| 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 | 27 | Very low | 33.6 | Very low | 233 Ų | 233 | 137 Ų | 137 | 100% | 1.148 | 66% | 0.664 | S | S | * | * | 0 | 109.2 | 0 | -177.8 | 163.4 | 42.8 | 0 | 0 | 107.6 | |||||
| 2 | I | 26.5 | Very low | 33.8 | Very low | 134 Ų | 134 | 134.1 Ų | 134.1 | 69% | 0.687 | 65% | 0.649 | S | S | * | * | trans | -97.2 | 117.5 | 178.7 | -62.9 | 173 | 0 | 0 | 0 | 106.3 | I4 | I2-I4 PolarHBondContact O-N 2.8Å; I2-I4 VanDerWaalsContact O-N 3.12Å | ||
| 3 | E | 28.7 | Very low | 34 | Very low | 137 Ų | 137 | 137.2 Ų | 137.2 | 64% | 0.64 | 66% | 0.661 | S | S | * | * | trans | -70.6 | 103.3 | 174.1 | -76.1 | -176.8 | 161 | 0 | 0 | 110 | N5 W7 | E3-N5 PolarHBondContact O-N 3.36Å; E3-W7 PolarHBondContact O-NE1 3.49Å | ||
| 4 | I | 36.4 | Very low | 34.2 | Very low | 103 Ų | 103 | 132.5 Ų | 132.5 | 53% | 0.528 | 65% | 0.65 | S | S | . | * | G | 310 helix | trans | -75.5 | -13.4 | 178.3 | -62.1 | 171.5 | 0 | 0 | 0 | 111.5 | I2 K6 W7 I9 | I2-I4 PolarHBondContact O-N 2.8Å; I2-I4 VanDerWaalsContact O-N 3.12Å; I4-K6 VanDerWaalsContact C-N 3.27Å; I4-K6 PolarHBondContact O-N 3.45Å; I4-K6 VanDerWaalsContact O-N 3.12Å; I4-W7 WeakPolarHBondContact O-CB 3.37Å; I4-W7 VanDerWaalsContact O-CD1 3.29Å; I4-W7 PolarHBondContact O-N 3.37Å; I4-I9 HydrophobicContact CG2-CD1 3.94Å |
| 5 | N | 33.4 | Very low | 35.2 | Very low | 164 Ų | 164 | 133.7 Ų | 133.7 | 88% | 0.877 | 67% | 0.668 | S | S | * | * | G | 310 helix | trans | -71.8 | -7.9 | -171.2 | -69.8 | -12.5 | 0 | 0 | 0 | 116.1 | E3 | E3-N5 PolarHBondContact O-N 3.36Š|
| 6 | K | 31 | Very low | 36.8 | Very low | 166 Ų | 166 | 130.1 Ų | 130.1 | 72% | 0.722 | 66% | 0.659 | S | S | * | * | G | 310 helix | trans | -98.7 | 18.3 | 176.4 | -70.3 | -176.6 | 179 | 169.9 | 0 | 114.3 | I4 | I4-K6 VanDerWaalsContact C-N 3.27Å; I4-K6 PolarHBondContact O-N 3.45Å; I4-K6 VanDerWaalsContact O-N 3.12Å |
| 7 | W | 33.8 | Very low | 38 | Very low | 97 Ų | 97 | 128.2 Ų | 128.2 | 37% | 0.367 | 64% | 0.643 | S | S | . | * | trans | -117.6 | 113.4 | -168.1 | -61.5 | 56.8 | 0 | 0 | 0 | 110.1 | E3 I4 I9 K22 | E3-W7 PolarHBondContact O-NE1 3.49Å; I4-W7 WeakPolarHBondContact O-CB 3.37Å; I4-W7 VanDerWaalsContact O-CD1 3.29Å; I4-W7 PolarHBondContact O-N 3.37Å; W7-I9 VanDerWaalsContact C-N 3.25Å; W7-I9 HydrophobicContact CB-CD1 3.41Å; W7-I9 VanDerWaalsContact CB-CD1 3.41Å; W7-I9 HydrophobicContact CB-CG1 3.51Å; W7-I9 HydrophobicContact CG-CD1 4.27Å; W7-I9 PolarHBondContact O-N 3.48Å; W7-K22 HydrophobicContact CB-CD 4.45Å; W7-K22 HydrophobicContact CD2-CD 3.51Å; W7-K22 HydrophobicContact CE3-CB 3.84Å; W7-K22 HydrophobicContact CE3-CD 3.17Å; W7-K22 HydrophobicContact CE3-CG 4.13Å; W7-K22 HydrophobicContact CG-CD 4.09Å; W7-K22 HydrophobicContact CH2-CD 4.19Å; W7-K22 HydrophobicContact CZ2-CD 4.49Å; W7-K22 HydrophobicContact CZ3-CB 3.91Å; W7-K22 HydrophobicContact CZ3-CD 3.55Å; W7-K22 HydrophobicContact CZ3-CG 4.31Å | ||
| 8 | N | 36.2 | Very low | 39.2 | Very low | 169 Ų | 169 | 124.7 Ų | 124.7 | 90% | 0.904 | 62% | 0.624 | S | S | * | * | trans | -68.5 | 87.2 | 166 | -89.2 | -11.3 | 0 | 0 | 0 | 108.6 | ||||
| 9 | I | 39.7 | Very low | 40.5 | Very low | 45 Ų | 45 | 119.4 Ų | 119.4 | 23% | 0.231 | 60% | 0.598 | C | S | . | * | trans | -101.9 | 118.4 | -174.6 | -69.7 | 166.3 | 0 | 0 | 0 | 108.6 | I4 W7 I11 L20 | I4-I9 HydrophobicContact CG2-CD1 3.94Å; W7-I9 VanDerWaalsContact C-N 3.25Å; W7-I9 HydrophobicContact CB-CD1 3.41Å; W7-I9 VanDerWaalsContact CB-CD1 3.41Å; W7-I9 HydrophobicContact CB-CG1 3.51Å; W7-I9 HydrophobicContact CG-CD1 4.27Å; W7-I9 PolarHBondContact O-N 3.48Å; I9-I11 HydrophobicContact CG2-CG1 4.08Å; I9-L20 HydrophobicContact CD1-CD1 4.33Å; I9-L20 HydrophobicContact CG2-CB 3.67Å; I9-L20 HydrophobicContact CG2-CD1 4.08Å; I9-L20 HydrophobicContact CG2-CD2 3.04Å; I9-L20 HydrophobicContact CG2-CG 3.72Å | ||
| 10 | K | 38.3 | Very low | 41.5 | Very low | 162 Ų | 162 | 114.5 Ų | 114.5 | 70% | 0.704 | 57% | 0.574 | S | S | * | * | trans | -83.6 | 116.4 | 167.6 | -164.9 | -177.3 | -177.5 | -163.1 | 0 | 108.5 | E12 | K10-E12 IonicContact NZ-OE1 3.91Š| ||
| 11 | I | 39.1 | Very low | 42.7 | Very low | 97 Ų | 97 | 116.1 Ų | 116.1 | 50% | 0.497 | 57% | 0.573 | S | S | . | * | trans | -91.8 | 115 | 179.7 | -57.5 | 174.7 | 0 | 0 | 0 | 108.1 | I9 Q13 M18 L20 | I9-I11 HydrophobicContact CG2-CG1 4.08Å; I11-Q13 HydrophobicContact CG2-CG 4.16Å; I11-M18 HydrophobicContact CG2-CE 3.89Å; I11-M18 HydrophobicContact CG2-CG 4.15Å; I11-M18 HydrophobicContact CG2-SD 4.24Å; I11-L20 HydrophobicContact CG1-CD2 4.03Å | ||
| 12 | E | 35.9 | Very low | 44.5 | Very low | 102 Ų | 102 | 108 Ų | 108 | 48% | 0.477 | 53% | 0.532 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.5 | 105.1 | 164.4 | -72.3 | 176.9 | -179.3 | 0 | 0 | 107.7 | K10 S14 | K10-E12 IonicContact NZ-OE1 3.91Å; E12-S14 PolarHBondContact O-N 3.06Å |
| 13 | Q | 36.4 | Very low | 46.7 | Very low | 174 Ų | 174 | 109.2 Ų | 109.2 | 81% | 0.813 | 53% | 0.534 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -76.9 | 109.7 | 174.3 | -85.6 | -176.5 | -16.5 | 0 | 0 | 109.3 | I11 | I11-Q13 HydrophobicContact CG2-CG 4.16Å |
| 14 | S | 37.2 | Very low | 48.8 | Very low | 72 Ų | 72 | 105.7 Ų | 105.7 | 50% | 0.503 | 52% | 0.518 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -105.6 | 142.1 | 146.1 | 72 | 0 | 0 | 0 | 0 | 106.4 | E12 S16 R17 | E12-S14 PolarHBondContact O-N 3.06Å; S14-S16 PolarHBondContact O-N 3.49Å; S14-R17 PolarHBondContact N-O 2.82Å; S14-R17 CarbonylContact O-C 3.53Å; S14-R17 PolarHBondContact O-N 3.42Å; S14-R17 PolarHBondContact OG-O 3.14Å |
| 15 | T | 49.3 | Very low | 50.2 | Low | 150 Ų | 150 | 104.6 Ų | 104.6 | 92% | 0.92 | 51% | 0.508 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.9 | 0.7 | -164.6 | 41.1 | 0 | 0 | 0 | 0 | 117.5 | ||
| 16 | S | 59.5 | Low | 51.7 | Low | 76 Ų | 76 | 97.8 Ų | 97.8 | 53% | 0.531 | 47% | 0.472 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -139.2 | -2.5 | 173.9 | -48.4 | 0 | 0 | 0 | 0 | 114.3 | S14 N31 | S14-S16 PolarHBondContact O-N 3.49Å; S16-N31 PolarHBondContact O-N 3.38Å |
| 17 | R | 58.4 | Low | 53.4 | Low | 99 Ų | 99 | 91.3 Ų | 91.3 | 37% | 0.374 | 45% | 0.445 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -145.2 | 126.7 | -172 | -179.9 | -175 | 176 | -169.9 | -0.9 | 110.6 | S14 I19 I28 V29 F30 | S14-R17 PolarHBondContact N-O 2.82Å; S14-R17 CarbonylContact O-C 3.53Å; S14-R17 PolarHBondContact O-N 3.42Å; S14-R17 PolarHBondContact OG-O 3.14Å; R17-I19 HydrophobicContact CG-CG1 4.15Å; R17-I19 VanDerWaalsContact CZ-CD1 3.5Å; R17-I28 HydrophobicContact CG-CG2 3.83Å; R17-I28 VanDerWaalsContact NE-CG2 3.34Å; R17-V29 CarbonylContact C-O 3.57Å; R17-V29 WeakPolarHBondContact CA-O 3.38Å; R17-F30 HydrophobicContact CB-CD1 4.36Å; R17-F30 HydrophobicContact CG-CD1 4.26Å; R17-F30 HydrophobicContact CG-CE1 4.27Å |
| 18 | M | 58.4 | Low | 54.9 | Low | 64 Ų | 64 | 87.3 Ų | 87.3 | 32% | 0.315 | 43% | 0.431 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -113.7 | 123.4 | 173 | 168.7 | -179.1 | -55.5 | 0 | 0 | 108.4 | I11 L20 V29 | I11-M18 HydrophobicContact CG2-CE 3.89Å; I11-M18 HydrophobicContact CG2-CG 4.15Å; I11-M18 HydrophobicContact CG2-SD 4.24Å; M18-L20 HydrophobicContact CG-CD2 3.54Å; M18-L20 HydrophobicContact CG-CG 4.11Å; M18-L20 HydrophobicContact SD-CD1 4.34Å; M18-L20 HydrophobicContact SD-CD2 3.76Å; M18-L20 HydrophobicContact SD-CG 4.36Å; M18-V29 HydrophobicContact CB-CB 4.11Å; M18-V29 PolarHBondContact N-O 3.28Å; M18-V29 PolarHBondContact O-N 3.24Å |
| 19 | I | 63.7 | Low | 56.1 | Low | 25 Ų | 25 | 79.9 Ų | 79.9 | 13% | 0.128 | 39% | 0.392 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.5 | 124 | 177.5 | -54.7 | 174.6 | 0 | 0 | 0 | 108.2 | R17 R21 T26 L27 | R17-I19 HydrophobicContact CG-CG1 4.15Å; R17-I19 VanDerWaalsContact CZ-CD1 3.5Å; I19-R21 HydrophobicContact CG2-CG 4.11Å; I19-T26 HydrophobicContact CG2-CG2 3.72Å; I19-L27 CarbonylContact C-O 3.46Å; I19-L27 WeakPolarHBondContact CA-O 3.2Å |
| 20 | L | 62 | Low | 57.1 | Low | 21 Ų | 21 | 80.8 Ų | 80.8 | 11% | 0.11 | 39% | 0.394 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.6 | 124.7 | 176.5 | -48 | 179.3 | 0 | 0 | 0 | 108.1 | I9 I11 M18 L27 V29 | I9-L20 HydrophobicContact CD1-CD1 4.33Å; I9-L20 HydrophobicContact CG2-CB 3.67Å; I9-L20 HydrophobicContact CG2-CD1 4.08Å; I9-L20 HydrophobicContact CG2-CD2 3.04Å; I9-L20 HydrophobicContact CG2-CG 3.72Å; I11-L20 HydrophobicContact CG1-CD2 4.03Å; M18-L20 HydrophobicContact CG-CD2 3.54Å; M18-L20 HydrophobicContact CG-CG 4.11Å; M18-L20 HydrophobicContact SD-CD1 4.34Å; M18-L20 HydrophobicContact SD-CD2 3.76Å; M18-L20 HydrophobicContact SD-CG 4.36Å; L20-L27 HydrophobicContact CB-CB 4.02Å; L20-L27 HydrophobicContact CB-CD2 4.15Å; L20-L27 HydrophobicContact CB-CG 4.1Å; L20-L27 HydrophobicContact CD1-CD2 3.67Å; L20-L27 HydrophobicContact CD1-CG 4.14Å; L20-L27 HydrophobicContact CG-CD2 4.31Å; L20-L27 HydrophobicContact CG-CG 4.31Å; L20-L27 PolarHBondContact N-O 3.49Å; L20-L27 PolarHBondContact O-N 2.86Å; L20-V29 HydrophobicContact CD1-CG2 4.44Å |
| 21 | R | 65.2 | Low | 57.9 | Low | 149 Ų | 149 | 77.9 Ų | 77.9 | 56% | 0.562 | 39% | 0.386 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -116.4 | 132.2 | -179 | -60.6 | -175.4 | -171.4 | 175.9 | 4.8 | 109.6 | I19 Y25 | I19-R21 HydrophobicContact CG2-CG 4.11Å; R21-Y25 WeakPolarHBondContact CA-O 3.19Å |
| 22 | K | 65.6 | Low | 58.4 | Low | 62 Ų | 62 | 76.1 Ų | 76.1 | 27% | 0.27 | 38% | 0.377 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -142.6 | 118.7 | 169.5 | -174.8 | 173.6 | -178.2 | 176.9 | 0 | 109.5 | W7 Q24 Y25 | W7-K22 HydrophobicContact CB-CD 4.45Å; W7-K22 HydrophobicContact CD2-CD 3.51Å; W7-K22 HydrophobicContact CE3-CB 3.84Å; W7-K22 HydrophobicContact CE3-CD 3.17Å; W7-K22 HydrophobicContact CE3-CG 4.13Å; W7-K22 HydrophobicContact CG-CD 4.09Å; W7-K22 HydrophobicContact CH2-CD 4.19Å; W7-K22 HydrophobicContact CZ2-CD 4.49Å; W7-K22 HydrophobicContact CZ3-CB 3.91Å; W7-K22 HydrophobicContact CZ3-CD 3.55Å; W7-K22 HydrophobicContact CZ3-CG 4.31Å; K22-Q24 PolarHBondContact O-N 3.23Å; K22-Q24 VanDerWaalsContact O-N 3.13Å; K22-Y25 PolarHBondContact N-O 2.85Å; K22-Y25 WeakPolarHBondContact O-CB 3.44Å; K22-Y25 PolarHBondContact O-N 2.87Å |
| 23 | E | 73.7 | Confident | 58.9 | Low | 159 Ų | 159 | 74.9 Ų | 74.9 | 74% | 0.743 | 38% | 0.38 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.6 | -116.5 | -178.5 | -60.7 | 173 | -171.8 | 0 | 0 | 111.3 | Q50 | E23-Q50 PolarHBondContact O-OE1 3.03Š|
| 24 | Q | 72 | Confident | 59 | Low | 63 Ų | 63 | 69.4 Ų | 69.4 | 29% | 0.294 | 36% | 0.355 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.6 | 6.2 | 179.2 | 66.5 | -178.8 | -7.6 | 0 | 0 | 114.1 | K22 K49 Q50 | K22-Q24 PolarHBondContact O-N 3.23Å; K22-Q24 VanDerWaalsContact O-N 3.13Å; Q24-K49 CarbonylContact O-C 3.58Å; Q24-Q50 WeakPolarHBondContact O-CB 3.34Å; Q24-Q50 PolarHBondContact O-N 3.03Å |
| 25 | Y | 65.1 | Low | 58.9 | Low | 81 Ų | 81 | 73.5 Ų | 73.5 | 32% | 0.318 | 37% | 0.367 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.6 | 130.7 | -175.8 | -54.6 | -73 | 0 | 0 | 0 | 110.7 | R21 K22 Q50 L56 | R21-Y25 WeakPolarHBondContact CA-O 3.19Å; K22-Y25 PolarHBondContact N-O 2.85Å; K22-Y25 WeakPolarHBondContact O-CB 3.44Å; K22-Y25 PolarHBondContact O-N 2.87Å; Y25-Q50 PolarHBondContact O-NE2 3.13Å; Y25-L56 HydrophobicContact CD1-CD1 3.77Å; Y25-L56 HydrophobicContact CE1-CD1 3.72Å |
| 26 | T | 66.4 | Low | 58.2 | Low | 20 Ų | 20 | 74.2 Ų | 74.2 | 12% | 0.123 | 37% | 0.365 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.8 | 118.3 | 166.6 | -68.1 | 0 | 0 | 0 | 0 | 107.8 | I19 I28 M48 Q50 | I19-T26 HydrophobicContact CG2-CG2 3.72Å; T26-I28 HydrophobicContact CG2-CD1 4.43Å; T26-I28 HydrophobicContact CG2-CG1 3.78Å; T26-M48 PolarHBondContact N-O 3.13Å; T26-M48 PolarHBondContact O-N 2.9Å; T26-Q50 VanDerWaalsContact OG1-CD 3.3Å; T26-Q50 WeakPolarHBondContact OG1-CG 2.97Å; T26-Q50 PolarHBondContact OG1-NE2 2.75Å |
| 27 | L | 65.4 | Low | 57.3 | Low | 30 Ų | 30 | 75 Ų | 75 | 16% | 0.157 | 36% | 0.362 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -94.9 | 120.7 | 167.2 | 163.4 | 50.8 | 0 | 0 | 0 | 108.2 | I19 L20 V29 F46 V47 F59 | I19-L27 CarbonylContact C-O 3.46Å; I19-L27 WeakPolarHBondContact CA-O 3.2Å; L20-L27 HydrophobicContact CB-CB 4.02Å; L20-L27 HydrophobicContact CB-CD2 4.15Å; L20-L27 HydrophobicContact CB-CG 4.1Å; L20-L27 HydrophobicContact CD1-CD2 3.67Å; L20-L27 HydrophobicContact CD1-CG 4.14Å; L20-L27 HydrophobicContact CG-CD2 4.31Å; L20-L27 HydrophobicContact CG-CG 4.31Å; L20-L27 PolarHBondContact N-O 3.49Å; L20-L27 PolarHBondContact O-N 2.86Å; L27-V29 HydrophobicContact CD1-CG2 3.89Å; L27-V29 HydrophobicContact CD2-CG2 4.42Å; L27-V29 HydrophobicContact CG-CG2 3.99Å; L27-F46 WeakPolarHBondContact CA-O 3.28Å; L27-F46 VanDerWaalsContact CD1-O 3.22Å; L27-F46 WeakPolarHBondContact CD1-O 3.46Å; L27-V47 HydrophobicContact CD1-CG2 4.23Å; L27-F59 HydrophobicContact CD1-CD1 4.24Å; L27-F59 HydrophobicContact CD1-CE1 3.1Å; L27-F59 HydrophobicContact CD1-CZ 3.38Å; L27-F59 HydrophobicContact CD2-CE1 3.55Å; L27-F59 HydrophobicContact CD2-CZ 3.56Å; L27-F59 HydrophobicContact CG-CE1 3.91Å; L27-F59 HydrophobicContact CG-CZ 3.98Å |
| 28 | I | 64.9 | Low | 56.4 | Low | 14 Ų | 14 | 77.3 Ų | 77.3 | 7% | 0.072 | 39% | 0.387 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -106.7 | 106.8 | 171 | -50.7 | 179.1 | 0 | 0 | 0 | 108.3 | R17 T26 F30 G45 F46 M48 | R17-I28 HydrophobicContact CG-CG2 3.83Å; R17-I28 VanDerWaalsContact NE-CG2 3.34Å; T26-I28 HydrophobicContact CG2-CD1 4.43Å; T26-I28 HydrophobicContact CG2-CG1 3.78Å; I28-F30 HydrophobicContact CB-CE2 4.02Å; I28-F30 HydrophobicContact CG2-CD2 3.79Å; I28-F30 HydrophobicContact CG2-CE1 4.15Å; I28-F30 HydrophobicContact CG2-CE2 3.31Å; I28-F30 HydrophobicContact CG2-CG 4.41Å; I28-F30 HydrophobicContact CG2-CZ 3.52Å; I28-G45 CarbonylContact O-C 3.56Å; I28-G45 WeakPolarHBondContact O-CA 3.49Å; I28-F46 PolarHBondContact N-O 2.7Å; I28-F46 PolarHBondContact O-N 3.16Å; I28-M48 HydrophobicContact CD1-CE 3.28Å; I28-M48 HydrophobicContact CG1-CE 4.13Å |
| 29 | V | 62.8 | Low | 55.6 | Low | 13 Ų | 13 | 77.3 Ų | 77.3 | 8% | 0.079 | 39% | 0.386 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -89 | 125.3 | 170.1 | -178.5 | 0 | 0 | 0 | 0 | 108.1 | R17 M18 L20 L27 F59 I61 | R17-V29 CarbonylContact C-O 3.57Å; R17-V29 WeakPolarHBondContact CA-O 3.38Å; M18-V29 HydrophobicContact CB-CB 4.11Å; M18-V29 PolarHBondContact N-O 3.28Å; M18-V29 PolarHBondContact O-N 3.24Å; L20-V29 HydrophobicContact CD1-CG2 4.44Å; L27-V29 HydrophobicContact CD1-CG2 3.89Å; L27-V29 HydrophobicContact CD2-CG2 4.42Å; L27-V29 HydrophobicContact CG-CG2 3.99Å; V29-F59 HydrophobicContact CG2-CE2 4.3Å; V29-F59 HydrophobicContact CG2-CZ 3.83Å; V29-I61 HydrophobicContact CG1-CD1 3.56Å; V29-I61 HydrophobicContact CG2-CD1 4.43Å |
| 30 | F | 59.9 | Low | 54.7 | Low | 63 Ų | 63 | 83.7 Ų | 83.7 | 28% | 0.276 | 42% | 0.415 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -108.9 | 132 | 169.9 | -62.2 | -96 | 0 | 0 | 0 | 108.8 | R17 I28 I32 V44 F46 | R17-F30 HydrophobicContact CB-CD1 4.36Å; R17-F30 HydrophobicContact CG-CD1 4.26Å; R17-F30 HydrophobicContact CG-CE1 4.27Å; I28-F30 HydrophobicContact CB-CE2 4.02Å; I28-F30 HydrophobicContact CG2-CD2 3.79Å; I28-F30 HydrophobicContact CG2-CE1 4.15Å; I28-F30 HydrophobicContact CG2-CE2 3.31Å; I28-F30 HydrophobicContact CG2-CG 4.41Å; I28-F30 HydrophobicContact CG2-CZ 3.52Å; F30-I32 HydrophobicContact CB-CD1 3.56Å; F30-I32 HydrophobicContact CB-CG1 3.31Å; F30-I32 HydrophobicContact CD1-CD1 4.44Å; F30-I32 HydrophobicContact CG-CD1 4Å; F30-I32 HydrophobicContact CG-CG1 4.22Å; F30-I32 PolarHBondContact O-N 2.82Å; F30-V44 PolarHBondContact N-O 2.91Å; F30-V44 PolarHBondContact O-N 2.79Å; F30-F46 AromaticContact CD2-CD2 3.5Å; F30-F46 HydrophobicContact CD2-CD2 3.5Å; F30-F46 AromaticContact CD2-CE2 3.54Å; F30-F46 HydrophobicContact CD2-CE2 3.54Å; F30-F46 AromaticContact CE2-CD2 3.61Å; F30-F46 HydrophobicContact CE2-CD2 3.61Å; F30-F46 AromaticContact CE2-CE2 3.87Å; F30-F46 HydrophobicContact CE2-CE2 3.87Å |
| 31 | N | 55 | Low | 54.4 | Low | 102 Ų | 102 | 85 Ų | 85 | 55% | 0.545 | 43% | 0.434 | S | S | . | . | trans | -82.2 | 76.3 | 165.9 | -165.8 | 5.6 | 0 | 0 | 0 | 107.8 | S16 | S16-N31 PolarHBondContact O-N 3.38Š| ||
| 32 | I | 50 | Low | 53.9 | Low | 60 Ų | 60 | 80.3 Ų | 80.3 | 31% | 0.308 | 42% | 0.419 | S | S | . | . | trans | -99.6 | 109.6 | 177.7 | -45.7 | 179.3 | 0 | 0 | 0 | 107.5 | F30 L34 | F30-I32 HydrophobicContact CB-CD1 3.56Å; F30-I32 HydrophobicContact CB-CG1 3.31Å; F30-I32 HydrophobicContact CD1-CD1 4.44Å; F30-I32 HydrophobicContact CG-CD1 4Å; F30-I32 HydrophobicContact CG-CG1 4.22Å; F30-I32 PolarHBondContact O-N 2.82Å; I32-L34 VanDerWaalsContact C-N 3.32Å; I32-L34 HydrophobicContact CB-CG 4.27Å; I32-L34 HydrophobicContact CG2-CD2 3.63Å; I32-L34 HydrophobicContact CG2-CG 3.63Å; I32-L34 PolarHBondContact O-N 2.76Å; I32-L34 VanDerWaalsContact O-N 3.13Å | ||
| 33 | S | 45.6 | Very low | 53.7 | Low | 76 Ų | 76 | 79.1 Ų | 79.1 | 53% | 0.531 | 42% | 0.418 | S | S | . | . | trans | -74.5 | 93.7 | 156.1 | -68.2 | 0 | 0 | 0 | 0 | 107.3 | H35 | S33-H35 PolarHBondContact O-N 2.85Š| ||
| 34 | L | 38.7 | Very low | 53.1 | Low | 58 Ų | 58 | 72 Ų | 72 | 30% | 0.304 | 39% | 0.385 | S | S | . | . | trans | -72.6 | 95 | 174 | -74.5 | 165.9 | 0 | 0 | 0 | 107.8 | I32 N36 I37 | I32-L34 VanDerWaalsContact C-N 3.32Å; I32-L34 HydrophobicContact CB-CG 4.27Å; I32-L34 HydrophobicContact CG2-CD2 3.63Å; I32-L34 HydrophobicContact CG2-CG 3.63Å; I32-L34 PolarHBondContact O-N 2.76Å; I32-L34 VanDerWaalsContact O-N 3.13Å; L34-N36 PolarHBondContact O-N 2.76Å; L34-I37 HydrophobicContact CB-CB 4.35Å; L34-I37 HydrophobicContact CD1-CD1 4.26Å | ||
| 35 | H | 36.6 | Very low | 53 | Low | 159 Ų | 159 | 69 Ų | 69 | 74% | 0.736 | 37% | 0.371 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.3 | -10.4 | -177.4 | -105.8 | -24.1 | 0 | 0 | 0 | 114.8 | S33 | S33-H35 PolarHBondContact O-N 2.85Š|
| 36 | N | 34.5 | Very low | 53.2 | Low | 165 Ų | 165 | 68.3 Ų | 68.3 | 88% | 0.882 | 37% | 0.37 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -130.6 | 11.9 | -172.3 | -88.8 | -5.9 | 0 | 0 | 0 | 115.5 | L34 | L34-N36 PolarHBondContact O-N 2.76Š|
| 37 | I | 39.8 | Very low | 53.3 | Low | 93 Ų | 93 | 69.3 Ų | 69.3 | 48% | 0.477 | 38% | 0.376 | S | S | . | . | S | Bend | trans | -124.2 | 144.6 | 169.6 | -54.6 | -179.7 | 0 | 0 | 0 | 105 | L34 F39 | L34-I37 HydrophobicContact CB-CB 4.35Å; L34-I37 HydrophobicContact CD1-CD1 4.26Å; I37-F39 HydrophobicContact CG2-CD2 3.71Å; I37-F39 HydrophobicContact CG2-CE2 4.12Å; I37-F39 CarbonylContact O-C 3.54Å; I37-F39 PolarHBondContact O-N 2.75Å |
| 38 | T | 39.7 | Very low | 53.5 | Low | 146 Ų | 146 | 70.3 Ų | 70.3 | 90% | 0.896 | 38% | 0.38 | S | S | * | . | S | Bend | trans | -51.9 | 5.4 | -173.3 | -24.9 | 0 | 0 | 0 | 0 | 116.4 | ||
| 39 | F | 42 | Very low | 53.7 | Low | 65 Ų | 65 | 72.4 Ų | 72.4 | 29% | 0.285 | 39% | 0.389 | S | S | . | . | trans | -96.1 | 63.2 | 170.2 | -58.3 | -81.7 | 0 | 0 | 0 | 110.8 | I37 G41 I42 W58 | I37-F39 HydrophobicContact CG2-CD2 3.71Å; I37-F39 HydrophobicContact CG2-CE2 4.12Å; I37-F39 CarbonylContact O-C 3.54Å; I37-F39 PolarHBondContact O-N 2.75Å; F39-G41 PolarHBondContact O-N 2.95Å; F39-I42 HydrophobicContact CD1-CD1 4.28Å; F39-W58 HydrophobicContact CZ-CH2 4.29Å | ||
| 40 | Q | 44.6 | Very low | 53.7 | Low | 159 Ų | 159 | 75.2 Ų | 75.2 | 74% | 0.743 | 40% | 0.401 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.4 | 104.4 | 169.8 | -77.2 | -175.3 | -10.4 | 0 | 0 | 109.2 | ||
| 41 | G | 54.7 | Low | 54.2 | Low | 49 Ų | 49 | 80.7 Ų | 80.7 | 51% | 0.505 | 43% | 0.425 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 87.6 | 14.2 | 166.4 | 0 | 0 | 0 | 0 | 0 | 117 | F39 | F39-G41 PolarHBondContact O-N 2.95Š|
| 42 | I | 55.7 | Low | 55.2 | Low | 49 Ų | 49 | 79.5 Ų | 79.5 | 25% | 0.251 | 42% | 0.421 | S | S | . | . | trans | -100.7 | 118.6 | 178.4 | -41.9 | -176.8 | 0 | 0 | 0 | 110.6 | F39 V44 Q60 I61 | F39-I42 HydrophobicContact CD1-CD1 4.28Å; I42-V44 PolarHBondContact O-N 2.86Å; I42-Q60 HydrophobicContact CB-CG 4.16Å; I42-Q60 VanDerWaalsContact CD1-NE2 3.33Å; I42-Q60 HydrophobicContact CG2-CG 3.21Å; I42-I61 WeakPolarHBondContact CG2-O 3.45Å | ||
| 43 | P | 60.2 | Low | 56 | Low | 38 Ų | 38 | 82.7 Ų | 82.7 | 25% | 0.247 | 44% | 0.439 | C | S | . | . | trans | -62.1 | 136.7 | 177.8 | -16.6 | 27.8 | 0 | 0 | 0 | 111.1 | I61 | P43-I61 HydrophobicContact CB-CB 4.06Å; P43-I61 HydrophobicContact CB-CD1 4.13Å; P43-I61 HydrophobicContact CB-CG1 4.32Å; P43-I61 HydrophobicContact CG-CB 4.39Å; P43-I61 PolarHBondContact O-N 2.63Å | ||
| 44 | V | 60.8 | Low | 57.2 | Low | 10 Ų | 10 | 83.7 Ų | 83.7 | 6% | 0.061 | 44% | 0.435 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -120.2 | 138.6 | 179 | -70.3 | 0 | 0 | 0 | 0 | 110.5 | F30 I42 F46 W58 F59 | F30-V44 PolarHBondContact N-O 2.91Å; F30-V44 PolarHBondContact O-N 2.79Å; I42-V44 PolarHBondContact O-N 2.86Å; V44-F46 HydrophobicContact CG2-CE2 4.49Å; V44-W58 HydrophobicContact CG1-CE3 4.45Å; V44-F59 WeakPolarHBondContact CA-O 3.1Å |
| 45 | G | 71 | Confident | 58.8 | Low | 0 Ų | 0 | 86.5 Ų | 86.5 | 0% | 0 | 44% | 0.443 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.6 | 150.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | I28 W58 F59 | I28-G45 CarbonylContact O-C 3.56Å; I28-G45 WeakPolarHBondContact O-CA 3.49Å; G45-W58 CarbonylContact O-C 3.54Å; G45-W58 WeakPolarHBondContact O-CA 3.34Å; G45-W58 WeakPolarHBondContact O-CB 3.44Å; G45-F59 PolarHBondContact N-O 3.02Å; G45-F59 PolarHBondContact O-N 2.83Å |
| 46 | F | 69.4 | Low | 60.3 | Low | 66 Ų | 66 | 82.7 Ų | 82.7 | 29% | 0.289 | 43% | 0.427 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.1 | 135.7 | 175.8 | -54.7 | -87.8 | 0 | 0 | 0 | 109.5 | L27 I28 F30 V44 Y55 W58 | L27-F46 WeakPolarHBondContact CA-O 3.28Å; L27-F46 VanDerWaalsContact CD1-O 3.22Å; L27-F46 WeakPolarHBondContact CD1-O 3.46Å; I28-F46 PolarHBondContact N-O 2.7Å; I28-F46 PolarHBondContact O-N 3.16Å; F30-F46 AromaticContact CD2-CD2 3.5Å; F30-F46 HydrophobicContact CD2-CD2 3.5Å; F30-F46 AromaticContact CD2-CE2 3.54Å; F30-F46 HydrophobicContact CD2-CE2 3.54Å; F30-F46 AromaticContact CE2-CD2 3.61Å; F30-F46 HydrophobicContact CE2-CD2 3.61Å; F30-F46 AromaticContact CE2-CE2 3.87Å; F30-F46 HydrophobicContact CE2-CE2 3.87Å; V44-F46 HydrophobicContact CG2-CE2 4.49Å; F46-Y55 HydrophobicContact CB-CE2 4.1Å; F46-Y55 AromaticContact CD1-CE2 3.75Å; F46-Y55 HydrophobicContact CD1-CE2 3.75Å; F46-Y55 HydrophobicContact CG-CE2 4.4Å; F46-W58 HydrophobicContact CD1-CB 3.95Å; F46-W58 HydrophobicContact CE1-CB 4.23Å |
| 47 | V | 68.1 | Low | 62.1 | Low | 40 Ų | 40 | 75.9 Ų | 75.9 | 24% | 0.242 | 40% | 0.396 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -102 | 127.3 | 176.2 | -173.7 | 0 | 0 | 0 | 0 | 108.5 | L27 L56 G57 F59 | L27-V47 HydrophobicContact CD1-CG2 4.23Å; V47-L56 HydrophobicContact CB-CB 4.32Å; V47-L56 HydrophobicContact CG1-CB 4.17Å; V47-L56 HydrophobicContact CG1-CD1 4.16Å; V47-L56 PolarHBondContact O-N 2.86Å; V47-G57 PolarHBondContact N-O 2.88Å; V47-F59 HydrophobicContact CG2-CD1 4.09Å; V47-F59 HydrophobicContact CG2-CE1 4.13Å |
| 48 | M | 69.5 | Low | 63.7 | Low | 52 Ų | 52 | 78.1 Ų | 78.1 | 26% | 0.256 | 40% | 0.398 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -129 | 147.2 | 175.1 | -58.9 | -171.6 | -51.6 | 0 | 0 | 111.1 | T26 I28 E54 | T26-M48 PolarHBondContact N-O 3.13Å; T26-M48 PolarHBondContact O-N 2.9Å; I28-M48 HydrophobicContact CD1-CE 3.28Å; I28-M48 HydrophobicContact CG1-CE 4.13Å; M48-E54 CarbonylContact C-O 3.56Å; M48-E54 VanDerWaalsContact CA-O 3.28Å; M48-E54 WeakPolarHBondContact CA-O 3.4Å |
| 49 | K | 68.3 | Low | 65 | Low | 58 Ų | 58 | 73.9 Ų | 73.9 | 25% | 0.252 | 37% | 0.368 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -85.1 | 118.8 | 170.7 | -169.8 | 170 | 172.1 | -174.4 | 0 | 109.6 | Q24 K51 T52 N53 E54 L56 | Q24-K49 CarbonylContact O-C 3.58Å; K49-K51 PolarHBondContact O-N 3.4Å; K49-T52 WeakPolarHBondContact CB-OG1 3.22Å; K49-T52 WeakPolarHBondContact CD-OG1 3.08Å; K49-T52 PolarHBondContact O-N 3.47Å; K49-N53 WeakPolarHBondContact O-CA 3.39Å; K49-N53 PolarHBondContact O-N 2.85Å; K49-E54 HydrophobicContact CB-CB 4.19Å; K49-E54 PolarHBondContact N-O 2.92Å; K49-E54 PolarHBondContact O-N 3.27Å; K49-L56 HydrophobicContact CB-CD1 4.15Å; K49-L56 HydrophobicContact CB-CG 4.41Å |
| 50 | Q | 63.4 | Low | 65.9 | Low | 72 Ų | 72 | 74.2 Ų | 74.2 | 34% | 0.336 | 37% | 0.37 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.7 | -43.1 | -173.4 | -73.8 | 177.4 | 3.9 | 0 | 0 | 114 | E23 Q24 Y25 T26 T52 | E23-Q50 PolarHBondContact O-OE1 3.03Å; Q24-Q50 WeakPolarHBondContact O-CB 3.34Å; Q24-Q50 PolarHBondContact O-N 3.03Å; Y25-Q50 PolarHBondContact O-NE2 3.13Å; T26-Q50 VanDerWaalsContact OG1-CD 3.3Å; T26-Q50 WeakPolarHBondContact OG1-CG 2.97Å; T26-Q50 PolarHBondContact OG1-NE2 2.75Å; Q50-T52 VanDerWaalsContact C-N 3.32Å; Q50-T52 PolarHBondContact O-N 2.96Å |
| 51 | K | 70.2 | Confident | 66.8 | Low | 177 Ų | 177 | 70 Ų | 70 | 77% | 0.77 | 35% | 0.352 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -70 | -30.6 | -174.8 | -72.3 | -173 | 176.5 | -179.1 | 0 | 113 | K49 | K49-K51 PolarHBondContact O-N 3.4Š|
| 52 | T | 75.5 | Confident | 67.2 | Low | 78 Ų | 78 | 76.2 Ų | 76.2 | 48% | 0.479 | 38% | 0.38 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -112.7 | -7 | -173.6 | 51.6 | 0 | 0 | 0 | 0 | 113.1 | K49 Q50 E54 | K49-T52 WeakPolarHBondContact CB-OG1 3.22Å; K49-T52 WeakPolarHBondContact CD-OG1 3.08Å; K49-T52 PolarHBondContact O-N 3.47Å; Q50-T52 VanDerWaalsContact C-N 3.32Å; Q50-T52 PolarHBondContact O-N 2.96Å; T52-E54 PolarHBondContact O-N 3.36Å; T52-E54 WeakPolarHBondContact OG1-CB 3.49Å; T52-E54 PolarHBondContact OG1-N 3.12Å; T52-E54 PolarHBondContact OG1-OE2 2.9Å |
| 53 | N | 68.5 | Low | 67.7 | Low | 127 Ų | 127 | 77.6 Ų | 77.6 | 68% | 0.679 | 39% | 0.387 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 48.9 | 24.6 | -165.1 | -63.6 | -46 | 0 | 0 | 0 | 113.2 | K49 Y55 | K49-N53 WeakPolarHBondContact O-CA 3.39Å; K49-N53 PolarHBondContact O-N 2.85Å; N53-Y55 PolarHBondContact O-N 3.45Å |
| 54 | E | 69.2 | Low | 68.1 | Low | 97 Ų | 97 | 79.6 Ų | 79.6 | 45% | 0.453 | 39% | 0.394 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.4 | 125.7 | -178.3 | -177.2 | -175.5 | 179.9 | 0 | 0 | 109.1 | M48 K49 T52 L56 | M48-E54 CarbonylContact C-O 3.56Å; M48-E54 VanDerWaalsContact CA-O 3.28Å; M48-E54 WeakPolarHBondContact CA-O 3.4Å; K49-E54 HydrophobicContact CB-CB 4.19Å; K49-E54 PolarHBondContact N-O 2.92Å; K49-E54 PolarHBondContact O-N 3.27Å; T52-E54 PolarHBondContact O-N 3.36Å; T52-E54 WeakPolarHBondContact OG1-CB 3.49Å; T52-E54 PolarHBondContact OG1-N 3.12Å; T52-E54 PolarHBondContact OG1-OE2 2.9Å; E54-L56 HydrophobicContact CG-CD2 4.07Å; E54-L56 PolarHBondContact O-N 3.12Å |
| 55 | Y | 72.4 | Confident | 68.5 | Low | 117 Ų | 117 | 83.5 Ų | 83.5 | 46% | 0.459 | 41% | 0.413 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -73.2 | 123.3 | 173.1 | 174.2 | -110.3 | 0 | 0 | 0 | 110 | F46 N53 G57 W58 | F46-Y55 HydrophobicContact CB-CE2 4.1Å; F46-Y55 AromaticContact CD1-CE2 3.75Å; F46-Y55 HydrophobicContact CD1-CE2 3.75Å; F46-Y55 HydrophobicContact CG-CE2 4.4Å; N53-Y55 PolarHBondContact O-N 3.45Å; Y55-G57 WeakPolarHBondContact CE2-O 3.13Å; Y55-G57 VanDerWaalsContact CZ-CA 3.44Å; Y55-W58 WeakPolarHBondContact OH-CB 3.39Å; Y55-W58 VanDerWaalsContact OH-CD1 3.27Å; Y55-W58 PolarHBondContact OH-N 2.98Å; Y55-W58 VanDerWaalsContact OH-N 3.16Å |
| 56 | L | 68.4 | Low | 68.4 | Low | 79 Ų | 79 | 88.4 Ų | 88.4 | 41% | 0.414 | 44% | 0.437 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -103.4 | -16.7 | -176.2 | -59.8 | -178.4 | 0 | 0 | 0 | 113 | Y25 V47 K49 E54 | Y25-L56 HydrophobicContact CD1-CD1 3.77Å; Y25-L56 HydrophobicContact CE1-CD1 3.72Å; V47-L56 HydrophobicContact CB-CB 4.32Å; V47-L56 HydrophobicContact CG1-CB 4.17Å; V47-L56 HydrophobicContact CG1-CD1 4.16Å; V47-L56 PolarHBondContact O-N 2.86Å; K49-L56 HydrophobicContact CB-CD1 4.15Å; K49-L56 HydrophobicContact CB-CG 4.41Å; E54-L56 HydrophobicContact CG-CD2 4.07Å; E54-L56 PolarHBondContact O-N 3.12Å |
| 57 | G | 71.8 | Confident | 68.3 | Low | 21 Ų | 21 | 89.8 Ų | 89.8 | 22% | 0.216 | 45% | 0.446 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | 146.7 | 177.9 | -179.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | V47 Y55 | V47-G57 PolarHBondContact N-O 2.88Å; Y55-G57 WeakPolarHBondContact CE2-O 3.13Å; Y55-G57 VanDerWaalsContact CZ-CA 3.44Å |
| 58 | W | 73.7 | Confident | 68.3 | Low | 141 Ų | 141 | 93.1 Ų | 93.1 | 53% | 0.534 | 46% | 0.46 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -122.5 | 160.6 | 175.9 | 65.3 | -79.7 | 0 | 0 | 0 | 109.9 | F39 V44 G45 F46 Y55 Q60 | F39-W58 HydrophobicContact CZ-CH2 4.29Å; V44-W58 HydrophobicContact CG1-CE3 4.45Å; G45-W58 CarbonylContact O-C 3.54Å; G45-W58 WeakPolarHBondContact O-CA 3.34Å; G45-W58 WeakPolarHBondContact O-CB 3.44Å; F46-W58 HydrophobicContact CD1-CB 3.95Å; F46-W58 HydrophobicContact CE1-CB 4.23Å; Y55-W58 WeakPolarHBondContact OH-CB 3.39Å; Y55-W58 VanDerWaalsContact OH-CD1 3.27Å; Y55-W58 PolarHBondContact OH-N 2.98Å; Y55-W58 VanDerWaalsContact OH-N 3.16Å; W58-Q60 HydrophobicContact CZ3-CB 4.09Å |
| 59 | F | 67.1 | Low | 68.3 | Low | 57 Ų | 57 | 96.1 Ų | 96.1 | 25% | 0.25 | 47% | 0.474 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -136.8 | 156.1 | 168.2 | 62.2 | -101.7 | 0 | 0 | 0 | 110.8 | L27 V29 V44 G45 V47 I61 | L27-F59 HydrophobicContact CD1-CD1 4.24Å; L27-F59 HydrophobicContact CD1-CE1 3.1Å; L27-F59 HydrophobicContact CD1-CZ 3.38Å; L27-F59 HydrophobicContact CD2-CE1 3.55Å; L27-F59 HydrophobicContact CD2-CZ 3.56Å; L27-F59 HydrophobicContact CG-CE1 3.91Å; L27-F59 HydrophobicContact CG-CZ 3.98Å; V29-F59 HydrophobicContact CG2-CE2 4.3Å; V29-F59 HydrophobicContact CG2-CZ 3.83Å; V44-F59 WeakPolarHBondContact CA-O 3.1Å; G45-F59 PolarHBondContact N-O 3.02Å; G45-F59 PolarHBondContact O-N 2.83Å; V47-F59 HydrophobicContact CG2-CD1 4.09Å; V47-F59 HydrophobicContact CG2-CE1 4.13Å; F59-I61 HydrophobicContact CD2-CG1 3.94Å; F59-I61 HydrophobicContact CE2-CD1 3.96Å; F59-I61 HydrophobicContact CE2-CG1 3.57Å |
| 60 | Q | 61.9 | Low | 68.3 | Low | 71 Ų | 71 | 99 Ų | 99 | 33% | 0.332 | 49% | 0.491 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.8 | 135.5 | 171.6 | -169.6 | 175.8 | -56.1 | 0 | 0 | 109.2 | I42 W58 | I42-Q60 HydrophobicContact CB-CG 4.16Å; I42-Q60 VanDerWaalsContact CD1-NE2 3.33Å; I42-Q60 HydrophobicContact CG2-CG 3.21Å; W58-Q60 HydrophobicContact CZ3-CB 4.09Å |
| 61 | I | 62.6 | Low | 68.7 | Low | 70 Ų | 70 | 101.3 Ų | 101.3 | 36% | 0.359 | 50% | 0.504 | S | S | . | . | trans | -92.7 | 108 | 169.1 | -53.2 | -177 | 0 | 0 | 0 | 107 | V29 I42 P43 F59 | V29-I61 HydrophobicContact CG1-CD1 3.56Å; V29-I61 HydrophobicContact CG2-CD1 4.43Å; I42-I61 WeakPolarHBondContact CG2-O 3.45Å; P43-I61 HydrophobicContact CB-CB 4.06Å; P43-I61 HydrophobicContact CB-CD1 4.13Å; P43-I61 HydrophobicContact CB-CG1 4.32Å; P43-I61 HydrophobicContact CG-CB 4.39Å; P43-I61 PolarHBondContact O-N 2.63Å; F59-I61 HydrophobicContact CD2-CG1 3.94Å; F59-I61 HydrophobicContact CE2-CD1 3.96Å; F59-I61 HydrophobicContact CE2-CG1 3.57Å | ||
| 62 | T | 62.7 | Low | 68.5 | Low | 180 Ų | 180 | 94.4 Ų | 94.4 | 100% | 1.104 | 48% | 0.48 | S | S | * | . | trans | -87.4 | 0 | 171.1 | 54.5 | 0 | 0 | 0 | 0 | 111.2 |
Retrieved 62 of 62 residues in 42.8 ms
(Link to these results)