| 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 | 42 | Very low | 43.9 | Very low | 224 Ų | 224 | 99.7 Ų | 99.7 | 100% | 1.103 | 56% | 0.562 | S | S | * | * | 0 | 126.5 | 0 | -83.1 | 168.7 | 152 | 0 | 0 | 107.1 | |||||
| 2 | M | 34.4 | Very low | 43.5 | Very low | 153 Ų | 153 | 98.5 Ų | 98.5 | 75% | 0.754 | 56% | 0.558 | S | S | * | * | trans | -82.2 | 120.4 | 176.2 | -69.9 | 179 | 87.4 | 0 | 0 | 108.5 | ||||
| 3 | S | 43.6 | Very low | 44 | Very low | 82 Ų | 82 | 96.9 Ų | 96.9 | 57% | 0.573 | 56% | 0.556 | S | S | * | * | trans | -87.8 | 113.5 | 174.9 | -52.8 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 4 | Q | 44.1 | Very low | 44.2 | Very low | 123 Ų | 123 | 98.9 Ų | 98.9 | 58% | 0.575 | 56% | 0.558 | S | S | * | * | P | Polyproline II helix | trans | -81 | 117.8 | 172.3 | -78.5 | 176.8 | -31 | 0 | 0 | 109 | ||
| 5 | L | 43.5 | Very low | 44.4 | Very low | 60 Ų | 60 | 98.3 Ų | 98.3 | 31% | 0.314 | 55% | 0.55 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.2 | 118 | 172.6 | -151.3 | 91.2 | 0 | 0 | 0 | 108.5 | I7 L19 F28 | L5-I7 HydrophobicContact CD2-CD1 4.09Å; L5-I7 HydrophobicContact CD2-CG1 3.88Å; L5-L19 HydrophobicContact CB-CD1 4.05Å; L5-L19 HydrophobicContact CD2-CD1 4.26Å; L5-F28 HydrophobicContact CD2-CE1 3.8Å; L5-F28 HydrophobicContact CD2-CZ 3.54Å |
| 6 | H | 44.8 | Very low | 44.8 | Very low | 111 Ų | 111 | 97 Ų | 97 | 51% | 0.514 | 54% | 0.538 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88.9 | 117.4 | 171.7 | -83.6 | 101.1 | 0 | 0 | 0 | 109 | M15 | H6-M15 VanDerWaalsContact NE2-CE 3.29Å; H6-M15 WeakPolarHBondContact NE2-CE 3.14Å; H6-M15 WeakPolarHBondContact NE2-CG 3.07Å |
| 7 | I | 49.6 | Very low | 44.7 | Very low | 11 Ų | 11 | 97.1 Ų | 97.1 | 6% | 0.056 | 53% | 0.534 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -110.8 | 123.5 | 173.4 | -51.1 | 167.6 | 0 | 0 | 0 | 107.4 | L5 Y9 E14 W36 | L5-I7 HydrophobicContact CD2-CD1 4.09Å; L5-I7 HydrophobicContact CD2-CG1 3.88Å; I7-Y9 HydrophobicContact CB-CE2 4.28Å; I7-Y9 HydrophobicContact CG2-CD2 4.17Å; I7-Y9 HydrophobicContact CG2-CE1 4.1Å; I7-Y9 HydrophobicContact CG2-CE2 3.41Å; I7-Y9 VanDerWaalsContact CG2-CE2 3.41Å; I7-Y9 WeakPolarHBondContact CG2-OH 3.34Å; I7-E14 PolarHBondContact N-O 3.27Å; I7-E14 PolarHBondContact O-N 3.36Å; I7-E14 VanDerWaalsContact O-O 3.12Å; I7-W36 HydrophobicContact CD1-CH2 3.89Å; I7-W36 HydrophobicContact CD1-CZ2 3.49Å; I7-W36 VanDerWaalsContact CD1-CZ2 3.49Å; I7-W36 HydrophobicContact CG1-CH2 4.39Å; I7-W36 HydrophobicContact CG1-CZ2 4.44Å |
| 8 | C | 42.6 | Very low | 44.9 | Very low | 61 Ų | 61 | 100.4 Ų | 100.4 | 41% | 0.412 | 54% | 0.544 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -114.7 | 128.8 | -178.4 | -61.2 | 0 | 0 | 0 | 0 | 110 | C13 | C8-C13 HydrophobicContact CB-CB 4.11Å; C8-C13 WeakPolarHBondContact CB-SG 3.43Å; C8-C13 WeakPolarHBondContact SG-CB 3.29Å; C8-C13 CovalentContact SG-SG 2.05Å; C8-C13 PolarHBondContact SG-SG 3.07Å |
| 9 | Y | 46.7 | Very low | 45.1 | Very low | 62 Ų | 62 | 97.1 Ų | 97.1 | 24% | 0.243 | 53% | 0.526 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -121.3 | 101.7 | 175.3 | -59.4 | -76.4 | 0 | 0 | 0 | 108.3 | I7 V12 L41 F42 | I7-Y9 HydrophobicContact CB-CE2 4.28Å; I7-Y9 HydrophobicContact CG2-CD2 4.17Å; I7-Y9 HydrophobicContact CG2-CE1 4.1Å; I7-Y9 HydrophobicContact CG2-CE2 3.41Å; I7-Y9 VanDerWaalsContact CG2-CE2 3.41Å; I7-Y9 WeakPolarHBondContact CG2-OH 3.34Å; Y9-V12 CarbonylContact C-O 3.57Å; Y9-V12 PolarHBondContact N-O 2.05Å; Y9-V12 PolarHBondContact O-N 3.25Å; Y9-V12 VanDerWaalsContact O-O 3.13Å; Y9-L41 HydrophobicContact CD1-CB 4.26Å; Y9-L41 HydrophobicContact CD1-CD2 4.32Å; Y9-L41 HydrophobicContact CE1-CB 3.63Å; Y9-L41 HydrophobicContact CE1-CD1 4.28Å; Y9-L41 HydrophobicContact CE1-CD2 4.17Å; Y9-L41 HydrophobicContact CE1-CG 4.24Å; Y9-F42 HydrophobicContact CD1-CE2 4.25Å; Y9-F42 HydrophobicContact CD1-CZ 4.33Å; Y9-F42 HydrophobicContact CE1-CD2 4.05Å; Y9-F42 AromaticContact CE1-CE2 3.4Å; Y9-F42 HydrophobicContact CE1-CE2 3.4Å; Y9-F42 AromaticContact CE1-CZ 3.86Å; Y9-F42 HydrophobicContact CE1-CZ 3.86Å |
| 10 | G | 50.7 | Low | 45.2 | Very low | 72 Ų | 72 | 96.4 Ų | 96.4 | 74% | 0.742 | 53% | 0.526 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 63.7 | -136.9 | -176.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | V12 | G10-V12 PolarHBondContact O-N 2.92Š|
| 11 | P | 40.8 | Very low | 45.5 | Very low | 138 Ų | 138 | 95.5 Ų | 95.5 | 90% | 0.896 | 53% | 0.527 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -76.3 | -0.2 | -179.6 | 32.3 | -34.3 | 0 | 0 | 0 | 113.8 | ||
| 12 | V | 39.4 | Very low | 45.8 | Very low | 85 Ų | 85 | 94.2 Ų | 94.2 | 52% | 0.515 | 52% | 0.516 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -112.5 | 122.2 | -176.8 | -173 | 0 | 0 | 0 | 0 | 109 | Y9 G10 E14 | Y9-V12 CarbonylContact C-O 3.57Å; Y9-V12 PolarHBondContact N-O 2.05Å; Y9-V12 PolarHBondContact O-N 3.25Å; Y9-V12 VanDerWaalsContact O-O 3.13Å; G10-V12 PolarHBondContact O-N 2.92Å; V12-E14 HydrophobicContact CG1-CG 4.41Å |
| 13 | C | 49.5 | Very low | 46.6 | Very low | 78 Ų | 78 | 89.5 Ų | 89.5 | 53% | 0.527 | 49% | 0.494 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.2 | 122.4 | 168.1 | -68 | 0 | 0 | 0 | 0 | 108.8 | C8 | C8-C13 HydrophobicContact CB-CB 4.11Å; C8-C13 WeakPolarHBondContact CB-SG 3.43Å; C8-C13 WeakPolarHBondContact SG-CB 3.29Å; C8-C13 CovalentContact SG-SG 2.05Å; C8-C13 PolarHBondContact SG-SG 3.07Å |
| 14 | E | 47.1 | Very low | 47.5 | Very low | 124 Ų | 124 | 90.1 Ų | 90.1 | 58% | 0.579 | 49% | 0.49 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -101.2 | 126.9 | 171.6 | -73.1 | -169.6 | 165.7 | 0 | 0 | 109.3 | I7 V12 Q16 | I7-E14 PolarHBondContact N-O 3.27Å; I7-E14 PolarHBondContact O-N 3.36Å; I7-E14 VanDerWaalsContact O-O 3.12Å; V12-E14 HydrophobicContact CG1-CG 4.41Å; E14-Q16 PolarHBondContact O-N 3.18Å |
| 15 | M | 47.5 | Very low | 48.2 | Very low | 90 Ų | 90 | 89.1 Ų | 89.1 | 44% | 0.443 | 50% | 0.495 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -90.8 | 100.7 | -179.1 | -158.4 | -176.5 | -41.4 | 0 | 0 | 109.2 | H6 H17 | H6-M15 VanDerWaalsContact NE2-CE 3.29Å; H6-M15 WeakPolarHBondContact NE2-CE 3.14Å; H6-M15 WeakPolarHBondContact NE2-CG 3.07Å; M15-H17 WeakPolarHBondContact CG-CE1 3.42Å; M15-H17 PolarHBondContact O-N 3.49Å; M15-H17 PolarHBondContact O-ND1 3.03Å; M15-H17 PolarHBondContact SD-CE1 2.95Å |
| 16 | Q | 50.2 | Low | 49.1 | Very low | 78 Ų | 78 | 89.5 Ų | 89.5 | 36% | 0.364 | 50% | 0.497 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -78.5 | 113.8 | 175.1 | -77.3 | -169.3 | -7.8 | 0 | 0 | 110.6 | E14 | E14-Q16 PolarHBondContact O-N 3.18Å |
| 17 | H | 43.7 | Very low | 49.8 | Very low | 99 Ų | 99 | 89.1 Ų | 89.1 | 46% | 0.458 | 50% | 0.495 | S | S | . | . | trans | -89.4 | 2.7 | -174.5 | -77.4 | 43.9 | 0 | 0 | 0 | 114.7 | M15 | M15-H17 WeakPolarHBondContact CG-CE1 3.42Å; M15-H17 PolarHBondContact O-N 3.49Å; M15-H17 PolarHBondContact O-ND1 3.03Å; M15-H17 PolarHBondContact SD-CE1 2.95Å | ||
| 18 | H | 47.6 | Very low | 50.6 | Low | 156 Ų | 156 | 89.8 Ų | 89.8 | 72% | 0.722 | 50% | 0.498 | S | S | * | . | trans | -137.5 | 64.6 | -174.6 | -66.6 | -63.8 | 0 | 0 | 0 | 111.6 | P20 | H18-P20 WeakPolarHBondContact O-CD 3.35Š| ||
| 19 | L | 49.8 | Very low | 51.6 | Low | 38 Ų | 38 | 89.1 Ų | 89.1 | 20% | 0.199 | 49% | 0.491 | C | S | . | . | trans | -77.7 | 120.1 | 151 | -109.2 | 81 | 0 | 0 | 0 | 107 | L5 S21 F28 | L5-L19 HydrophobicContact CB-CD1 4.05Å; L5-L19 HydrophobicContact CD2-CD1 4.26Å; L19-S21 PolarHBondContact O-N 3.34Å; L19-S21 VanDerWaalsContact O-N 3.16Å; L19-F28 HydrophobicContact CD1-CE2 3.67Å; L19-F28 HydrophobicContact CD1-CZ 4.02Å; L19-F28 HydrophobicContact CD2-CD2 3.62Å; L19-F28 HydrophobicContact CD2-CE2 3.39Å; L19-F28 HydrophobicContact CD2-CG 4.31Å; L19-F28 HydrophobicContact CD2-CZ 3.88Å; L19-F28 HydrophobicContact CG-CD2 4.12Å; L19-F28 HydrophobicContact CG-CE2 3.63Å; L19-F28 HydrophobicContact CG-CZ 4.33Å | ||
| 20 | P | 46.7 | Very low | 52.5 | Low | 82 Ų | 82 | 88.3 Ų | 88.3 | 53% | 0.532 | 49% | 0.491 | S | S | . | . | trans | -55.5 | 125.8 | 163.8 | 23.3 | -29.3 | 0 | 0 | 0 | 107 | H18 F22 | H18-P20 WeakPolarHBondContact O-CD 3.35Å; P20-F22 PolarHBondContact O-N 3.43Å | ||
| 21 | S | 50.3 | Low | 53 | Low | 78 Ų | 78 | 88.2 Ų | 88.2 | 55% | 0.545 | 48% | 0.475 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.6 | 10.9 | -162.8 | 28.2 | 0 | 0 | 0 | 0 | 116.3 | L19 | L19-S21 PolarHBondContact O-N 3.34Å; L19-S21 VanDerWaalsContact O-N 3.16Å |
| 22 | F | 49.6 | Very low | 54.1 | Low | 198 Ų | 198 | 84.4 Ų | 84.4 | 87% | 0.868 | 44% | 0.444 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -156.3 | 53.1 | -174.1 | -90.5 | -82.7 | 0 | 0 | 0 | 112.7 | P20 | P20-F22 PolarHBondContact O-N 3.43Š|
| 23 | L | 51.8 | Low | 55.3 | Low | 54 Ų | 54 | 81.3 Ų | 81.3 | 28% | 0.283 | 42% | 0.424 | S | S | . | . | S | Bend | trans | -83.1 | 132.1 | 147.4 | -74.4 | 168.9 | 0 | 0 | 0 | 106.2 | E27 F28 Y32 | L23-E27 HydrophobicContact CD2-CG 4.05Å; L23-F28 HydrophobicContact CB-CB 3.98Å; L23-F28 HydrophobicContact CD1-CD2 4.33Å; L23-Y32 HydrophobicContact CD1-CE2 4.1Å |
| 24 | D | 62.1 | Low | 56 | Low | 95 Ų | 95 | 83.9 Ų | 83.9 | 51% | 0.508 | 43% | 0.429 | S | S | . | . | trans | -45.5 | 133.1 | 166.3 | -175.3 | -53.7 | 0 | 0 | 0 | 107.3 | L26 E27 F28 | D24-L26 PolarHBondContact O-N 3.2Å; D24-L26 VanDerWaalsContact OD1-CB 3.23Å; D24-L26 WeakPolarHBondContact OD1-CB 3.38Å; D24-L26 PolarHBondContact OD1-N 3.44Å; D24-E27 HydrophobicContact CB-CB 3.96Å; D24-E27 WeakPolarHBondContact O-CA 3.44Å; D24-E27 PolarHBondContact O-N 2.87Å; D24-F28 PolarHBondContact O-N 3.28Å | ||
| 25 | P | 58.3 | Low | 56.8 | Low | 102 Ų | 102 | 80.9 Ų | 80.9 | 66% | 0.662 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -46.9 | -32.9 | 178.5 | -28.6 | 34.4 | 0 | 0 | 0 | 113.2 | V29 | P25-V29 WeakPolarHBondContact O-CB 3.49Å; P25-V29 WeakPolarHBondContact O-CG2 3.07Å; P25-V29 PolarHBondContact O-N 2.96Å; P25-V29 VanDerWaalsContact O-N 3.09Å |
| 26 | L | 62.5 | Low | 57.7 | Low | 68 Ų | 68 | 78.4 Ų | 78.4 | 36% | 0.356 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -71.7 | -43.8 | 176 | -163.7 | 69.5 | 0 | 0 | 0 | 112.5 | D24 V29 I30 | D24-L26 PolarHBondContact O-N 3.2Å; D24-L26 VanDerWaalsContact OD1-CB 3.23Å; D24-L26 WeakPolarHBondContact OD1-CB 3.38Å; D24-L26 PolarHBondContact OD1-N 3.44Å; L26-V29 PolarHBondContact O-N 3.28Å; L26-I30 HydrophobicContact CG-CD1 4.12Å; L26-I30 VanDerWaalsContact O-CG1 3.28Å; L26-I30 WeakPolarHBondContact O-CG1 3.45Å; L26-I30 PolarHBondContact O-N 3.47Å |
| 27 | E | 59.6 | Low | 58.4 | Low | 103 Ų | 103 | 77 Ų | 77 | 48% | 0.481 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -67.7 | -38.5 | 178.5 | -164.5 | 178.6 | -168.4 | 0 | 0 | 111.5 | L23 D24 I30 V31 | L23-E27 HydrophobicContact CD2-CG 4.05Å; D24-E27 HydrophobicContact CB-CB 3.96Å; D24-E27 WeakPolarHBondContact O-CA 3.44Å; D24-E27 PolarHBondContact O-N 2.87Å; E27-I30 PolarHBondContact O-N 3.41Å; E27-V31 WeakPolarHBondContact O-CB 3.2Å; E27-V31 WeakPolarHBondContact O-CG2 3.27Å; E27-V31 PolarHBondContact O-N 2.99Å; E27-V31 VanDerWaalsContact O-N 3.07Å |
| 28 | F | 65.4 | Low | 59.3 | Low | 25 Ų | 25 | 82.5 Ų | 82.5 | 11% | 0.11 | 42% | 0.419 | C | S | . | . | H | α-helix | trans | -59.6 | -49 | 170.9 | 178.7 | -99.1 | 0 | 0 | 0 | 110.9 | L5 L19 L23 D24 I30 Y32 W36 | L5-F28 HydrophobicContact CD2-CE1 3.8Å; L5-F28 HydrophobicContact CD2-CZ 3.54Å; L19-F28 HydrophobicContact CD1-CE2 3.67Å; L19-F28 HydrophobicContact CD1-CZ 4.02Å; L19-F28 HydrophobicContact CD2-CD2 3.62Å; L19-F28 HydrophobicContact CD2-CE2 3.39Å; L19-F28 HydrophobicContact CD2-CG 4.31Å; L19-F28 HydrophobicContact CD2-CZ 3.88Å; L19-F28 HydrophobicContact CG-CD2 4.12Å; L19-F28 HydrophobicContact CG-CE2 3.63Å; L19-F28 HydrophobicContact CG-CZ 4.33Å; L23-F28 HydrophobicContact CB-CB 3.98Å; L23-F28 HydrophobicContact CD1-CD2 4.33Å; D24-F28 PolarHBondContact O-N 3.28Å; F28-I30 PolarHBondContact O-N 2.86Å; F28-Y32 AromaticContact CD2-CD2 3.35Å; F28-Y32 HydrophobicContact CD2-CD2 3.35Å; F28-Y32 AromaticContact CD2-CE2 3.47Å; F28-Y32 HydrophobicContact CD2-CE2 3.47Å; F28-Y32 VanDerWaalsContact CD2-CE2 3.47Å; F28-Y32 HydrophobicContact CD2-CG 4.18Å; F28-Y32 HydrophobicContact CE2-CD1 4.17Å; F28-Y32 AromaticContact CE2-CD2 3.27Å; F28-Y32 HydrophobicContact CE2-CD2 3.27Å; F28-Y32 HydrophobicContact CE2-CE1 4.25Å; F28-Y32 AromaticContact CE2-CE2 3.37Å; F28-Y32 HydrophobicContact CE2-CE2 3.37Å; F28-Y32 AromaticContact CE2-CG 3.69Å; F28-Y32 HydrophobicContact CE2-CG 3.69Å; F28-Y32 AromaticContact CE2-CZ 3.87Å; F28-Y32 HydrophobicContact CG-CD2 4.13Å; F28-Y32 HydrophobicContact CZ-CD1 4.46Å; F28-Y32 HydrophobicContact CZ-CD2 4.02Å; F28-Y32 HydrophobicContact CZ-CE2 4.44Å; F28-Y32 HydrophobicContact CZ-CG 4.02Å; F28-Y32 VanDerWaalsContact O-CB 3.31Å; F28-Y32 WeakPolarHBondContact O-CB 3.38Å; F28-Y32 WeakPolarHBondContact O-CD2 3.34Å; F28-Y32 PolarHBondContact O-N 3.3Å; F28-W36 HydrophobicContact CE1-CH2 4.41Å; F28-W36 HydrophobicContact CZ-CH2 4.31Å; F28-W36 HydrophobicContact CZ-CZ2 4.44Å |
| 29 | V | 65.2 | Low | 60.1 | Low | 46 Ų | 46 | 81.9 Ų | 81.9 | 28% | 0.279 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -60.6 | -45.9 | 179.8 | 164.6 | 0 | 0 | 0 | 0 | 110.7 | P25 L26 L33 F52 | P25-V29 WeakPolarHBondContact O-CB 3.49Å; P25-V29 WeakPolarHBondContact O-CG2 3.07Å; P25-V29 PolarHBondContact O-N 2.96Å; P25-V29 VanDerWaalsContact O-N 3.09Å; L26-V29 PolarHBondContact O-N 3.28Å; V29-L33 HydrophobicContact CG1-CD1 3.33Å; V29-L33 HydrophobicContact CG1-CG 4.16Å; V29-L33 WeakPolarHBondContact O-CA 3.37Å; V29-L33 WeakPolarHBondContact O-CB 3.41Å; V29-L33 WeakPolarHBondContact O-CD1 3.34Å; V29-L33 WeakPolarHBondContact O-CG 3.27Å; V29-L33 PolarHBondContact O-N 3.38Å; V29-F52 HydrophobicContact CG1-CD1 3.76Å; V29-F52 HydrophobicContact CG1-CE1 3.65Å; V29-F52 HydrophobicContact CG1-CE2 4.44Å; V29-F52 HydrophobicContact CG1-CG 4.22Å; V29-F52 HydrophobicContact CG1-CZ 4.01Å |
| 30 | I | 63.8 | Low | 60.6 | Low | 45 Ų | 45 | 83.1 Ų | 83.1 | 23% | 0.231 | 44% | 0.436 | C | S | . | . | H | α-helix | trans | -65.2 | -53.7 | -177.9 | -68.4 | 165 | 0 | 0 | 0 | 111.7 | L26 E27 F28 Y32 L33 E34 | L26-I30 HydrophobicContact CG-CD1 4.12Å; L26-I30 VanDerWaalsContact O-CG1 3.28Å; L26-I30 WeakPolarHBondContact O-CG1 3.45Å; L26-I30 PolarHBondContact O-N 3.47Å; E27-I30 PolarHBondContact O-N 3.41Å; F28-I30 PolarHBondContact O-N 2.86Å; I30-Y32 PolarHBondContact O-N 2.99Å; I30-L33 PolarHBondContact O-N 2.93Å; I30-E34 PolarHBondContact O-N 3.01Å; I30-E34 VanDerWaalsContact O-N 3.1Å |
| 31 | V | 61.8 | Low | 61.3 | Low | 70 Ų | 70 | 82.5 Ų | 82.5 | 42% | 0.424 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -65.4 | -42.3 | -174.8 | 173.3 | 0 | 0 | 0 | 0 | 111.5 | E27 T35 | E27-V31 WeakPolarHBondContact O-CB 3.2Å; E27-V31 WeakPolarHBondContact O-CG2 3.27Å; E27-V31 PolarHBondContact O-N 2.99Å; E27-V31 VanDerWaalsContact O-N 3.07Å; V31-T35 PolarHBondContact O-N 2.82Å; V31-T35 PolarHBondContact O-OG1 3.32Å |
| 32 | Y | 63.7 | Low | 61.8 | Low | 58 Ų | 58 | 83 Ų | 83 | 23% | 0.227 | 42% | 0.42 | C | S | . | . | H | α-helix | trans | -80.2 | -33 | -178.9 | -75 | -93.9 | 0 | 0 | 0 | 112.3 | L23 F28 I30 T35 W36 | L23-Y32 HydrophobicContact CD1-CE2 4.1Å; F28-Y32 AromaticContact CD2-CD2 3.35Å; F28-Y32 HydrophobicContact CD2-CD2 3.35Å; F28-Y32 AromaticContact CD2-CE2 3.47Å; F28-Y32 HydrophobicContact CD2-CE2 3.47Å; F28-Y32 VanDerWaalsContact CD2-CE2 3.47Å; F28-Y32 HydrophobicContact CD2-CG 4.18Å; F28-Y32 HydrophobicContact CE2-CD1 4.17Å; F28-Y32 AromaticContact CE2-CD2 3.27Å; F28-Y32 HydrophobicContact CE2-CD2 3.27Å; F28-Y32 HydrophobicContact CE2-CE1 4.25Å; F28-Y32 AromaticContact CE2-CE2 3.37Å; F28-Y32 HydrophobicContact CE2-CE2 3.37Å; F28-Y32 AromaticContact CE2-CG 3.69Å; F28-Y32 HydrophobicContact CE2-CG 3.69Å; F28-Y32 AromaticContact CE2-CZ 3.87Å; F28-Y32 HydrophobicContact CG-CD2 4.13Å; F28-Y32 HydrophobicContact CZ-CD1 4.46Å; F28-Y32 HydrophobicContact CZ-CD2 4.02Å; F28-Y32 HydrophobicContact CZ-CE2 4.44Å; F28-Y32 HydrophobicContact CZ-CG 4.02Å; F28-Y32 VanDerWaalsContact O-CB 3.31Å; F28-Y32 WeakPolarHBondContact O-CB 3.38Å; F28-Y32 WeakPolarHBondContact O-CD2 3.34Å; F28-Y32 PolarHBondContact O-N 3.3Å; I30-Y32 PolarHBondContact O-N 2.99Å; Y32-T35 PolarHBondContact O-N 3.17Å; Y32-W36 AromaticContact CD1-CZ2 3.91Å; Y32-W36 HydrophobicContact CD1-CZ2 3.91Å; Y32-W36 AromaticContact CD1-NE1 3.79Å; Y32-W36 HydrophobicContact CG-CZ2 4.22Å; Y32-W36 VanDerWaalsContact O-CB 3.27Å; Y32-W36 WeakPolarHBondContact O-CB 3.33Å; Y32-W36 VanDerWaalsContact O-CD1 3.31Å; Y32-W36 PolarHBondContact O-N 3.47Å |
| 33 | L | 65.8 | Low | 62.1 | Low | 21 Ų | 21 | 81.6 Ų | 81.6 | 11% | 0.11 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -59.9 | -50.3 | 172.5 | -85.7 | 170.3 | 0 | 0 | 0 | 111.1 | V29 I30 T35 W36 V37 L44 F52 | V29-L33 HydrophobicContact CG1-CD1 3.33Å; V29-L33 HydrophobicContact CG1-CG 4.16Å; V29-L33 WeakPolarHBondContact O-CA 3.37Å; V29-L33 WeakPolarHBondContact O-CB 3.41Å; V29-L33 WeakPolarHBondContact O-CD1 3.34Å; V29-L33 WeakPolarHBondContact O-CG 3.27Å; V29-L33 PolarHBondContact O-N 3.38Å; I30-L33 PolarHBondContact O-N 2.93Å; L33-T35 VanDerWaalsContact C-N 3.26Å; L33-T35 PolarHBondContact O-N 2.85Å; L33-W36 PolarHBondContact O-N 3.3Å; L33-V37 WeakPolarHBondContact O-CB 3.11Å; L33-V37 WeakPolarHBondContact O-CG2 3.35Å; L33-V37 PolarHBondContact O-N 3.09Å; L33-L44 HydrophobicContact CD2-CD1 3.31Å; L33-L44 HydrophobicContact CD2-CD2 3.76Å; L33-L44 HydrophobicContact CD2-CG 4.17Å; L33-F52 HydrophobicContact CD1-CD2 3.41Å; L33-F52 VanDerWaalsContact CD1-CD2 3.41Å; L33-F52 HydrophobicContact CD1-CE2 3.56Å; L33-F52 HydrophobicContact CD1-CG 3.98Å; L33-F52 HydrophobicContact CD1-CZ 4.23Å |
| 34 | E | 62.8 | Low | 62.4 | Low | 132 Ų | 132 | 80.4 Ų | 80.4 | 62% | 0.617 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -59.1 | -43 | -178.9 | -165.6 | 178.4 | -167.1 | 0 | 0 | 110.9 | I30 Y38 | I30-E34 PolarHBondContact O-N 3.01Å; I30-E34 VanDerWaalsContact O-N 3.1Å; E34-Y38 WeakPolarHBondContact O-CB 3.48Å; E34-Y38 PolarHBondContact O-N 3.17Å |
| 35 | T | 65.1 | Low | 62.3 | Low | 60 Ų | 60 | 84.8 Ų | 84.8 | 37% | 0.368 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -65.2 | -41.8 | 176.9 | -58 | 0 | 0 | 0 | 0 | 112.6 | V31 Y32 L33 K39 | V31-T35 PolarHBondContact O-N 2.82Å; V31-T35 PolarHBondContact O-OG1 3.32Å; Y32-T35 PolarHBondContact O-N 3.17Å; L33-T35 VanDerWaalsContact C-N 3.26Å; L33-T35 PolarHBondContact O-N 2.85Å; T35-K39 HydrophobicContact CG2-CD 4.33Å; T35-K39 WeakPolarHBondContact O-CB 3.49Å; T35-K39 WeakPolarHBondContact O-CG 3.08Å; T35-K39 PolarHBondContact O-N 3.04Å |
| 36 | W | 66.4 | Low | 62.3 | Low | 39 Ų | 39 | 84.2 Ų | 84.2 | 15% | 0.148 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -72.9 | -35 | -178.7 | -64.4 | -11.3 | 0 | 0 | 0 | 112.2 | I7 F28 Y32 L33 K39 G40 L41 F42 | I7-W36 HydrophobicContact CD1-CH2 3.89Å; I7-W36 HydrophobicContact CD1-CZ2 3.49Å; I7-W36 VanDerWaalsContact CD1-CZ2 3.49Å; I7-W36 HydrophobicContact CG1-CH2 4.39Å; I7-W36 HydrophobicContact CG1-CZ2 4.44Å; F28-W36 HydrophobicContact CE1-CH2 4.41Å; F28-W36 HydrophobicContact CZ-CH2 4.31Å; F28-W36 HydrophobicContact CZ-CZ2 4.44Å; Y32-W36 AromaticContact CD1-CZ2 3.91Å; Y32-W36 HydrophobicContact CD1-CZ2 3.91Å; Y32-W36 AromaticContact CD1-NE1 3.79Å; Y32-W36 HydrophobicContact CG-CZ2 4.22Å; Y32-W36 VanDerWaalsContact O-CB 3.27Å; Y32-W36 WeakPolarHBondContact O-CB 3.33Å; Y32-W36 VanDerWaalsContact O-CD1 3.31Å; Y32-W36 PolarHBondContact O-N 3.47Å; L33-W36 PolarHBondContact O-N 3.3Å; W36-K39 PolarHBondContact O-N 3.32Å; W36-G40 PolarHBondContact O-N 3.4Å; W36-L41 HydrophobicContact CB-CB 4.22Å; W36-L41 HydrophobicContact CB-CD1 4.5Å; W36-L41 HydrophobicContact CG-CD1 4.41Å; W36-L41 WeakPolarHBondContact O-CB 3.37Å; W36-L41 PolarHBondContact O-N 3.48Å; W36-F42 HydrophobicContact CB-CD2 4.08Å; W36-F42 HydrophobicContact CD2-CD2 4.42Å; W36-F42 HydrophobicContact CD2-CE2 4.31Å; W36-F42 AromaticContact CE3-CD2 3.94Å; W36-F42 HydrophobicContact CE3-CD2 3.94Å; W36-F42 AromaticContact CE3-CE2 3.72Å; W36-F42 HydrophobicContact CE3-CE2 3.72Å; W36-F42 HydrophobicContact CZ3-CE2 4.24Å |
| 37 | V | 64.7 | Low | 62.1 | Low | 49 Ų | 49 | 87 Ų | 87 | 30% | 0.297 | 43% | 0.433 | S | S | . | . | H | α-helix | trans | -65.7 | -47.6 | 171.8 | 173.4 | 0 | 0 | 0 | 0 | 110.6 | L33 K39 G40 L44 | L33-V37 WeakPolarHBondContact O-CB 3.11Å; L33-V37 WeakPolarHBondContact O-CG2 3.35Å; L33-V37 PolarHBondContact O-N 3.09Å; V37-K39 PolarHBondContact O-N 3.28Å; V37-G40 PolarHBondContact O-N 3.31Å; V37-L44 HydrophobicContact CG2-CB 3.58Å; V37-L44 HydrophobicContact CG2-CD1 3.85Å; V37-L44 HydrophobicContact CG2-CD2 4.3Å; V37-L44 HydrophobicContact CG2-CG 4.11Å |
| 38 | Y | 62.7 | Low | 62.2 | Low | 213 Ų | 213 | 85.9 Ų | 85.9 | 84% | 0.835 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -60.2 | -35.6 | 177.5 | -174.9 | -96.6 | 0 | 0 | 0 | 112.6 | E34 G40 | E34-Y38 WeakPolarHBondContact O-CB 3.48Å; E34-Y38 PolarHBondContact O-N 3.17Å; Y38-G40 VanDerWaalsContact C-N 3.26Å; Y38-G40 PolarHBondContact O-N 3.03Å |
| 39 | K | 63.1 | Low | 62.2 | Low | 144 Ų | 144 | 87.3 Ų | 87.3 | 63% | 0.626 | 44% | 0.438 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.9 | -0.2 | 176 | -71 | -174.5 | 176.3 | -171.7 | 0 | 114.1 | T35 W36 V37 L41 | T35-K39 HydrophobicContact CG2-CD 4.33Å; T35-K39 WeakPolarHBondContact O-CB 3.49Å; T35-K39 WeakPolarHBondContact O-CG 3.08Å; T35-K39 PolarHBondContact O-N 3.04Å; W36-K39 PolarHBondContact O-N 3.32Å; V37-K39 PolarHBondContact O-N 3.28Å; K39-L41 HydrophobicContact CB-CD1 3.89Å; K39-L41 HydrophobicContact CB-CG 3.82Å; K39-L41 HydrophobicContact CD-CD1 4.23Å; K39-L41 PolarHBondContact O-N 2.81Å |
| 40 | G | 61.7 | Low | 62.1 | Low | 63 Ų | 63 | 89.8 Ų | 89.8 | 65% | 0.649 | 45% | 0.45 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 64.7 | 21.4 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | W36 V37 Y38 F42 | W36-G40 PolarHBondContact O-N 3.4Å; V37-G40 PolarHBondContact O-N 3.31Å; Y38-G40 VanDerWaalsContact C-N 3.26Å; Y38-G40 PolarHBondContact O-N 3.03Å; G40-F42 VanDerWaalsContact C-N 3.33Å |
| 41 | L | 61.7 | Low | 62.2 | Low | 70 Ų | 70 | 94 Ų | 94 | 37% | 0.366 | 46% | 0.464 | S | S | . | . | S | Bend | trans | -77.3 | -23.5 | -178 | -68.2 | 173.4 | 0 | 0 | 0 | 112.2 | Y9 W36 K39 | Y9-L41 HydrophobicContact CD1-CB 4.26Å; Y9-L41 HydrophobicContact CD1-CD2 4.32Å; Y9-L41 HydrophobicContact CE1-CB 3.63Å; Y9-L41 HydrophobicContact CE1-CD1 4.28Å; Y9-L41 HydrophobicContact CE1-CD2 4.17Å; Y9-L41 HydrophobicContact CE1-CG 4.24Å; W36-L41 HydrophobicContact CB-CB 4.22Å; W36-L41 HydrophobicContact CB-CD1 4.5Å; W36-L41 HydrophobicContact CG-CD1 4.41Å; W36-L41 WeakPolarHBondContact O-CB 3.37Å; W36-L41 PolarHBondContact O-N 3.48Å; K39-L41 HydrophobicContact CB-CD1 3.89Å; K39-L41 HydrophobicContact CB-CG 3.82Å; K39-L41 HydrophobicContact CD-CD1 4.23Å; K39-L41 PolarHBondContact O-N 2.81Å |
| 42 | F | 59.6 | Low | 62.2 | Low | 87 Ų | 87 | 93 Ų | 93 | 38% | 0.382 | 45% | 0.453 | S | S | . | . | S | Bend | trans | -138.3 | 136.3 | 170.7 | -72.7 | -82.1 | 0 | 0 | 0 | 109.7 | Y9 W36 G40 L44 | Y9-F42 HydrophobicContact CD1-CE2 4.25Å; Y9-F42 HydrophobicContact CD1-CZ 4.33Å; Y9-F42 HydrophobicContact CE1-CD2 4.05Å; Y9-F42 AromaticContact CE1-CE2 3.4Å; Y9-F42 HydrophobicContact CE1-CE2 3.4Å; Y9-F42 AromaticContact CE1-CZ 3.86Å; Y9-F42 HydrophobicContact CE1-CZ 3.86Å; W36-F42 HydrophobicContact CB-CD2 4.08Å; W36-F42 HydrophobicContact CD2-CD2 4.42Å; W36-F42 HydrophobicContact CD2-CE2 4.31Å; W36-F42 AromaticContact CE3-CD2 3.94Å; W36-F42 HydrophobicContact CE3-CD2 3.94Å; W36-F42 AromaticContact CE3-CE2 3.72Å; W36-F42 HydrophobicContact CE3-CE2 3.72Å; W36-F42 HydrophobicContact CZ3-CE2 4.24Å; G40-F42 VanDerWaalsContact C-N 3.33Å; F42-L44 HydrophobicContact CB-CD1 4.05Å; F42-L44 PolarHBondContact O-N 2.99Å |
| 43 | D | 56.1 | Low | 62.2 | Low | 170 Ų | 170 | 94.9 Ų | 94.9 | 91% | 0.909 | 47% | 0.467 | S | S | * | . | trans | -81.6 | 77.7 | 169.3 | -136.9 | -5.6 | 0 | 0 | 0 | 107.5 | R45 | D43-R45 PolarHBondContact O-N 2.85Š| ||
| 44 | L | 59.1 | Low | 62.1 | Low | 29 Ų | 29 | 99.9 Ų | 99.9 | 15% | 0.152 | 49% | 0.494 | C | S | . | . | trans | -71.8 | 118.3 | 172.9 | -115.1 | 90.2 | 0 | 0 | 0 | 108.1 | L33 V37 F42 L48 L49 | L33-L44 HydrophobicContact CD2-CD1 3.31Å; L33-L44 HydrophobicContact CD2-CD2 3.76Å; L33-L44 HydrophobicContact CD2-CG 4.17Å; V37-L44 HydrophobicContact CG2-CB 3.58Å; V37-L44 HydrophobicContact CG2-CD1 3.85Å; V37-L44 HydrophobicContact CG2-CD2 4.3Å; V37-L44 HydrophobicContact CG2-CG 4.11Å; F42-L44 HydrophobicContact CB-CD1 4.05Å; F42-L44 PolarHBondContact O-N 2.99Å; L44-L48 HydrophobicContact CD2-CB 4.01Å; L44-L48 HydrophobicContact CD2-CD2 4.1Å; L44-L48 HydrophobicContact CG-CB 4.44Å; L44-L48 HydrophobicContact CG-CD2 4.19Å; L44-L49 HydrophobicContact CD2-CB 4.27Å; L44-L49 HydrophobicContact CD2-CD1 4.44Å | ||
| 45 | R | 60.3 | Low | 61.8 | Low | 186 Ų | 186 | 97.9 Ų | 97.9 | 70% | 0.702 | 49% | 0.486 | S | S | * | . | trans | -53.2 | 126.4 | 164.2 | -71.4 | -168 | -66.2 | 174 | -0.8 | 108.6 | D43 E47 L48 | D43-R45 PolarHBondContact O-N 2.85Å; R45-E47 WeakPolarHBondContact CB-OE2 2.98Å; R45-E47 PolarHBondContact O-N 3.47Å; R45-L48 WeakPolarHBondContact O-CB 3.33Å; R45-L48 PolarHBondContact O-N 3.46Å | ||
| 46 | P | 58.2 | Low | 61.2 | Low | 90 Ų | 90 | 105.5 Ų | 105.5 | 58% | 0.584 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -50.6 | -30 | -175.7 | -28.4 | 34 | 0 | 0 | 0 | 114.2 | L48 L49 L50 | P46-L48 VanDerWaalsContact C-N 3.29Å; P46-L48 PolarHBondContact O-N 3.06Å; P46-L49 WeakPolarHBondContact O-CB 3.31Å; P46-L49 PolarHBondContact O-N 3.1Å; P46-L50 PolarHBondContact O-N 3.07Å |
| 47 | E | 57.7 | Low | 61 | Low | 128 Ų | 128 | 108.9 Ų | 108.9 | 60% | 0.598 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -63.8 | -32.5 | 177.4 | -56.9 | 86.3 | 167.8 | 0 | 0 | 112.8 | R45 Y51 | R45-E47 WeakPolarHBondContact CB-OE2 2.98Å; R45-E47 PolarHBondContact O-N 3.47Å; E47-Y51 WeakPolarHBondContact O-CB 3.31Å; E47-Y51 PolarHBondContact O-N 3.47Å |
| 48 | L | 62.2 | Low | 60.8 | Low | 78 Ų | 78 | 112 Ų | 112 | 41% | 0.408 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -74.6 | -37.3 | 177.8 | -146.4 | 86.1 | 0 | 0 | 0 | 110.9 | L44 R45 P46 Y51 F52 | L44-L48 HydrophobicContact CD2-CB 4.01Å; L44-L48 HydrophobicContact CD2-CD2 4.1Å; L44-L48 HydrophobicContact CG-CB 4.44Å; L44-L48 HydrophobicContact CG-CD2 4.19Å; R45-L48 WeakPolarHBondContact O-CB 3.33Å; R45-L48 PolarHBondContact O-N 3.46Å; P46-L48 VanDerWaalsContact C-N 3.29Å; P46-L48 PolarHBondContact O-N 3.06Å; L48-Y51 WeakPolarHBondContact O-CB 3.23Å; L48-Y51 PolarHBondContact O-N 3.17Å; L48-F52 HydrophobicContact CD2-CE2 4.03Å; L48-F52 HydrophobicContact CG-CE2 4.07Å; L48-F52 WeakPolarHBondContact O-CD2 3.37Å; L48-F52 PolarHBondContact O-N 2.92Å; L48-F52 VanDerWaalsContact O-N 3.17Å |
| 49 | L | 64.5 | Low | 60.6 | Low | 56 Ų | 56 | 106.4 Ų | 106.4 | 29% | 0.293 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -63.4 | -46 | 173.6 | -170 | 78.3 | 0 | 0 | 0 | 110.3 | L44 P46 Y51 F52 L53 | L44-L49 HydrophobicContact CD2-CB 4.27Å; L44-L49 HydrophobicContact CD2-CD1 4.44Å; P46-L49 WeakPolarHBondContact O-CB 3.31Å; P46-L49 PolarHBondContact O-N 3.1Å; L49-Y51 VanDerWaalsContact C-N 3.3Å; L49-Y51 PolarHBondContact O-N 2.84Å; L49-F52 PolarHBondContact O-N 3.28Å; L49-L53 HydrophobicContact CD2-CD1 4.46Å; L49-L53 HydrophobicContact CG-CD1 4.14Å; L49-L53 WeakPolarHBondContact O-CG 3.45Å; L49-L53 PolarHBondContact O-N 3.46Å |
| 50 | L | 64 | Low | 60.5 | Low | 98 Ų | 98 | 104.2 Ų | 104.2 | 51% | 0.513 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -59.4 | -39.2 | 174.4 | -79.4 | 162.8 | 0 | 0 | 0 | 112.4 | P46 L53 N54 | P46-L50 PolarHBondContact O-N 3.07Å; L50-L53 PolarHBondContact O-N 2.87Å; L50-N54 VanDerWaalsContact O-CB 3.31Å; L50-N54 WeakPolarHBondContact O-CB 3.49Å; L50-N54 VanDerWaalsContact O-CG 3.31Å; L50-N54 PolarHBondContact O-N 3.32Å; L50-N54 PolarHBondContact O-ND2 3.42Å |
| 51 | Y | 65.3 | Low | 60.4 | Low | 134 Ų | 134 | 106.8 Ų | 106.8 | 53% | 0.525 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.2 | -46.9 | 176.4 | 174.9 | -101.8 | 0 | 0 | 0 | 112 | E47 L48 L49 N54 M55 | E47-Y51 WeakPolarHBondContact O-CB 3.31Å; E47-Y51 PolarHBondContact O-N 3.47Å; L48-Y51 WeakPolarHBondContact O-CB 3.23Å; L48-Y51 PolarHBondContact O-N 3.17Å; L49-Y51 VanDerWaalsContact C-N 3.3Å; L49-Y51 PolarHBondContact O-N 2.84Å; Y51-N54 PolarHBondContact O-N 2.96Å; Y51-M55 HydrophobicContact CE1-CE 3.57Å; Y51-M55 HydrophobicContact CE1-CG 4.36Å; Y51-M55 HydrophobicContact CE1-SD 4.16Å; Y51-M55 HydrophobicContact CE2-CG 4.37Å; Y51-M55 HydrophobicContact CE2-SD 4.18Å; Y51-M55 VanDerWaalsContact O-CG 3.27Å; Y51-M55 WeakPolarHBondContact O-CG 3.48Å; Y51-M55 PolarHBondContact O-N 2.86Å; Y51-M55 WeakPolarHBondContact OH-CE 3.28Å; Y51-M55 PolarHBondContact OH-SD 2.87Å |
| 52 | F | 61.3 | Low | 60.3 | Low | 48 Ų | 48 | 109.2 Ų | 109.2 | 21% | 0.211 | 53% | 0.528 | C | S | . | . | H | α-helix | trans | -67 | -38.9 | 178 | -73 | -64.8 | 0 | 0 | 0 | 112.9 | V29 L33 L48 L49 N54 M55 | V29-F52 HydrophobicContact CG1-CD1 3.76Å; V29-F52 HydrophobicContact CG1-CE1 3.65Å; V29-F52 HydrophobicContact CG1-CE2 4.44Å; V29-F52 HydrophobicContact CG1-CG 4.22Å; V29-F52 HydrophobicContact CG1-CZ 4.01Å; L33-F52 HydrophobicContact CD1-CD2 3.41Å; L33-F52 VanDerWaalsContact CD1-CD2 3.41Å; L33-F52 HydrophobicContact CD1-CE2 3.56Å; L33-F52 HydrophobicContact CD1-CG 3.98Å; L33-F52 HydrophobicContact CD1-CZ 4.23Å; L48-F52 HydrophobicContact CD2-CE2 4.03Å; L48-F52 HydrophobicContact CG-CE2 4.07Å; L48-F52 WeakPolarHBondContact O-CD2 3.37Å; L48-F52 PolarHBondContact O-N 2.92Å; L48-F52 VanDerWaalsContact O-N 3.17Å; L49-F52 PolarHBondContact O-N 3.28Å; F52-N54 VanDerWaalsContact C-N 3.27Å; F52-N54 PolarHBondContact O-N 3.39Å; F52-M55 PolarHBondContact O-N 2.76Å |
| 53 | L | 63.3 | Low | 60.4 | Low | 98 Ų | 98 | 110.8 Ų | 110.8 | 51% | 0.513 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -66.4 | -27.6 | 176.1 | -70.5 | 171.2 | 0 | 0 | 0 | 113.1 | L49 L50 | L49-L53 HydrophobicContact CD2-CD1 4.46Å; L49-L53 HydrophobicContact CG-CD1 4.14Å; L49-L53 WeakPolarHBondContact O-CG 3.45Å; L49-L53 PolarHBondContact O-N 3.46Å; L50-L53 PolarHBondContact O-N 2.87Å |
| 54 | N | 64.2 | Low | 60.7 | Low | 125 Ų | 125 | 106.2 Ų | 106.2 | 67% | 0.668 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -90.2 | -6.4 | -179.4 | -77.5 | -51 | 0 | 0 | 0 | 114.3 | L50 Y51 F52 H56 | L50-N54 VanDerWaalsContact O-CB 3.31Å; L50-N54 WeakPolarHBondContact O-CB 3.49Å; L50-N54 VanDerWaalsContact O-CG 3.31Å; L50-N54 PolarHBondContact O-N 3.32Å; L50-N54 PolarHBondContact O-ND2 3.42Å; Y51-N54 PolarHBondContact O-N 2.96Å; F52-N54 VanDerWaalsContact C-N 3.27Å; F52-N54 PolarHBondContact O-N 3.39Å; N54-H56 PolarHBondContact O-N 3.16Å |
| 55 | M | 57.6 | Low | 60.9 | Low | 91 Ų | 91 | 112.7 Ų | 112.7 | 45% | 0.448 | 54% | 0.54 | S | S | . | . | trans | -81.3 | 21.4 | 177 | -71.9 | -120.3 | -84.2 | 0 | 0 | 113.1 | Y51 F52 | Y51-M55 HydrophobicContact CE1-CE 3.57Å; Y51-M55 HydrophobicContact CE1-CG 4.36Å; Y51-M55 HydrophobicContact CE1-SD 4.16Å; Y51-M55 HydrophobicContact CE2-CG 4.37Å; Y51-M55 HydrophobicContact CE2-SD 4.18Å; Y51-M55 VanDerWaalsContact O-CG 3.27Å; Y51-M55 WeakPolarHBondContact O-CG 3.48Å; Y51-M55 PolarHBondContact O-N 2.86Å; Y51-M55 WeakPolarHBondContact OH-CE 3.28Å; Y51-M55 PolarHBondContact OH-SD 2.87Å; F52-M55 PolarHBondContact O-N 2.76Å | ||
| 56 | H | 52.1 | Low | 60.9 | Low | 220 Ų | 220 | 106 Ų | 106 | 100% | 1.019 | 53% | 0.526 | S | S | * | . | trans | -92.4 | 0 | -173 | -141.3 | -44.4 | 0 | 0 | 0 | 113.7 | N54 | N54-H56 PolarHBondContact O-N 3.16Š|
Retrieved 56 of 56 residues in 181.7 ms
(Link to these results)