very low | 126 Ų | 126 | 124.5 Ų | 124.5 | 66% | 0.66 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -72.7 | -37.3 | 179.6 | -151.7 | 86.3 | 0 | 0 | 0 | 111.9 | Q160 V166 | Q160-L162 VanDerWaalsContact C-N 3.29Å; Q160-L162 PolarHBondContact O-N 3.48Å; L162-V166 VanDerWaalsContact O-CG2 3.25Å; L162-V166 WeakPolarHBondContact O-CG2 2.96Å; L162-V166 PolarHBondContact O-N 3.5Å; L162-V166 VanDerWaalsContact O-N 3.16Å |
| 163 | K | 29.8 | Very low | 26.8 | Very low | 165 Ų | 165 | 116.6 Ų | 116.6 | 72% | 0.717 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -63.2 | -44.9 | 176.8 | -92.8 | -176.1 | 172.5 | -176.9 | 0 | 111.6 | L167 | K163-L167 WeakPolarHBondContact O-CD1 3.18Å; K163-L167 PolarHBondContact O-N 3.32Å |
| 164 | E | 27.9 | Very low | 27.1 | Very low | 133 Ų | 133 | 110.6 Ų | 110.6 | 62% | 0.621 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -70.1 | -36.9 | -179.2 | -69.9 | -177.8 | 169 | 0 | 0 | 112.5 | L167 H168 | E164-L167 WeakPolarHBondContact O-CB 3.08Å; E164-L167 PolarHBondContact O-N 3.25Å; E164-H168 PolarHBondContact O-N 3.45Å |
| 165 | R | 29.2 | Very low | 27.2 | Very low | 152 Ų | 152 | 108.5 Ų | 108.5 | 57% | 0.574 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -75.2 | -32.2 | -178.8 | -71.7 | 177.5 | 179.1 | -161.6 | 0.1 | 113.8 | N161 L167 H168 S169 | N161-R165 WeakPolarHBondContact O-CB 3Å; N161-R165 VanDerWaalsContact O-CG 3.25Å; N161-R165 WeakPolarHBondContact O-CG 3Å; N161-R165 PolarHBondContact O-N 2.73Å; R165-L167 VanDerWaalsContact C-N 3.33Å; R165-H168 PolarHBondContact O-N 2.78Å; R165-S169 PolarHBondContact O-N 3.29Å |
| 166 | V | 29.5 | Very low | 27.5 | Very low | 70 Ų | 70 | 102.7 Ų | 102.7 | 42% | 0.424 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -68.5 | -35.2 | 172.6 | 173.2 | 0 | 0 | 0 | 0 | 110.9 | I126 L162 S170 | I126-V166 HydrophobicContact CD1-CG1 4.48Å; L162-V166 VanDerWaalsContact O-CG2 3.25Å; L162-V166 WeakPolarHBondContact O-CG2 2.96Å; L162-V166 PolarHBondContact O-N 3.5Å; L162-V166 VanDerWaalsContact O-N 3.16Å; V166-S170 WeakPolarHBondContact O-CB 3.47Å; V166-S170 PolarHBondContact O-N 3.49Å; V166-S170 PolarHBondContact O-OG 3.08Å |
| 167 | L | 27.1 | Very low | 27.7 | Very low | 119 Ų | 119 | 105.5 Ų | 105.5 | 62% | 0.623 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -65.3 | -43.3 | 169.8 | -83.9 | 157.3 | 0 | 0 | 0 | 111.6 | K163 E164 R165 S170 M171 | K163-L167 WeakPolarHBondContact O-CD1 3.18Å; K163-L167 PolarHBondContact O-N 3.32Å; E164-L167 WeakPolarHBondContact O-CB 3.08Å; E164-L167 PolarHBondContact O-N 3.25Å; R165-L167 VanDerWaalsContact C-N 3.33Å; L167-S170 PolarHBondContact O-N 3.07Å; L167-M171 PolarHBondContact O-N 2.89Å |
| 168 | H | 27.8 | Very low | 28 | Very low | 118 Ų | 118 | 106.6 Ų | 106.6 | 55% | 0.546 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -65.8 | -41.7 | 179.5 | -155.6 | -72.1 | 0 | 0 | 0 | 113.3 | E164 R165 S170 M171 T172 | E164-H168 PolarHBondContact O-N 3.45Å; R165-H168 PolarHBondContact O-N 2.78Å; H168-S170 VanDerWaalsContact C-N 3.26Å; H168-S170 PolarHBondContact O-N 3.22Å; H168-M171 PolarHBondContact O-N 3.12Å; H168-T172 PolarHBondContact O-N 3.24Å; H168-T172 PolarHBondContact O-OG1 3.41Å |
| 169 | S | 28.1 | Very low | 28.2 | Very low | 46 Ų | 46 | 111.8 Ų | 111.8 | 32% | 0.322 | 61% | 0.605 | S | S | . | * | H | α-helix | trans | -66.7 | -27 | 175.4 | 178.1 | 0 | 0 | 0 | 0 | 113.1 | R165 M171 G173 | R165-S169 PolarHBondContact O-N 3.29Å; S169-M171 VanDerWaalsContact C-N 3.31Å; S169-G173 PolarHBondContact O-N 3.41Å |
| 170 | S | 26.4 | Very low | 28.5 | Very low | 50 Ų | 50 | 115.3 Ų | 115.3 | 35% | 0.35 | 62% | 0.616 | S | S | . | * | H | α-helix | trans | -76.1 | -21.6 | 178.1 | -62.1 | 0 | 0 | 0 | 0 | 112.6 | K131 V166 L167 H168 | K131-S170 PolarHBondContact NZ-O 3.43Å; V166-S170 WeakPolarHBondContact O-CB 3.47Å; V166-S170 PolarHBondContact O-N 3.49Å; V166-S170 PolarHBondContact O-OG 3.08Å; L167-S170 PolarHBondContact O-N 3.07Å; H168-S170 VanDerWaalsContact C-N 3.26Å; H168-S170 PolarHBondContact O-N 3.22Å |
| 171 | M | 25.1 | Very low | 28.6 | Very low | 120 Ų | 120 | 115.8 Ų | 115.8 | 59% | 0.591 | 62% | 0.618 | S | S | * | * | H | α-helix | trans | -87.1 | -39.7 | 176.4 | -66 | -168.4 | -54.7 | 0 | 0 | 112.7 | L167 H168 S169 A174 | L167-M171 PolarHBondContact O-N 2.89Å; H168-M171 PolarHBondContact O-N 3.12Å; S169-M171 VanDerWaalsContact C-N 3.31Å; M171-A174 PolarHBondContact O-N 3.3Å |
| 172 | T | 29.2 | Very low | 28.8 | Very low | 89 Ų | 89 | 118.1 Ų | 118.1 | 55% | 0.546 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -73.2 | -28.7 | 178.3 | 38.3 | 0 | 0 | 0 | 0 | 113.7 | H168 A174 | H168-T172 PolarHBondContact O-N 3.24Å; H168-T172 PolarHBondContact O-OG1 3.41Å; T172-A174 PolarHBondContact O-N 3.17Å |
| 173 | G | 27.5 | Very low | 28.7 | Very low | 56 Ų | 56 | 121 Ų | 121 | 58% | 0.577 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -74.2 | -3.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 115 | S169 | S169-G173 PolarHBondContact O-N 3.41Š|
| 174 | A | 26.9 | Very low | 28.6 | Very low | 65 Ų | 65 | 119.1 Ų | 119.1 | 54% | 0.537 | 65% | 0.649 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -104.5 | -4.9 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.4 | M171 T172 | M171-A174 PolarHBondContact O-N 3.3Å; T172-A174 PolarHBondContact O-N 3.17Å |
| 175 | V | 27.9 | Very low | 28.6 | Very low | 120 Ų | 120 | 118.1 Ų | 118.1 | 73% | 0.727 | 65% | 0.654 | S | S | * | * | S | Bend | trans | -133.7 | 106.4 | -172.8 | -170.8 | 0 | 0 | 0 | 0 | 108.6 | ||
| 176 | G | 28.3 | Very low | 28.6 | Very low | 65 Ų | 65 | 115.4 Ų | 115.4 | 67% | 0.67 | 66% | 0.664 | S | S | * | * | trans | 97 | 65.9 | 160.7 | 0 | 0 | 0 | 0 | 0 | 116.9 | D178 | G176-D178 PolarHBondContact O-N 3.18Å; G176-D178 VanDerWaalsContact O-N 3.11Å | ||
| 177 | N | 28.2 | Very low | 28.6 | Very low | 166 Ų | 166 | 118.8 Ų | 118.8 | 89% | 0.888 | 68% | 0.679 | S | S | * | * | S | Bend | trans | -70.5 | 87.4 | 138.2 | -84.4 | -21.5 | 0 | 0 | 0 | 106.6 | ||
| 178 | D | 28.8 | Very low | 28.9 | Very low | 131 Ų | 131 | 121.6 Ų | 121.6 | 70% | 0.701 | 69% | 0.686 | S | S | * | * | trans | 175.4 | 87.8 | 159 | -89.3 | -23.8 | 0 | 0 | 0 | 105.6 | G176 | G176-D178 PolarHBondContact O-N 3.18Å; G176-D178 VanDerWaalsContact O-N 3.11Å | ||
| 179 | F | 31.2 | Very low | 29 | Very low | 214 Ų | 214 | 120.5 Ų | 120.5 | 94% | 0.939 | 69% | 0.688 | S | S | * | * | trans | -173.3 | 107.1 | 144.8 | -97.4 | -69.6 | 0 | 0 | 0 | 107.9 | ||||
| 180 | F | 32.1 | Very low | 29.4 | Very low | 190 Ų | 190 | 122.9 Ų | 122.9 | 83% | 0.833 | 70% | 0.697 | S | S | * | * | trans | -63.4 | 126.7 | -178.7 | -80 | -103.3 | 0 | 0 | 0 | 112.3 | ||||
| 181 | E | 30.2 | Very low | 29.8 | Very low | 179 Ų | 179 | 128.4 Ų | 128.4 | 84% | 0.836 | 72% | 0.72 | S | S | * | * | 47.9 | 152.4 | 123.7 | -91.1 | -164 | 179.6 | 0 | 0 | 122.4 | |||||
| 182 | P | 34.1 | Very low | 30.4 | Very low | 107 Ų | 107 | 128 Ų | 128 | 70% | 0.695 | 72% | 0.72 | S | S | * | * | -123.6 | 149.7 | -116.7 | 37.2 | -21.9 | 0 | 0 | 0 | 113.6 | |||||
| 183 | E | 28.1 | Very low | 30.9 | Very low | 185 Ų | 185 | 128 Ų | 128 | 86% | 0.864 | 72% | 0.716 | S | S | * | * | trans | -160.7 | 126.7 | 166.2 | -114.2 | -175.7 | -160 | 0 | 0 | 113.6 | ||||
| 184 | V | 28 | Very low | 31.5 | Very low | 126 Ų | 126 | 132.5 Ų | 132.5 | 76% | 0.764 | 73% | 0.726 | S | S | * | * | trans | 84.3 | 140.8 | 143.5 | -172 | 0 | 0 | 0 | 0 | 119.5 | ||||
| 185 | P | 28 | Very low | 32.4 | Very low | 113 Ų | 113 | 138.5 Ų | 138.5 | 73% | 0.734 | 74% | 0.743 | S | S | * | * | trans | -101.6 | 179.6 | -156.8 | 39.4 | -29.5 | 0 | 0 | 0 | 115.2 | ||||
| 186 | A | 27.4 | Very low | 33.2 | Very low | 95 Ų | 95 | 140.1 Ų | 140.1 | 79% | 0.785 | 74% | 0.742 | S | S | * | * | trans | 79.1 | 82.4 | 166.8 | 0 | 0 | 0 | 0 | 0 | 116.9 | ||||
| 187 | L | 30.2 | Very low | 33.8 | Very low | 140 Ų | 140 | 146.2 Ų | 146.2 | 73% | 0.733 | 75% | 0.751 | S | S | * | * | trans | -113.9 | 102.2 | 165.3 | -77.8 | 145.6 | 0 | 0 | 0 | 106.5 | L193 | L187-L193 HydrophobicContact CD2-CD1 4.23Š| ||
| 188 | K | 33.3 | Very low | 33.9 | Very low | 178 Ų | 178 | 141.5 Ų | 141.5 | 77% | 0.774 | 74% | 0.742 | S | S | * | * | 30.8 | 112.8 | 84 | -84.2 | -170.6 | 176.4 | -174.7 | 0 | 111.4 | D190 | K188-D190 PolarHBondContact O-N 2.9Š| |||
| 189 | T | 31.1 | Very low | 34.3 | Very low | 95 Ų | 95 | 142.5 Ų | 142.5 | 58% | 0.583 | 75% | 0.747 | S | S | * | * | trans | -54.2 | 123 | -176.8 | 19.7 | 0 | 0 | 0 | 0 | 112.1 | M191 D192 | T189-M191 PolarHBondContact O-N 2.93Å; T189-M191 VanDerWaalsContact O-N 3.16Å; T189-D192 WeakPolarHBondContact CB-OD2 3.26Å; T189-D192 VanDerWaalsContact O-CB 3.3Å; T189-D192 WeakPolarHBondContact O-CB 3.34Å; T189-D192 PolarHBondContact O-N 2.81Å; T189-D192 PolarHBondContact OG1-OD2 3.08Å | ||
| 190 | D | 35.2 | Very low | 34.3 | Very low | 97 Ų | 97 | 143.3 Ų | 143.3 | 52% | 0.519 | 74% | 0.744 | S | S | . | * | G | 310 helix | trans | -69.6 | -6.8 | -178.5 | -81.1 | -30.2 | 0 | 0 | 0 | 114.5 | K188 D192 L193 | K188-D190 PolarHBondContact O-N 2.9Å; D190-D192 PolarHBondContact O-N 3.11Å; D190-L193 PolarHBondContact O-N 2.01Å |
| 191 | M | 35.2 | Very low | 34.5 | Very low | 166 Ų | 166 | 142.7 Ų | 142.7 | 82% | 0.818 | 75% | 0.748 | S | S | * | * | G | 310 helix | trans | -66.1 | -25.3 | 163.8 | -124.1 | -173.6 | 71.9 | 0 | 0 | 111.6 | T189 | T189-M191 PolarHBondContact O-N 2.93Å; T189-M191 VanDerWaalsContact O-N 3.16Å |
| 192 | D | 38 | Very low | 34.7 | Very low | 112 Ų | 112 | 142.7 Ų | 142.7 | 60% | 0.599 | 75% | 0.748 | S | S | * | * | G | 310 helix | trans | -88.1 | -3.9 | 179.8 | -57.7 | -49.2 | 0 | 0 | 0 | 113.3 | T189 D190 | T189-D192 WeakPolarHBondContact CB-OD2 3.26Å; T189-D192 VanDerWaalsContact O-CB 3.3Å; T189-D192 WeakPolarHBondContact O-CB 3.34Å; T189-D192 PolarHBondContact O-N 2.81Å; T189-D192 PolarHBondContact OG1-OD2 3.08Å; D190-D192 PolarHBondContact O-N 3.11Å |
| 193 | L | 40.6 | Very low | 34.7 | Very low | 88 Ų | 88 | 143.9 Ų | 143.9 | 46% | 0.461 | 76% | 0.756 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -116.5 | -11.4 | -175 | -77 | 165.1 | 0 | 0 | 0 | 114.7 | L187 D190 | L187-L193 HydrophobicContact CD2-CD1 4.23Å; D190-L193 PolarHBondContact O-N 2.01Å |
| 194 | L | 38.8 | Very low | 34.9 | Very low | 151 Ų | 151 | 143.7 Ų | 143.7 | 79% | 0.791 | 76% | 0.755 | S | S | * | * | S | Bend | trans | -89.8 | -7.8 | -179.9 | -84.1 | 160.7 | 0 | 0 | 0 | 114.7 | ||
| 195 | E | 45.1 | Very low | 35 | Very low | 190 Ų | 190 | 142.9 Ų | 142.9 | 89% | 0.888 | 76% | 0.761 | S | S | * | * | S | Bend | trans | -87.7 | -10.7 | 174.9 | -78.7 | -171.2 | 155.6 | 0 | 0 | 114.1 | ||
| 196 | E | 45.9 | Very low | 35.1 | Very low | 154 Ų | 154 | 141.4 Ų | 141.4 | 72% | 0.72 | 77% | 0.767 | S | S | * | * | S | Bend | trans | -102 | -11.6 | -163.7 | -150.3 | 179.3 | 171.8 | 0 | 0 | 115.9 | ||
| 197 | K | 39.9 | Very low | 35.1 | Very low | 193 Ų | 193 | 141.1 Ų | 141.1 | 84% | 0.839 | 76% | 0.755 | S | S | * | * | trans | -141.6 | 91 | 179.2 | -68.7 | -165.6 | 179.1 | -177.4 | 0 | 113.6 | ||||
| 198 | G | 31.8 | Very low | 34.9 | Very low | 68 Ų | 68 | 143.4 Ų | 143.4 | 70% | 0.701 | 76% | 0.762 | S | S | * | * | trans | -59.5 | 142.5 | 151.5 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 199 | D | 35.9 | Very low | 34.7 | Very low | 151 Ų | 151 | 144.4 Ų | 144.4 | 81% | 0.807 | 76% | 0.762 | S | S | * | * | 176.4 | 116.9 | 116.4 | -93.1 | -30.2 | 0 | 0 | 0 | 110.5 | |||||
| 200 | R | 32.5 | Very low | 34.6 | Very low | 231 Ų | 231 | 146.6 Ų | 146.6 | 87% | 0.872 | 77% | 0.769 | S | S | * | * | trans | 38 | 103.6 | 143.2 | -68.8 | 175 | 157.7 | 178.5 | -6.1 | 118.3 | ||||
| 201 | L | 35.1 | Very low | 34.2 | Very low | 178 Ų | 178 | 147.4 Ų | 147.4 | 93% | 0.932 | 77% | 0.773 | S | S | * | * | trans | -128.1 | 118.4 | 145.6 | -74.2 | 171.2 | 0 | 0 | 0 | 109.2 | ||||
| 202 | E | 35.7 | Very low | 33.9 | Very low | 179 Ų | 179 | 147 Ų | 147 | 84% | 0.836 | 77% | 0.773 | S | S | * | * | P | Polyproline II helix | trans | -67.2 | 144.6 | 179.3 | -66.6 | -174.6 | 152.8 | 0 | 0 | 111.3 | Q204 | E202-Q204 PolarHBondContact O-N 3.47Š|
| 203 | P | 33.6 | Very low | 33.7 | Very low | 132 Ų | 132 | 148.4 Ų | 148.4 | 86% | 0.857 | 78% | 0.781 | S | S | * | * | P | Polyproline II helix | trans | -70.1 | 118.2 | 178.7 | -0.8 | 14.8 | 0 | 0 | 0 | 110 | A205 | P203-A205 PolarHBondContact O-N 2.81Š|
| 204 | Q | 31.7 | Very low | 33.1 | Very low | 181 Ų | 181 | 147 Ų | 147 | 85% | 0.846 | 78% | 0.782 | S | S | * | * | P | Polyproline II helix | trans | -65.8 | 123.6 | 167.7 | -74.9 | -173.5 | 4.2 | 0 | 0 | 109.4 | E202 G206 | E202-Q204 PolarHBondContact O-N 3.47Å; Q204-G206 PolarHBondContact O-N 2.86Å |
| 205 | A | 29.7 | Very low | 32.8 | Very low | 108 Ų | 108 | 149.3 Ų | 149.3 | 89% | 0.893 | 79% | 0.789 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -58.1 | 130.3 | 175 | 0 | 0 | 0 | 0 | 0 | 110.9 | P203 | P203-A205 PolarHBondContact O-N 2.81Š|
| 206 | G | 30.2 | Very low | 32.3 | Very low | 82 Ų | 82 | 148.8 Ų | 148.8 | 85% | 0.845 | 79% | 0.791 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 122.6 | 1.4 | 170.2 | 0 | 0 | 0 | 0 | 0 | 116.6 | Q204 | Q204-G206 PolarHBondContact O-N 2.86Š|
| 207 | V | 27.7 | Very low | 31.5 | Very low | 90 Ų | 90 | 144.7 Ų | 144.7 | 55% | 0.545 | 78% | 0.784 | S | S | . | * | trans | -114 | 104.2 | 174.1 | -173.6 | 0 | 0 | 0 | 0 | 109.3 | Y209 | V207-Y209 HydrophobicContact CB-CD2 4.33Å; V207-Y209 HydrophobicContact CB-CE2 3.8Å; V207-Y209 HydrophobicContact CG1-CD2 3.98Å; V207-Y209 HydrophobicContact CG1-CE1 4.18Å; V207-Y209 HydrophobicContact CG1-CE2 3.58Å; V207-Y209 HydrophobicContact CG1-CG 4.44Å; V207-Y209 WeakPolarHBondContact O-CD2 3.14Å; V207-Y209 PolarHBondContact O-N 3.38Å | ||
| 208 | E | 26.9 | Very low | 31 | Very low | 188 Ų | 188 | 142.4 Ų | 142.4 | 88% | 0.879 | 79% | 0.786 | S | S | * | * | trans | -70.7 | 105.6 | 165.9 | -76.5 | -177.5 | 165.1 | 0 | 0 | 108.5 | I210 | E208-I210 PolarHBondContact O-N 3.29Š| ||
| 209 | Y | 28 | Very low | 30.9 | Very low | 198 Ų | 198 | 142.6 Ų | 142.6 | 78% | 0.776 | 79% | 0.788 | S | S | * | * | trans | -80.4 | 108 | 167.3 | -68.6 | -89.1 | 0 | 0 | 0 | 108.2 | V207 N211 | V207-Y209 HydrophobicContact CB-CD2 4.33Å; V207-Y209 HydrophobicContact CB-CE2 3.8Å; V207-Y209 HydrophobicContact CG1-CD2 3.98Å; V207-Y209 HydrophobicContact CG1-CE1 4.18Å; V207-Y209 HydrophobicContact CG1-CE2 3.58Å; V207-Y209 HydrophobicContact CG1-CG 4.44Å; V207-Y209 WeakPolarHBondContact O-CD2 3.14Å; V207-Y209 PolarHBondContact O-N 3.38Å; Y209-N211 PolarHBondContact O-N 3.36Å | ||
| 210 | I | 28.5 | Very low | 30.5 | Very low | 142 Ų | 142 | 139.2 Ų | 139.2 | 73% | 0.728 | 79% | 0.789 | S | S | * | * | trans | -68.2 | 103 | 167.5 | -59.5 | 172.9 | 0 | 0 | 0 | 106.7 | E208 L212 | E208-I210 PolarHBondContact O-N 3.29Å; I210-L212 HydrophobicContact CG2-CD2 4.11Å; I210-L212 HydrophobicContact CG2-CG 4.23Å; I210-L212 PolarHBondContact O-N 3.28Å | ||
| 211 | N | 27.4 | Very low | 30.6 | Very low | 113 Ų | 113 | 136.4 Ų | 136.4 | 60% | 0.604 | 79% | 0.789 | S | S | * | * | trans | -72.1 | 95.8 | 174.3 | -173.5 | -2.8 | 0 | 0 | 0 | 109.1 | Y209 N213 A214 | Y209-N211 PolarHBondContact O-N 3.36Å; N211-N213 PolarHBondContact O-N 3.29Å; N211-N213 VanDerWaalsContact O-N 3.11Å; N211-N213 PolarHBondContact OD1-N 3.44Å; N211-A214 PolarHBondContact O-N 2.63Å | ||
| 212 | L | 28.4 | Very low | 30.7 | Very low | 157 Ų | 157 | 135.1 Ų | 135.1 | 82% | 0.822 | 78% | 0.784 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -72.1 | 7.7 | 176.6 | -70.2 | 167.9 | 0 | 0 | 0 | 113.6 | I210 | I210-L212 HydrophobicContact CG2-CD2 4.11Å; I210-L212 HydrophobicContact CG2-CG 4.23Å; I210-L212 PolarHBondContact O-N 3.28Å |
| 213 | N | 33.2 | Very low | 30.6 | Very low | 143 Ų | 143 | 134.1 Ų | 134.1 | 77% | 0.765 | 78% | 0.784 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -112.3 | 17.5 | 173.9 | -81.3 | -9.5 | 0 | 0 | 0 | 114.1 | N211 | N211-N213 PolarHBondContact O-N 3.29Å; N211-N213 VanDerWaalsContact O-N 3.11Å; N211-N213 PolarHBondContact OD1-N 3.44Å |
| 214 | A | 29.9 | Very low | 30.5 | Very low | 58 Ų | 58 | 135.8 Ų | 135.8 | 48% | 0.479 | 78% | 0.78 | S | S | . | * | S | Bend | trans | -99.4 | -7 | 178.5 | 0 | 0 | 0 | 0 | 0 | 115.5 | N211 | N211-A214 PolarHBondContact O-N 2.63Š|
| 215 | E | 32.2 | Very low | 30.6 | Very low | 199 Ų | 199 | 132.4 Ų | 132.4 | 93% | 0.93 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -91.8 | 1 | 178.8 | -86.9 | -169.7 | 163.1 | 0 | 0 | 115.2 | ||
| 216 | L | 34.7 | Very low | 31.1 | Very low | 180 Ų | 180 | 135.1 Ų | 135.1 | 94% | 0.942 | 77% | 0.772 | S | S | * | * | S | Bend | trans | -116.7 | 5.8 | 176.8 | -90.8 | 148.4 | 0 | 0 | 0 | 114.3 | ||
| 217 | A | 28.2 | Very low | 31.5 | Very low | 68 Ų | 68 | 138.7 Ų | 138.7 | 56% | 0.562 | 77% | 0.766 | S | S | * | * | S | Bend | trans | -148.4 | 75.1 | -178.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||
| 218 | T | 29.2 | Very low | 31.7 | Very low | 145 Ų | 145 | 138.7 Ų | 138.7 | 89% | 0.89 | 77% | 0.77 | S | S | * | * | S | Bend | trans | 163.2 | 122.6 | 137.4 | 46.1 | 0 | 0 | 0 | 0 | 110.9 | ||
| 219 | G | 29.6 | Very low | 32.2 | Very low | 71 Ų | 71 | 137.2 Ų | 137.2 | 73% | 0.732 | 77% | 0.765 | S | S | * | * | trans | 94.6 | 100.7 | 167.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 220 | G | 28.6 | Very low | 32.5 | Very low | 81 Ų | 81 | 135.1 Ų | 135.1 | 84% | 0.835 | 76% | 0.762 | S | S | * | * | cis | 66 | 72.7 | 48.2 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 221 | I | 34.4 | Very low | 32.8 | Very low | 171 Ų | 171 | 134.9 Ų | 134.9 | 88% | 0.877 | 76% | 0.758 | S | S | * | * | trans | -112.5 | 108.2 | 154.8 | -58.6 | 179.6 | 0 | 0 | 0 | 105.1 | ||||
| 222 | D | 36.2 | Very low | 33.3 | Very low | 152 Ų | 152 | 138.3 Ų | 138.3 | 81% | 0.813 | 77% | 0.768 | S | S | * | * | trans | -48.1 | 140.4 | -179.2 | -88 | -47.3 | 0 | 0 | 0 | 113.4 | Q224 | D222-Q224 PolarHBondContact O-N 2.88Š| ||
| 223 | D | 33.5 | Very low | 33.7 | Very low | 158 Ų | 158 | 136.9 Ų | 136.9 | 85% | 0.845 | 77% | 0.768 | S | S | * | * | trans | -40.2 | 114.5 | 145.8 | -75.5 | -46.5 | 0 | 0 | 0 | 110.5 | ||||
| 224 | Q | 32.7 | Very low | 34 | Very low | 167 Ų | 167 | 134.5 Ų | 134.5 | 78% | 0.78 | 77% | 0.768 | S | S | * | * | trans | -159.4 | 125.6 | 137.3 | -77.6 | -147.4 | -16.2 | 0 | 0 | 111.2 | D222 I226 | D222-Q224 PolarHBondContact O-N 2.88Å; Q224-I226 PolarHBondContact O-N 2.8Å | ||
| 225 | P | 33 | Very low | 34.4 | Very low | 109 Ų | 109 | 139.4 Ų | 139.4 | 71% | 0.708 | 79% | 0.785 | S | S | * | * | trans | -75.6 | 111.4 | 162 | 30.1 | -27 | 0 | 0 | 0 | 108.1 | H227 | P225-H227 PolarHBondContact O-N 3.37Å; P225-H227 VanDerWaalsContact O-N 3.07Å | ||
| 226 | I | 40.5 | Very low | 34.5 | Very low | 166 Ų | 166 | 137.3 Ų | 137.3 | 85% | 0.851 | 78% | 0.78 | S | S | * | * | trans | -69.2 | 112.9 | 174.7 | -61.3 | 177.9 | 0 | 0 | 0 | 108.6 | Q224 | Q224-I226 PolarHBondContact O-N 2.8Š| ||
| 227 | H | 38.1 | Very low | 34.7 | Very low | 157 Ų | 157 | 137.6 Ų | 137.6 | 73% | 0.727 | 77% | 0.773 | S | S | * | * | trans | -58.8 | 146.8 | -178.8 | -87.3 | -87.7 | 0 | 0 | 0 | 114.8 | P225 | P225-H227 PolarHBondContact O-N 3.37Å; P225-H227 VanDerWaalsContact O-N 3.07Å | ||
| 228 | S | 33.4 | Very low | 35.2 | Very low | 90 Ų | 90 | 140.1 Ų | 140.1 | 63% | 0.629 | 78% | 0.784 | S | S | * | * | trans | -12.3 | 133.8 | 146 | 53.5 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 229 | M | 36.1 | Very low | 35.6 | Very low | 157 Ų | 157 | 136.8 Ų | 136.8 | 77% | 0.773 | 78% | 0.778 | S | S | * | * | 166.9 | 131.1 | 113.9 | -89 | -163.9 | 178.8 | 0 | 0 | 112 | |||||
| 230 | Q | 35.1 | Very low | 36.1 | Very low | 153 Ų | 153 | 142 Ų | 142 | 72% | 0.715 | 79% | 0.789 | S | S | * | * | trans | 65.1 | 144.5 | 147.8 | -68.3 | 173.7 | -61.7 | 0 | 0 | 117.4 | ||||
| 231 | E | 34.6 | Very low | 36.4 | Very low | 138 Ų | 138 | 146.1 Ų | 146.1 | 65% | 0.645 | 79% | 0.79 | S | S | * | * | cis | -178.1 | 125.8 | 9.8 | -115.9 | 172.2 | -151.3 | 0 | 0 | 102.8 | ||||
| 232 | K | 37.6 | Very low | 36.9 | Very low | 184 Ų | 184 | 148.2 Ų | 148.2 | 80% | 0.8 | 81% | 0.811 | S | S | * | * | 165.1 | 140.4 | 88.3 | -106 | 167.5 | -174.6 | 174.2 | 0 | 108.6 | |||||
| 233 | P | 36.8 | Very low | 36.9 | Very low | 128 Ų | 128 | 148.1 Ų | 148.1 | 83% | 0.831 | 81% | 0.811 | S | S | * | * | trans | -97.9 | 136.6 | 166.7 | 34.9 | -26.4 | 0 | 0 | 0 | 111.3 | ||||
| 234 | A | 39.6 | Very low | 37.1 | Very low | 92 Ų | 92 | 147.5 Ų | 147.5 | 76% | 0.76 | 81% | 0.809 | S | S | * | * | trans | -174.7 | 143.1 | 171.5 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 235 | L | 38.6 | Very low | 37.3 | Very low | 161 Ų | 161 | 146.4 Ų | 146.4 | 84% | 0.843 | 81% | 0.81 | S | S | * | * | cis | -169.7 | 124 | -4.5 | -123.5 | 143.1 | 0 | 0 | 0 | 105.5 | ||||
| 236 | L | 33.5 | Very low | 37.6 | Very low | 155 Ų | 155 | 148.6 Ų | 148.6 | 81% | 0.812 | 82% | 0.816 | S | S | * | * | trans | 3.5 | 143.2 | 151.6 | -87.4 | 158.9 | 0 | 0 | 0 | 123.2 | ||||
| 237 | K | 38.5 | Very low | 37.4 | Very low | 187 Ų | 187 | 147.6 Ų | 147.6 | 81% | 0.813 | 81% | 0.814 | S | S | * | * | trans | 105.3 | 159.2 | 144 | -76.8 | 179.4 | -175.5 | -176.3 | 0 | 118.9 | ||||
| 238 | P | 39.2 | Very low | 37.3 | Very low | 121 Ų | 121 | 146.9 Ų | 146.9 | 79% | 0.786 | 82% | 0.82 | S | S | * | * | cis | -141.9 | 170.5 | -41.2 | 39 | -21.4 | 0 | 0 | 0 | 114.7 | ||||
| 239 | G | 37.8 | Very low | 37.6 | Very low | 74 Ų | 74 | 151 Ų | 151 | 76% | 0.763 | 83% | 0.834 | S | S | * | * | trans | 108.4 | 138.2 | 163.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | ||||
| 240 | L | 40.7 | Very low | 37.7 | Very low | 182 Ų | 182 | 150.5 Ų | 150.5 | 95% | 0.953 | 84% | 0.838 | S | S | * | * | cis | -157.8 | 150.5 | 32.3 | -134.5 | 86.1 | 0 | 0 | 0 | 110.3 | ||||
| 241 | L | 33.9 | Very low | 38 | Very low | 166 Ų | 166 | 150.3 Ų | 150.3 | 87% | 0.869 | 85% | 0.849 | S | S | * | * | trans | -71.2 | 141.6 | 177.8 | -73.6 | 147 | 0 | 0 | 0 | 113.9 | ||||
| 242 | V | 44.7 | Very low | 38.3 | Very low | 216 Ų | 216 | 151.5 Ų | 151.5 | 100% | 1.309 | 87% | 0.867 | S | S | * | * | -136.3 | 0 | 129.3 | -178 | 0 | 0 | 0 | 0 | 107.2 |
Retrieved 242 of 242 residues in 663.2 ms
(Link to these results)