| 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 | 46.5 | Very low | 51.8 | Low | 212 Ų | 212 | 139.1 Ų | 139.1 | 100% | 1.044 | 67% | 0.667 | S | S | * | * | 0 | -22.7 | 0 | -74.5 | -156.4 | -97.8 | 0 | 0 | 114.7 | |||||
| 2 | R | 51.7 | Low | 51.5 | Low | 225 Ų | 225 | 138 Ų | 138 | 85% | 0.849 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -75.8 | -31.5 | 177.1 | -68.4 | 168.7 | 63.9 | 152.8 | -1.7 | 112.5 | K5 A6 | R2-K5 PolarHBondContact O-N 3.36Å; R2-A6 PolarHBondContact O-N 3.28Å |
| 3 | D | 45.5 | Very low | 51.5 | Low | 123 Ų | 123 | 139.3 Ų | 139.3 | 66% | 0.658 | 67% | 0.667 | S | S | * | * | H | α-helix | trans | -74.1 | -37.6 | -178.6 | -51.1 | -76.7 | 0 | 0 | 0 | 112.5 | K5 A6 V7 | D3-K5 PolarHBondContact O-N 2.84Å; D3-A6 WeakPolarHBondContact O-CB 3.38Å; D3-A6 PolarHBondContact O-N 3.49Å; D3-V7 WeakPolarHBondContact O-CG2 3.43Å; D3-V7 PolarHBondContact O-N 2.88Å |
| 4 | L | 52.5 | Low | 51.1 | Low | 144 Ų | 144 | 137.6 Ų | 137.6 | 75% | 0.754 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -61.3 | -34.6 | 176.3 | -140.2 | 78.3 | 0 | 0 | 0 | 112.2 | G8 | L4-G8 PolarHBondContact O-N 3.01Å |
| 5 | K | 52.3 | Low | 51 | Low | 164 Ų | 164 | 136.1 Ų | 136.1 | 71% | 0.713 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -72.2 | -30.8 | 174.2 | -106.3 | 177.6 | 179.2 | 173.1 | 0 | 112.7 | R2 D3 R9 | R2-K5 PolarHBondContact O-N 3.36Å; D3-K5 PolarHBondContact O-N 2.84Å; K5-R9 PolarHBondContact O-N 2.86Å; K5-R9 VanDerWaalsContact O-N 3.13Å |
| 6 | A | 55 | Low | 50.6 | Low | 47 Ų | 47 | 140.1 Ų | 140.1 | 39% | 0.388 | 67% | 0.673 | S | S | . | * | H | α-helix | trans | -73.4 | -42.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111 | R2 D3 R9 K10 | R2-A6 PolarHBondContact O-N 3.28Å; D3-A6 WeakPolarHBondContact O-CB 3.38Å; D3-A6 PolarHBondContact O-N 3.49Å; A6-R9 PolarHBondContact O-N 3.45Å; A6-K10 PolarHBondContact O-N 2.93Å; A6-K10 VanDerWaalsContact O-N 3.16Å |
| 7 | V | 53.7 | Low | 50.2 | Low | 91 Ų | 91 | 136.4 Ų | 136.4 | 55% | 0.552 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -63.8 | -47 | 173.3 | 176.9 | 0 | 0 | 0 | 0 | 110.4 | D3 R9 K10 F11 | D3-V7 WeakPolarHBondContact O-CG2 3.43Å; D3-V7 PolarHBondContact O-N 2.88Å; V7-R9 VanDerWaalsContact C-N 3.32Å; V7-R9 PolarHBondContact O-N 3.08Å; V7-K10 PolarHBondContact O-N 3.28Å; V7-K10 VanDerWaalsContact O-N 3.12Å; V7-F11 WeakPolarHBondContact O-CB 3.4Å; V7-F11 PolarHBondContact O-N 3.13Å |
| 8 | G | 55.6 | Low | 50.1 | Low | 35 Ų | 35 | 142.6 Ų | 142.6 | 36% | 0.361 | 68% | 0.678 | S | S | . | * | H | α-helix | trans | -61.8 | -34.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114 | L4 F11 M12 | L4-G8 PolarHBondContact O-N 3.01Å; G8-F11 PolarHBondContact O-N 3.32Å; G8-M12 WeakPolarHBondContact O-CB 3.43Å; G8-M12 PolarHBondContact O-N 3.45Å |
| 9 | R | 52.9 | Low | 50.3 | Low | 193 Ų | 193 | 143.8 Ų | 143.8 | 73% | 0.728 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -70.3 | -38 | 173 | -84.4 | -167.1 | -68.9 | -158.8 | 1.1 | 113 | K5 A6 V7 F11 H13 | K5-R9 PolarHBondContact O-N 2.86Å; K5-R9 VanDerWaalsContact O-N 3.13Å; A6-R9 PolarHBondContact O-N 3.45Å; V7-R9 VanDerWaalsContact C-N 3.32Å; V7-R9 PolarHBondContact O-N 3.08Å; R9-F11 VanDerWaalsContact C-N 3.35Å; R9-H13 PolarHBondContact O-N 3.39Å |
| 10 | K | 53.4 | Low | 50 | Low | 164 Ų | 164 | 139.8 Ų | 139.8 | 71% | 0.713 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -66.7 | -40.1 | 172 | -72 | -169.3 | 175.9 | -171.5 | 0 | 111 | A6 V7 M12 H13 V14 | A6-K10 PolarHBondContact O-N 2.93Å; A6-K10 VanDerWaalsContact O-N 3.16Å; V7-K10 PolarHBondContact O-N 3.28Å; V7-K10 VanDerWaalsContact O-N 3.12Å; K10-M12 PolarHBondContact O-N 2.83Å; K10-H13 WeakPolarHBondContact O-CB 3.43Å; K10-H13 PolarHBondContact O-N 3.12Å; K10-V14 WeakPolarHBondContact O-CG2 3.4Å; K10-V14 PolarHBondContact O-N 3.16Å; K10-V14 VanDerWaalsContact O-N 3.09Å |
| 11 | F | 50.8 | Low | 50.1 | Low | 132 Ų | 132 | 138 Ų | 138 | 58% | 0.579 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -63.1 | -40.6 | 176.5 | -148.1 | -94.8 | 0 | 0 | 0 | 111.9 | V7 G8 R9 H13 V14 L15 | V7-F11 WeakPolarHBondContact O-CB 3.4Å; V7-F11 PolarHBondContact O-N 3.13Å; G8-F11 PolarHBondContact O-N 3.32Å; R9-F11 VanDerWaalsContact C-N 3.35Å; F11-H13 VanDerWaalsContact C-N 3.33Å; F11-H13 PolarHBondContact O-N 2.8Å; F11-V14 CarbonylContact O-C 3.57Å; F11-V14 PolarHBondContact O-N 3.49Å; F11-L15 WeakPolarHBondContact O-CB 3.35Å; F11-L15 PolarHBondContact O-N 3.2Å |
| 12 | M | 48.5 | Very low | 50.2 | Low | 126 Ų | 126 | 132.4 Ų | 132.4 | 62% | 0.621 | 64% | 0.641 | S | S | * | * | H | α-helix | trans | -65.1 | -34 | 173.9 | -103.3 | -68.1 | -162.4 | 0 | 0 | 113.3 | G8 K10 V14 L15 Y16 | G8-M12 WeakPolarHBondContact O-CB 3.43Å; G8-M12 PolarHBondContact O-N 3.45Å; K10-M12 PolarHBondContact O-N 2.83Å; M12-V14 VanDerWaalsContact C-N 3.29Å; M12-L15 PolarHBondContact O-N 3.09Å; M12-Y16 PolarHBondContact O-N 3.46Å; M12-Y16 VanDerWaalsContact O-N 3.16Å |
| 13 | H | 50.6 | Low | 49.8 | Very low | 155 Ų | 155 | 126.9 Ų | 126.9 | 72% | 0.718 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -69.8 | -31.4 | 174.9 | -144.4 | 73.4 | 0 | 0 | 0 | 112 | R9 K10 F11 | R9-H13 PolarHBondContact O-N 3.39Å; K10-H13 WeakPolarHBondContact O-CB 3.43Å; K10-H13 PolarHBondContact O-N 3.12Å; F11-H13 VanDerWaalsContact C-N 3.33Å; F11-H13 PolarHBondContact O-N 2.8Å |
| 14 | V | 46.6 | Very low | 50.1 | Low | 116 Ų | 116 | 124.1 Ų | 124.1 | 70% | 0.703 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -77.1 | -31.8 | 174 | 174.1 | 0 | 0 | 0 | 0 | 111.7 | K10 F11 M12 | K10-V14 WeakPolarHBondContact O-CG2 3.4Å; K10-V14 PolarHBondContact O-N 3.16Å; K10-V14 VanDerWaalsContact O-N 3.09Å; F11-V14 CarbonylContact O-C 3.57Å; F11-V14 PolarHBondContact O-N 3.49Å; M12-V14 VanDerWaalsContact C-N 3.29Å |
| 15 | L | 48.8 | Very low | 50 | Low | 115 Ų | 115 | 125.4 Ų | 125.4 | 60% | 0.602 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -75.8 | -22.5 | 178.2 | -151.7 | 86.6 | 0 | 0 | 0 | 113 | F11 M12 | F11-L15 WeakPolarHBondContact O-CB 3.35Å; F11-L15 PolarHBondContact O-N 3.2Å; M12-L15 PolarHBondContact O-N 3.09Å |
| 16 | Y | 44.7 | Very low | 49.7 | Very low | 199 Ų | 199 | 122.1 Ų | 122.1 | 78% | 0.78 | 60% | 0.597 | S | S | * | * | S | Bend | trans | -136.7 | 69.9 | -179.5 | -142.7 | -96.4 | 0 | 0 | 0 | 113.2 | M12 R18 | M12-Y16 PolarHBondContact O-N 3.46Å; M12-Y16 VanDerWaalsContact O-N 3.16Å; Y16-R18 PolarHBondContact O-N 3.19Å |
| 17 | P | 44.9 | Very low | 49.4 | Very low | 78 Ų | 78 | 126.5 Ų | 126.5 | 51% | 0.506 | 60% | 0.604 | S | S | . | * | trans | -72.7 | 124.1 | 173.9 | 27.8 | -30.2 | 0 | 0 | 0 | 110.5 | K19 | P17-K19 PolarHBondContact O-N 3.18Š| ||
| 18 | R | 47 | Very low | 49.3 | Very low | 248 Ų | 248 | 123.5 Ų | 123.5 | 94% | 0.936 | 59% | 0.585 | S | S | * | * | trans | -60.1 | 121.4 | 173.9 | -170.1 | 173.5 | 174 | 172 | -2.7 | 109.1 | Y16 S20 | Y16-R18 PolarHBondContact O-N 3.19Å; R18-S20 PolarHBondContact O-N 3.39Å | ||
| 19 | K | 54.6 | Low | 48.8 | Very low | 166 Ų | 166 | 127 Ų | 127 | 72% | 0.722 | 59% | 0.594 | S | S | * | * | trans | -37.8 | 120.8 | -173.9 | -80.2 | -177.7 | 167.8 | -176.2 | 0 | 115.3 | P17 | P17-K19 PolarHBondContact O-N 3.18Š| ||
| 20 | S | 45.1 | Very low | 48.5 | Very low | 63 Ų | 63 | 126 Ų | 126 | 44% | 0.441 | 59% | 0.591 | S | S | . | * | trans | -123.5 | 108.2 | 131.7 | 69.3 | 0 | 0 | 0 | 0 | 107.8 | R18 T22 | R18-S20 PolarHBondContact O-N 3.39Å; S20-T22 PolarHBondContact O-N 3.16Å; S20-T22 VanDerWaalsContact O-N 3.1Å | ||
| 21 | N | 50.8 | Low | 48.9 | Very low | 102 Ų | 102 | 118.6 Ų | 118.6 | 55% | 0.545 | 56% | 0.562 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -69.7 | -6.8 | -168.9 | -64 | -81.8 | 0 | 0 | 0 | 114.1 | R25 | N21-R25 WeakPolarHBondContact O-CB 3.36Š|
| 22 | T | 49.2 | Very low | 49 | Very low | 95 Ų | 95 | 114.5 Ų | 114.5 | 58% | 0.583 | 55% | 0.548 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -85 | -48.7 | -177.1 | 48.3 | 0 | 0 | 0 | 0 | 111.6 | S20 L24 R25 D26 | S20-T22 PolarHBondContact O-N 3.16Å; S20-T22 VanDerWaalsContact O-N 3.1Å; T22-L24 PolarHBondContact O-N 2.76Å; T22-R25 WeakPolarHBondContact O-CB 3.46Å; T22-R25 PolarHBondContact O-N 3.42Å; T22-R25 VanDerWaalsContact O-N 3.11Å; T22-D26 PolarHBondContact O-N 3.15Å; T22-D26 VanDerWaalsContact O-N 3.12Å |
| 23 | L | 44.4 | Very low | 49.5 | Very low | 109 Ų | 109 | 113.6 Ų | 113.6 | 57% | 0.571 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -69.9 | -33.9 | -177.4 | -133 | 151.6 | 0 | 0 | 0 | 112.3 | R25 W27 | L23-R25 VanDerWaalsContact C-N 3.31Å; L23-W27 PolarHBondContact O-N 3.37Å |
| 24 | L | 49.8 | Very low | 50 | Low | 65 Ų | 65 | 110.5 Ų | 110.5 | 34% | 0.34 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -68.9 | -25.7 | 172 | -90.7 | 145.6 | 0 | 0 | 0 | 113.3 | T22 D28 Q88 | T22-L24 PolarHBondContact O-N 2.76Å; L24-D28 WeakPolarHBondContact O-CB 3.49Å; L24-D28 PolarHBondContact O-N 2.77Å; L24-Q88 PolarHBondContact O-NE2 2.98Å |
| 25 | R | 50.5 | Low | 50.7 | Low | 170 Ų | 170 | 107.6 Ų | 107.6 | 64% | 0.642 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -82.1 | -37 | 177.8 | -167.9 | 171.8 | 74.5 | 155.8 | 4.5 | 111.7 | N21 T22 L23 D28 L29 | N21-R25 WeakPolarHBondContact O-CB 3.36Å; T22-R25 WeakPolarHBondContact O-CB 3.46Å; T22-R25 PolarHBondContact O-N 3.42Å; T22-R25 VanDerWaalsContact O-N 3.11Å; L23-R25 VanDerWaalsContact C-N 3.31Å; R25-D28 PolarHBondContact O-N 3.03Å; R25-L29 HydrophobicContact CG-CD1 4.35Å; R25-L29 WeakPolarHBondContact O-CD1 3.41Å; R25-L29 PolarHBondContact O-N 3.43Å |
| 26 | D | 47.8 | Very low | 51.3 | Low | 95 Ų | 95 | 106.3 Ų | 106.3 | 51% | 0.508 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -67 | -37.2 | 173.2 | -70.6 | -37.3 | 0 | 0 | 0 | 111.6 | T22 L29 W30 | T22-D26 PolarHBondContact O-N 3.15Å; T22-D26 VanDerWaalsContact O-N 3.12Å; D26-L29 PolarHBondContact O-N 3.46Å; D26-W30 VanDerWaalsContact O-CD1 3.24Å; D26-W30 PolarHBondContact O-N 3.1Å |
| 27 | W | 47.2 | Very low | 52.3 | Low | 140 Ų | 140 | 100.3 Ų | 100.3 | 53% | 0.53 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -68.6 | -31.1 | 171.2 | -90.3 | 72.4 | 0 | 0 | 0 | 113.8 | L23 Y95 | L23-W27 PolarHBondContact O-N 3.37Å; W27-Y95 AromaticContact CE3-CE2 3.75Å; W27-Y95 HydrophobicContact CE3-CE2 3.75Å; W27-Y95 AromaticContact CE3-CZ 3.88Å; W27-Y95 HydrophobicContact CH2-CE1 4.38Å; W27-Y95 HydrophobicContact CZ3-CD2 4.12Å; W27-Y95 AromaticContact CZ3-CE1 3.87Å; W27-Y95 HydrophobicContact CZ3-CE1 3.87Å; W27-Y95 AromaticContact CZ3-CE2 3.42Å; W27-Y95 HydrophobicContact CZ3-CE2 3.42Å; W27-Y95 VanDerWaalsContact CZ3-CE2 3.42Å; W27-Y95 AromaticContact CZ3-CZ 3.27Å; W27-Y95 VanDerWaalsContact CZ3-OH 3.31Å; W27-Y95 WeakPolarHBondContact CZ3-OH 3.29Å |
| 28 | D | 52.9 | Low | 53.2 | Low | 28 Ų | 28 | 99 Ų | 99 | 15% | 0.15 | 49% | 0.489 | C | S | . | . | H | α-helix | trans | -71.1 | -28.9 | 173.2 | -166 | 63.2 | 0 | 0 | 0 | 112.2 | L24 R25 P32 F87 Q88 | L24-D28 WeakPolarHBondContact O-CB 3.49Å; L24-D28 PolarHBondContact O-N 2.77Å; R25-D28 PolarHBondContact O-N 3.03Å; D28-P32 WeakPolarHBondContact O-CD 3.4Å; D28-F87 VanDerWaalsContact OD1-C 3.27Å; D28-F87 WeakPolarHBondContact OD1-CB 3.47Å; D28-Q88 HydrophobicContact CB-CG 4.07Å; D28-Q88 VanDerWaalsContact OD1-CA 3.24Å; D28-Q88 WeakPolarHBondContact OD1-CA 3.26Å; D28-Q88 WeakPolarHBondContact OD1-CB 3.43Å; D28-Q88 WeakPolarHBondContact OD1-CG 3.44Å; D28-Q88 PolarHBondContact OD1-N 3.41Å |
| 29 | L | 44.5 | Very low | 53.9 | Low | 108 Ų | 108 | 89.5 Ų | 89.5 | 57% | 0.565 | 46% | 0.457 | S | S | * | . | H | α-helix | trans | -73.2 | -31.7 | 177.4 | -106.3 | 79.5 | 0 | 0 | 0 | 113.4 | R25 D26 | R25-L29 HydrophobicContact CG-CD1 4.35Å; R25-L29 WeakPolarHBondContact O-CD1 3.41Å; R25-L29 PolarHBondContact O-N 3.43Å; D26-L29 PolarHBondContact O-N 3.46Å |
| 30 | W | 45.6 | Very low | 54.4 | Low | 171 Ų | 171 | 84.1 Ų | 84.1 | 65% | 0.648 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -74.2 | -28.4 | 179.4 | -83 | 64.3 | 0 | 0 | 0 | 112.8 | D26 L33 I34 | D26-W30 VanDerWaalsContact O-CD1 3.24Å; D26-W30 PolarHBondContact O-N 3.1Å; W30-L33 PolarHBondContact O-N 3.33Å; W30-I34 WeakPolarHBondContact O-CG1 3.22Å; W30-I34 PolarHBondContact O-N 2.91Å |
| 31 | G | 62.3 | Low | 55.3 | Low | 10 Ų | 10 | 85.8 Ų | 85.8 | 10% | 0.103 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -59.6 | -56.4 | 179.4 | 0 | 0 | 0 | 0 | 0 | 115.6 | L33 I34 L35 C91 | G31-L33 PolarHBondContact O-N 3.38Å; G31-I34 PolarHBondContact O-N 3.39Å; G31-L35 PolarHBondContact O-N 3.41Å; G31-C91 WeakPolarHBondContact CA-SG 3.15Å |
| 32 | P | 54.4 | Low | 55.9 | Low | 46 Ų | 46 | 86.3 Ų | 86.3 | 30% | 0.299 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -57.1 | -34.8 | 173.4 | -24 | 32.6 | 0 | 0 | 0 | 112 | D28 C36 F87 | D28-P32 WeakPolarHBondContact O-CD 3.4Å; P32-C36 WeakPolarHBondContact O-CB 3.46Å; P32-C36 PolarHBondContact O-N 2.96Å; P32-F87 HydrophobicContact CG-CB 4.47Å; P32-F87 HydrophobicContact CG-CD1 3.92Å; P32-F87 HydrophobicContact CG-CG 4.34Å |
| 33 | L | 57.6 | Low | 56.4 | Low | 107 Ų | 107 | 86.1 Ų | 86.1 | 56% | 0.56 | 44% | 0.442 | S | S | * | . | H | α-helix | trans | -71.3 | -41.6 | 179.8 | -153.9 | 144.8 | 0 | 0 | 0 | 111.4 | W30 G31 C36 V37 | W30-L33 PolarHBondContact O-N 3.33Å; G31-L33 PolarHBondContact O-N 3.38Å; L33-C36 PolarHBondContact O-N 3.27Å; L33-V37 HydrophobicContact CD2-CG2 4.14Å; L33-V37 WeakPolarHBondContact O-CB 3.43Å; L33-V37 VanDerWaalsContact O-CG2 3.23Å; L33-V37 WeakPolarHBondContact O-CG2 3.38Å; L33-V37 PolarHBondContact O-N 2.85Å |
| 34 | I | 62.3 | Low | 57.2 | Low | 89 Ų | 89 | 86.9 Ų | 86.9 | 46% | 0.456 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -67.2 | -37.8 | 173.2 | -73.1 | -163.2 | 0 | 0 | 0 | 111.7 | W30 G31 V37 S38 | W30-I34 WeakPolarHBondContact O-CG1 3.22Å; W30-I34 PolarHBondContact O-N 2.91Å; G31-I34 PolarHBondContact O-N 3.39Å; I34-V37 PolarHBondContact O-N 2.92Å; I34-S38 WeakPolarHBondContact O-CB 3.34Å; I34-S38 PolarHBondContact O-N 3.29Å; I34-S38 PolarHBondContact O-OG 3.02Å |
| 35 | L | 61.4 | Low | 57.5 | Low | 56 Ų | 56 | 90 Ų | 90 | 29% | 0.293 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -62.6 | -45.6 | 172.2 | -80.1 | 169.5 | 0 | 0 | 0 | 111.3 | G31 V37 S38 L39 L90 | G31-L35 PolarHBondContact O-N 3.41Å; L35-V37 PolarHBondContact O-N 3.27Å; L35-S38 WeakPolarHBondContact CA-OG 3.46Å; L35-S38 PolarHBondContact O-N 3.35Å; L35-S38 PolarHBondContact O-OG 2.8Å; L35-L39 WeakPolarHBondContact O-CB 3.35Å; L35-L39 WeakPolarHBondContact O-CD1 2.91Å; L35-L39 PolarHBondContact O-N 3.39Å; L35-L90 HydrophobicContact CD1-CD1 4.28Å |
| 36 | C | 61.1 | Low | 57.7 | Low | 87 Ų | 87 | 84.2 Ų | 84.2 | 59% | 0.588 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -61.4 | -43.1 | 174.5 | -88.9 | 0 | 0 | 0 | 0 | 112.6 | P32 L33 A40 | P32-C36 WeakPolarHBondContact O-CB 3.46Å; P32-C36 PolarHBondContact O-N 2.96Å; L33-C36 PolarHBondContact O-N 3.27Å; C36-A40 WeakPolarHBondContact O-CB 3.15Å; C36-A40 PolarHBondContact O-N 3.34Å |
| 37 | V | 65.3 | Low | 57.9 | Low | 73 Ų | 73 | 83.8 Ų | 83.8 | 44% | 0.442 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -68.3 | -41.5 | 179.3 | 170 | 0 | 0 | 0 | 0 | 111.4 | L33 I34 L35 A40 L41 | L33-V37 HydrophobicContact CD2-CG2 4.14Å; L33-V37 WeakPolarHBondContact O-CB 3.43Å; L33-V37 VanDerWaalsContact O-CG2 3.23Å; L33-V37 WeakPolarHBondContact O-CG2 3.38Å; L33-V37 PolarHBondContact O-N 2.85Å; I34-V37 PolarHBondContact O-N 2.92Å; L35-V37 PolarHBondContact O-N 3.27Å; V37-A40 PolarHBondContact O-N 2.92Å; V37-L41 HydrophobicContact CG1-CD1 3.96Å; V37-L41 HydrophobicContact CG1-CG 4.34Å; V37-L41 WeakPolarHBondContact O-CB 3.34Å; V37-L41 VanDerWaalsContact O-CG 3.26Å; V37-L41 WeakPolarHBondContact O-CG 3.39Å; V37-L41 PolarHBondContact O-N 3.37Å |
| 38 | S | 64.5 | Low | 58.3 | Low | 50 Ų | 50 | 83.1 Ų | 83.1 | 35% | 0.35 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -66.2 | -40.1 | 176.3 | 52.7 | 0 | 0 | 0 | 0 | 112.3 | I34 L35 L41 M42 | I34-S38 WeakPolarHBondContact O-CB 3.34Å; I34-S38 PolarHBondContact O-N 3.29Å; I34-S38 PolarHBondContact O-OG 3.02Å; L35-S38 WeakPolarHBondContact CA-OG 3.46Å; L35-S38 PolarHBondContact O-N 3.35Å; L35-S38 PolarHBondContact O-OG 2.8Å; S38-L41 PolarHBondContact O-N 3Å; S38-M42 WeakPolarHBondContact O-CB 3.28Å; S38-M42 VanDerWaalsContact O-CG 3.32Å; S38-M42 WeakPolarHBondContact O-CG 3.31Å; S38-M42 PolarHBondContact O-N 3.43Å |
| 39 | L | 61.4 | Low | 58.3 | Low | 49 Ų | 49 | 89.4 Ų | 89.4 | 26% | 0.257 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -60 | -45.1 | 169.9 | -87.7 | 153.8 | 0 | 0 | 0 | 111.7 | L35 M42 L43 F59 F63 | L35-L39 WeakPolarHBondContact O-CB 3.35Å; L35-L39 WeakPolarHBondContact O-CD1 2.91Å; L35-L39 PolarHBondContact O-N 3.39Å; L39-M42 PolarHBondContact O-N 3.09Å; L39-L43 VanDerWaalsContact O-CB 3.27Å; L39-L43 WeakPolarHBondContact O-CB 3.41Å; L39-L43 PolarHBondContact O-N 3.29Å; L39-F59 HydrophobicContact CD2-CD2 4.15Å; L39-F59 HydrophobicContact CD2-CE2 3.32Å; L39-F59 HydrophobicContact CD2-CZ 3.79Å; L39-F63 HydrophobicContact CD1-CD2 4.01Å; L39-F63 HydrophobicContact CD1-CE2 4.17Å; L39-F63 HydrophobicContact CD2-CD2 3.9Å |
| 40 | A | 63.8 | Low | 58.6 | Low | 54 Ų | 54 | 87 Ų | 87 | 45% | 0.446 | 48% | 0.484 | S | S | . | . | H | α-helix | trans | -63.9 | -40.4 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | C36 V37 L43 Q44 | C36-A40 WeakPolarHBondContact O-CB 3.15Å; C36-A40 PolarHBondContact O-N 3.34Å; V37-A40 PolarHBondContact O-N 2.92Å; A40-L43 PolarHBondContact O-N 3.02Å; A40-Q44 WeakPolarHBondContact O-CB 3.44Å; A40-Q44 PolarHBondContact O-N 3.15Å |
| 41 | L | 65.1 | Low | 58.6 | Low | 98 Ų | 98 | 88 Ų | 88 | 51% | 0.513 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -68.9 | -39.7 | 176.5 | -72.3 | 171.9 | 0 | 0 | 0 | 112.3 | V37 S38 Q44 K45 | V37-L41 HydrophobicContact CG1-CD1 3.96Å; V37-L41 HydrophobicContact CG1-CG 4.34Å; V37-L41 WeakPolarHBondContact O-CB 3.34Å; V37-L41 VanDerWaalsContact O-CG 3.26Å; V37-L41 WeakPolarHBondContact O-CG 3.39Å; V37-L41 PolarHBondContact O-N 3.37Å; S38-L41 PolarHBondContact O-N 3Å; L41-Q44 PolarHBondContact O-N 3.33Å; L41-K45 VanDerWaalsContact O-CB 3.27Å; L41-K45 WeakPolarHBondContact O-CB 3.29Å; L41-K45 PolarHBondContact O-N 3.26Å |
| 42 | M | 62.6 | Low | 58 | Low | 113 Ų | 113 | 98.7 Ų | 98.7 | 56% | 0.557 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -62.6 | -46.1 | 172.3 | -76.2 | -75.2 | 108.9 | 0 | 0 | 110.7 | S38 L39 Q44 K45 S46 | S38-M42 WeakPolarHBondContact O-CB 3.28Å; S38-M42 VanDerWaalsContact O-CG 3.32Å; S38-M42 WeakPolarHBondContact O-CG 3.31Å; S38-M42 PolarHBondContact O-N 3.43Å; L39-M42 PolarHBondContact O-N 3.09Å; M42-Q44 VanDerWaalsContact C-N 3.34Å; M42-Q44 PolarHBondContact O-N 2.99Å; M42-K45 HydrophobicContact CE-CD 4.48Å; M42-K45 PolarHBondContact O-N 3.07Å; M42-S46 PolarHBondContact O-N 3.43Å; M42-S46 PolarHBondContact O-OG 3.39Å; M42-S46 VanDerWaalsContact O-OG 3.09Å |
| 43 | L | 60.6 | Low | 57.8 | Low | 90 Ų | 90 | 105 Ų | 105 | 47% | 0.471 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -62.8 | -40 | 177.4 | -164.3 | 77.5 | 0 | 0 | 0 | 112 | L39 A40 S47 F59 | L39-L43 VanDerWaalsContact O-CB 3.27Å; L39-L43 WeakPolarHBondContact O-CB 3.41Å; L39-L43 PolarHBondContact O-N 3.29Å; A40-L43 PolarHBondContact O-N 3.02Å; L43-S47 PolarHBondContact O-N 3.03Å; L43-F59 HydrophobicContact CD1-CD2 3.76Å; L43-F59 HydrophobicContact CD1-CE2 3.92Å; L43-F59 HydrophobicContact CD1-CG 4.1Å; L43-F59 HydrophobicContact CD1-CZ 4.44Å |
| 44 | Q | 60.3 | Low | 57.4 | Low | 125 Ų | 125 | 103 Ų | 103 | 58% | 0.584 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -70.3 | -34 | 176.5 | -169.3 | 169.2 | 26.9 | 0 | 0 | 112.2 | A40 L41 M42 S47 V48 | A40-Q44 WeakPolarHBondContact O-CB 3.44Å; A40-Q44 PolarHBondContact O-N 3.15Å; L41-Q44 PolarHBondContact O-N 3.33Å; M42-Q44 VanDerWaalsContact C-N 3.34Å; M42-Q44 PolarHBondContact O-N 2.99Å; Q44-S47 PolarHBondContact O-OG 3.46Å; Q44-V48 VanDerWaalsContact O-CG2 3.29Å; Q44-V48 WeakPolarHBondContact O-CG2 3.34Å; Q44-V48 PolarHBondContact O-N 3.39Å |
| 45 | K | 56.9 | Low | 57 | Low | 131 Ų | 131 | 102.5 Ų | 102.5 | 57% | 0.57 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -71.4 | -40.2 | 175.7 | -161.2 | 176.6 | -179.7 | -177 | 0 | 111.4 | L41 M42 S47 V48 E49 | L41-K45 VanDerWaalsContact O-CB 3.27Å; L41-K45 WeakPolarHBondContact O-CB 3.29Å; L41-K45 PolarHBondContact O-N 3.26Å; M42-K45 HydrophobicContact CE-CD 4.48Å; M42-K45 PolarHBondContact O-N 3.07Å; K45-S47 VanDerWaalsContact C-N 3.33Å; K45-S47 PolarHBondContact O-N 3.35Å; K45-V48 PolarHBondContact O-N 3.18Å; K45-E49 PolarHBondContact O-N 3.1Å |
| 46 | S | 53.5 | Low | 56.7 | Low | 49 Ų | 49 | 102.1 Ų | 102.1 | 34% | 0.343 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -63.7 | -34.5 | 173.4 | -61.7 | 0 | 0 | 0 | 0 | 112.9 | M42 V48 E49 G50 | M42-S46 PolarHBondContact O-N 3.43Å; M42-S46 PolarHBondContact O-OG 3.39Å; M42-S46 VanDerWaalsContact O-OG 3.09Å; S46-V48 VanDerWaalsContact C-N 3.33Å; S46-E49 PolarHBondContact O-N 3.05Å; S46-G50 PolarHBondContact O-N 2.92Å; S46-G50 VanDerWaalsContact O-N 3.09Å |
| 47 | S | 52.4 | Low | 56.5 | Low | 86 Ų | 86 | 102.6 Ų | 102.6 | 60% | 0.601 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -73.7 | -22.3 | 176.3 | 70 | 0 | 0 | 0 | 0 | 113.8 | L43 Q44 K45 | L43-S47 PolarHBondContact O-N 3.03Å; Q44-S47 PolarHBondContact O-OG 3.46Å; K45-S47 VanDerWaalsContact C-N 3.33Å; K45-S47 PolarHBondContact O-N 3.35Å |
| 48 | V | 54.9 | Low | 56.5 | Low | 125 Ų | 125 | 104.4 Ų | 104.4 | 76% | 0.758 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -78.3 | -29.1 | 174.6 | 172.9 | 0 | 0 | 0 | 0 | 111.9 | Q44 K45 S46 | Q44-V48 VanDerWaalsContact O-CG2 3.29Å; Q44-V48 WeakPolarHBondContact O-CG2 3.34Å; Q44-V48 PolarHBondContact O-N 3.39Å; K45-V48 PolarHBondContact O-N 3.18Å; S46-V48 VanDerWaalsContact C-N 3.33Å |
| 49 | E | 54.7 | Low | 56.4 | Low | 161 Ų | 161 | 105.9 Ų | 105.9 | 75% | 0.752 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -89.2 | -16.9 | 175.4 | -103.4 | 166.1 | 119.9 | 0 | 0 | 114.1 | K45 S46 K51 | K45-E49 PolarHBondContact O-N 3.1Å; S46-E49 PolarHBondContact O-N 3.05Å; E49-K51 PolarHBondContact O-N 3.47Å |
| 50 | G | 49.1 | Very low | 56.5 | Low | 56 Ų | 56 | 106.2 Ų | 106.2 | 58% | 0.577 | 60% | 0.601 | S | S | * | * | trans | -83.8 | 65.7 | -173 | 0 | 0 | 0 | 0 | 0 | 115.8 | S46 | S46-G50 PolarHBondContact O-N 2.92Å; S46-G50 VanDerWaalsContact O-N 3.09Å | ||
| 51 | K | 47.4 | Very low | 56.5 | Low | 192 Ų | 192 | 109.6 Ų | 109.6 | 84% | 0.835 | 61% | 0.608 | S | S | * | * | trans | -102.6 | 78.3 | 158.3 | -140.7 | -179.8 | -164.6 | 176.8 | 0 | 108.3 | E49 | E49-K51 PolarHBondContact O-N 3.47Š| ||
| 52 | R | 48.7 | Very low | 56.7 | Low | 236 Ų | 236 | 108.9 Ų | 108.9 | 89% | 0.891 | 61% | 0.608 | S | S | * | * | S | Bend | trans | 170.4 | 138.9 | 155.3 | -93.5 | 162.1 | -70.1 | 169.9 | 1.3 | 109.8 | ||
| 53 | D | 50.8 | Low | 56.9 | Low | 177 Ų | 177 | 108 Ų | 108 | 95% | 0.947 | 60% | 0.601 | S | S | * | * | S | Bend | trans | -47.9 | 136.8 | -167.4 | -67.3 | -64.5 | 0 | 0 | 0 | 116.8 | ||
| 54 | G | 49.6 | Very low | 57.2 | Low | 67 Ų | 67 | 107.6 Ų | 107.6 | 69% | 0.691 | 60% | 0.602 | S | S | * | * | S | Bend | trans | 126.7 | 96.8 | 168.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | S56 | G54-S56 PolarHBondContact O-N 2.95Š|
| 55 | G | 52.2 | Low | 57.6 | Low | 78 Ų | 78 | 106.7 Ų | 106.7 | 80% | 0.804 | 60% | 0.6 | S | S | * | * | trans | -48.1 | 113.3 | -179.8 | 0 | 0 | 0 | 0 | 0 | 112 | P57 | G55-P57 WeakPolarHBondContact O-CD 3.43Å; G55-P57 VanDerWaalsContact O-N 3.14Å | ||
| 56 | S | 56 | Low | 58.2 | Low | 48 Ų | 48 | 104.4 Ų | 104.4 | 34% | 0.336 | 59% | 0.593 | S | S | . | * | trans | -46.6 | 103.2 | -174.2 | 39.5 | 0 | 0 | 0 | 0 | 113.6 | G54 E58 | G54-S56 PolarHBondContact O-N 2.95Å; S56-E58 WeakPolarHBondContact CA-OE1 3.43Å; S56-E58 WeakPolarHBondContact CB-OE1 3.24Å; S56-E58 PolarHBondContact O-N 3.47Å | ||
| 57 | P | 57.5 | Low | 59 | Low | 96 Ų | 96 | 109.4 Ų | 109.4 | 62% | 0.623 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.5 | -20.1 | 178.6 | -17.9 | 31.1 | 0 | 0 | 0 | 113.5 | G55 F59 A60 E61 | G55-P57 WeakPolarHBondContact O-CD 3.43Å; G55-P57 VanDerWaalsContact O-N 3.14Å; P57-F59 PolarHBondContact O-N 3.39Å; P57-A60 PolarHBondContact O-N 3.37Å; P57-A60 VanDerWaalsContact O-N 3.16Å; P57-E61 PolarHBondContact O-N 3.4Å |
| 58 | E | 63.7 | Low | 59.6 | Low | 112 Ų | 112 | 111.5 Ų | 111.5 | 52% | 0.523 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -60.9 | -28.7 | -177.9 | 49.8 | -116.5 | 122.1 | 0 | 0 | 113.7 | S56 V62 | S56-E58 WeakPolarHBondContact CA-OE1 3.43Å; S56-E58 WeakPolarHBondContact CB-OE1 3.24Å; S56-E58 PolarHBondContact O-N 3.47Å; E58-V62 WeakPolarHBondContact O-CG2 3.4Å; E58-V62 PolarHBondContact O-N 3.03Å; E58-V62 VanDerWaalsContact O-N 3.14Å |
| 59 | F | 62.2 | Low | 60 | Low | 81 Ų | 81 | 106.9 Ų | 106.9 | 36% | 0.355 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -65.8 | -46.8 | 174.7 | 173.3 | -96.7 | 0 | 0 | 0 | 112 | L39 L43 P57 E61 F63 | L39-F59 HydrophobicContact CD2-CD2 4.15Å; L39-F59 HydrophobicContact CD2-CE2 3.32Å; L39-F59 HydrophobicContact CD2-CZ 3.79Å; L43-F59 HydrophobicContact CD1-CD2 3.76Å; L43-F59 HydrophobicContact CD1-CE2 3.92Å; L43-F59 HydrophobicContact CD1-CG 4.1Å; L43-F59 HydrophobicContact CD1-CZ 4.44Å; P57-F59 PolarHBondContact O-N 3.39Å; F59-E61 VanDerWaalsContact C-N 3.32Å; F59-E61 PolarHBondContact O-N 3.37Å; F59-F63 WeakPolarHBondContact O-CB 3.13Å; F59-F63 PolarHBondContact O-N 3.12Å |
| 60 | A | 64.6 | Low | 60.3 | Low | 55 Ų | 55 | 99.4 Ų | 99.4 | 46% | 0.455 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -67.4 | -37.2 | -178.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | P57 V64 | P57-A60 PolarHBondContact O-N 3.37Å; P57-A60 VanDerWaalsContact O-N 3.16Å; A60-V64 WeakPolarHBondContact O-CB 3.25Å; A60-V64 WeakPolarHBondContact O-CG2 2.99Å; A60-V64 PolarHBondContact O-N 2.86Å |
| 61 | E | 64.6 | Low | 60.9 | Low | 126 Ų | 126 | 98.6 Ų | 98.6 | 59% | 0.589 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -62.8 | -53.7 | 177.2 | -173.5 | 179.9 | 167 | 0 | 0 | 111.9 | P57 F59 F63 V64 I65 | P57-E61 PolarHBondContact O-N 3.4Å; F59-E61 VanDerWaalsContact C-N 3.32Å; F59-E61 PolarHBondContact O-N 3.37Å; E61-F63 VanDerWaalsContact C-N 3.31Å; E61-F63 PolarHBondContact O-N 3Å; E61-V64 PolarHBondContact O-N 3.49Å; E61-I65 HydrophobicContact CG-CD1 3.91Å; E61-I65 VanDerWaalsContact O-CG1 3.28Å; E61-I65 WeakPolarHBondContact O-CG1 3.36Å; E61-I65 PolarHBondContact O-N 3.29Å |
| 62 | V | 67.9 | Low | 61.5 | Low | 83 Ų | 83 | 92.1 Ų | 92.1 | 50% | 0.503 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -64.1 | -39.6 | -179.7 | 176.2 | 0 | 0 | 0 | 0 | 111 | E58 I65 I66 | E58-V62 WeakPolarHBondContact O-CG2 3.4Å; E58-V62 PolarHBondContact O-N 3.03Å; E58-V62 VanDerWaalsContact O-N 3.14Å; V62-I65 PolarHBondContact O-N 2.87Å; V62-I66 HydrophobicContact CG1-CD1 3.76Å; V62-I66 HydrophobicContact CG1-CG1 4.44Å; V62-I66 VanDerWaalsContact O-CG1 3.3Å; V62-I66 WeakPolarHBondContact O-CG1 3.48Å; V62-I66 PolarHBondContact O-N 3.19Å |
| 63 | F | 68 | Low | 62 | Low | 93 Ų | 93 | 84.1 Ų | 84.1 | 41% | 0.408 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -61.2 | -46 | 175.8 | -178.7 | -96.1 | 0 | 0 | 0 | 112.1 | L39 F59 E61 I66 W67 | L39-F63 HydrophobicContact CD1-CD2 4.01Å; L39-F63 HydrophobicContact CD1-CE2 4.17Å; L39-F63 HydrophobicContact CD2-CD2 3.9Å; F59-F63 WeakPolarHBondContact O-CB 3.13Å; F59-F63 PolarHBondContact O-N 3.12Å; E61-F63 VanDerWaalsContact C-N 3.31Å; E61-F63 PolarHBondContact O-N 3Å; F63-I66 PolarHBondContact O-N 3.12Å; F63-W67 WeakPolarHBondContact O-CB 3.48Å; F63-W67 PolarHBondContact O-N 3.47Å |
| 64 | V | 66.3 | Low | 62.2 | Low | 83 Ų | 83 | 76.2 Ų | 76.2 | 50% | 0.503 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -65.9 | -40.8 | 179.8 | 169 | 0 | 0 | 0 | 0 | 111.4 | A60 E61 W67 F68 | A60-V64 WeakPolarHBondContact O-CB 3.25Å; A60-V64 WeakPolarHBondContact O-CG2 2.99Å; A60-V64 PolarHBondContact O-N 2.86Å; E61-V64 PolarHBondContact O-N 3.49Å; V64-W67 PolarHBondContact O-N 2.9Å; V64-F68 WeakPolarHBondContact O-CB 3.31Å; V64-F68 PolarHBondContact O-N 3.08Å |
| 65 | I | 68.4 | Low | 62.5 | Low | 106 Ų | 106 | 78.3 Ų | 78.3 | 54% | 0.544 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -64 | -45.6 | 178.4 | -67 | 165.2 | 0 | 0 | 0 | 110.9 | E61 V62 G69 | E61-I65 HydrophobicContact CG-CD1 3.91Å; E61-I65 VanDerWaalsContact O-CG1 3.28Å; E61-I65 WeakPolarHBondContact O-CG1 3.36Å; E61-I65 PolarHBondContact O-N 3.29Å; V62-I65 PolarHBondContact O-N 2.87Å; I65-G69 PolarHBondContact O-N 3.19Å |
| 66 | I | 68.8 | Low | 62.5 | Low | 83 Ų | 83 | 78.9 Ų | 78.9 | 43% | 0.426 | 42% | 0.419 | S | S | . | . | H | α-helix | trans | -66.4 | -46.2 | 178.8 | -67.5 | 173.1 | 0 | 0 | 0 | 110.6 | V62 F63 G69 A70 | V62-I66 HydrophobicContact CG1-CD1 3.76Å; V62-I66 HydrophobicContact CG1-CG1 4.44Å; V62-I66 VanDerWaalsContact O-CG1 3.3Å; V62-I66 WeakPolarHBondContact O-CG1 3.48Å; V62-I66 PolarHBondContact O-N 3.19Å; F63-I66 PolarHBondContact O-N 3.12Å; I66-G69 PolarHBondContact O-N 2.93Å; I66-A70 VanDerWaalsContact O-CB 3.31Å; I66-A70 WeakPolarHBondContact O-CB 3.45Å; I66-A70 PolarHBondContact O-N 3.06Å |
| 67 | W | 70.7 | Confident | 62.3 | Low | 154 Ų | 154 | 78.5 Ų | 78.5 | 58% | 0.583 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -63.8 | -45.5 | -179.4 | -174 | 78.4 | 0 | 0 | 0 | 111.9 | F63 V64 A70 V71 | F63-W67 WeakPolarHBondContact O-CB 3.48Å; F63-W67 PolarHBondContact O-N 3.47Å; V64-W67 PolarHBondContact O-N 2.9Å; W67-A70 WeakPolarHBondContact O-CB 3.15Å; W67-A70 PolarHBondContact O-N 3.18Å; W67-V71 HydrophobicContact CD2-CG2 4.37Å; W67-V71 HydrophobicContact CZ2-CG2 4.45Å; W67-V71 VanDerWaalsContact O-CG2 3.25Å; W67-V71 WeakPolarHBondContact O-CG2 3.34Å; W67-V71 PolarHBondContact O-N 3.26Å |
| 68 | F | 66.4 | Low | 61.9 | Low | 130 Ų | 130 | 80.8 Ų | 80.8 | 57% | 0.57 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -69.7 | -38.1 | 179.2 | -163.9 | -96 | 0 | 0 | 0 | 112.4 | V64 A70 V71 T72 | V64-F68 WeakPolarHBondContact O-CB 3.31Å; V64-F68 PolarHBondContact O-N 3.08Å; F68-A70 VanDerWaalsContact C-N 3.34Å; F68-V71 PolarHBondContact O-N 3.11Å; F68-T72 WeakPolarHBondContact O-CB 3.38Å; F68-T72 PolarHBondContact O-N 2.94Å; F68-T72 PolarHBondContact O-OG1 3Å |
| 69 | G | 62.5 | Low | 61.2 | Low | 28 Ų | 28 | 82.8 Ų | 82.8 | 29% | 0.289 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -60.7 | -43.2 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112 | I65 I66 T72 I73 | I65-G69 PolarHBondContact O-N 3.19Å; I66-G69 PolarHBondContact O-N 2.93Å; G69-T72 PolarHBondContact O-N 3.46Å; G69-I73 WeakPolarHBondContact O-CB 3.3Å; G69-I73 WeakPolarHBondContact O-CD1 3.36Å; G69-I73 VanDerWaalsContact O-CG1 3.22Å; G69-I73 WeakPolarHBondContact O-CG1 2.86Å; G69-I73 PolarHBondContact O-N 3.14Å |
| 70 | A | 61.3 | Low | 60.6 | Low | 3 Ų | 3 | 86.2 Ų | 86.2 | 3% | 0.025 | 45% | 0.451 | C | S | . | . | H | α-helix | trans | -62.5 | -43.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | I66 W67 F68 T74 F86 L90 | I66-A70 VanDerWaalsContact O-CB 3.31Å; I66-A70 WeakPolarHBondContact O-CB 3.45Å; I66-A70 PolarHBondContact O-N 3.06Å; W67-A70 WeakPolarHBondContact O-CB 3.15Å; W67-A70 PolarHBondContact O-N 3.18Å; F68-A70 VanDerWaalsContact C-N 3.34Å; A70-T74 WeakPolarHBondContact O-CB 3.34Å; A70-T74 PolarHBondContact O-N 2.84Å; A70-T74 PolarHBondContact O-OG1 3.49Å; A70-F86 VanDerWaalsContact C-CZ 3.47Å; A70-F86 HydrophobicContact CB-CE1 3.61Å; A70-F86 HydrophobicContact CB-CE2 4.28Å; A70-F86 HydrophobicContact CB-CZ 3.34Å; A70-F86 WeakPolarHBondContact O-CE2 3.19Å; A70-L90 HydrophobicContact CB-CD1 3.43Å; A70-L90 VanDerWaalsContact CB-CD1 3.43Å; A70-L90 HydrophobicContact CB-CD2 3.73Å; A70-L90 HydrophobicContact CB-CG 3.62Å |
| 71 | V | 62.1 | Low | 59.8 | Low | 40 Ų | 40 | 86.9 Ų | 86.9 | 24% | 0.242 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -62.6 | -45.9 | 175.8 | 173.5 | 0 | 0 | 0 | 0 | 111.5 | W67 F68 T74 L75 F86 | W67-V71 HydrophobicContact CD2-CG2 4.37Å; W67-V71 HydrophobicContact CZ2-CG2 4.45Å; W67-V71 VanDerWaalsContact O-CG2 3.25Å; W67-V71 WeakPolarHBondContact O-CG2 3.34Å; W67-V71 PolarHBondContact O-N 3.26Å; F68-V71 PolarHBondContact O-N 3.11Å; V71-T74 PolarHBondContact O-N 3.4Å; V71-L75 HydrophobicContact CG1-CD1 3.75Å; V71-L75 HydrophobicContact CG1-CG 4.4Å; V71-L75 WeakPolarHBondContact O-CB 3.16Å; V71-L75 WeakPolarHBondContact O-CG 3.34Å; V71-L75 PolarHBondContact O-N 2.81Å; V71-F86 HydrophobicContact CB-CE2 4.05Å; V71-F86 HydrophobicContact CB-CZ 4.47Å; V71-F86 HydrophobicContact CG2-CE2 3.6Å; V71-F86 HydrophobicContact CG2-CZ 3.78Å |
| 72 | T | 60.1 | Low | 59.3 | Low | 56 Ų | 56 | 82.6 Ų | 82.6 | 34% | 0.344 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -63 | -48.1 | 179.8 | -59.3 | 0 | 0 | 0 | 0 | 111.3 | F68 G69 T74 L75 N76 | F68-T72 WeakPolarHBondContact O-CB 3.38Å; F68-T72 PolarHBondContact O-N 2.94Å; F68-T72 PolarHBondContact O-OG1 3Å; G69-T72 PolarHBondContact O-N 3.46Å; T72-T74 VanDerWaalsContact C-N 3.3Å; T72-T74 PolarHBondContact O-N 3.41Å; T72-L75 PolarHBondContact O-N 3.26Å; T72-N76 WeakPolarHBondContact O-CB 3.18Å; T72-N76 PolarHBondContact O-N 3.45Å; T72-N76 PolarHBondContact O-ND2 3.49Å |
| 73 | I | 57.3 | Low | 58.6 | Low | 67 Ų | 67 | 86.7 Ų | 86.7 | 34% | 0.344 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -63.6 | -37.6 | 179.5 | -68.7 | 165.3 | 0 | 0 | 0 | 111.2 | G69 S77 L93 | G69-I73 WeakPolarHBondContact O-CB 3.3Å; G69-I73 WeakPolarHBondContact O-CD1 3.36Å; G69-I73 VanDerWaalsContact O-CG1 3.22Å; G69-I73 WeakPolarHBondContact O-CG1 2.86Å; G69-I73 PolarHBondContact O-N 3.14Å; I73-S77 WeakPolarHBondContact O-CB 3.45Å; I73-S77 PolarHBondContact O-N 2.78Å; I73-S77 PolarHBondContact O-OG 2.94Å; I73-L93 HydrophobicContact CD1-CD1 3.79Å; I73-L93 HydrophobicContact CG2-CD1 4.31Å |
| 74 | T | 55.6 | Low | 58 | Low | 12 Ų | 12 | 86.7 Ų | 86.7 | 7% | 0.074 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -69.5 | -45 | 177.8 | -59 | 0 | 0 | 0 | 0 | 112.4 | A70 V71 T72 N76 S77 K78 F86 | A70-T74 WeakPolarHBondContact O-CB 3.34Å; A70-T74 PolarHBondContact O-N 2.84Å; A70-T74 PolarHBondContact O-OG1 3.49Å; V71-T74 PolarHBondContact O-N 3.4Å; T72-T74 VanDerWaalsContact C-N 3.3Å; T72-T74 PolarHBondContact O-N 3.41Å; T74-N76 VanDerWaalsContact C-N 3.29Å; T74-N76 PolarHBondContact O-N 3.36Å; T74-S77 PolarHBondContact O-N 2.95Å; T74-S77 VanDerWaalsContact O-N 3.15Å; T74-K78 HydrophobicContact CG2-CD 4.24Å; T74-K78 HydrophobicContact CG2-CG 4.37Å; T74-K78 WeakPolarHBondContact O-CG 3.32Å; T74-K78 PolarHBondContact O-N 3.29Å; T74-F86 HydrophobicContact CG2-CB 3.62Å; T74-F86 HydrophobicContact CG2-CD2 3.48Å; T74-F86 VanDerWaalsContact CG2-CD2 3.48Å; T74-F86 HydrophobicContact CG2-CG 3.9Å; T74-F86 WeakPolarHBondContact OG1-CA 3.45Å; T74-F86 WeakPolarHBondContact OG1-CD2 3.36Å; T74-F86 WeakPolarHBondContact OG1-CG 3.34Å |
| 75 | L | 56.8 | Low | 57.5 | Low | 111 Ų | 111 | 85.7 Ų | 85.7 | 58% | 0.581 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -61.3 | -42.1 | 177.9 | -74.2 | 168.1 | 0 | 0 | 0 | 110.8 | V71 T72 S77 K78 L79 | V71-L75 HydrophobicContact CG1-CD1 3.75Å; V71-L75 HydrophobicContact CG1-CG 4.4Å; V71-L75 WeakPolarHBondContact O-CB 3.16Å; V71-L75 WeakPolarHBondContact O-CG 3.34Å; V71-L75 PolarHBondContact O-N 2.81Å; T72-L75 PolarHBondContact O-N 3.26Å; L75-S77 VanDerWaalsContact C-N 3.34Å; L75-S77 PolarHBondContact O-N 2.91Å; L75-K78 PolarHBondContact O-N 3.26Å; L75-L79 WeakPolarHBondContact O-CB 3.42Å; L75-L79 PolarHBondContact O-N 3.31Å |
| 76 | N | 51.9 | Low | 56.9 | Low | 90 Ų | 90 | 82.8 Ų | 82.8 | 48% | 0.481 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -61.8 | -40.2 | 174.1 | -80.8 | -84.4 | 0 | 0 | 0 | 112.2 | T72 T74 L79 L80 | T72-N76 WeakPolarHBondContact O-CB 3.18Å; T72-N76 PolarHBondContact O-N 3.45Å; T72-N76 PolarHBondContact O-ND2 3.49Å; T74-N76 VanDerWaalsContact C-N 3.29Å; T74-N76 PolarHBondContact O-N 3.36Å; N76-L79 PolarHBondContact O-N 3.36Å; N76-L80 WeakPolarHBondContact O-CD1 3.27Å; N76-L80 PolarHBondContact O-N 2.89Å; N76-L80 VanDerWaalsContact O-N 3.1Å |
| 77 | S | 52.5 | Low | 56 | Low | 39 Ų | 39 | 83.3 Ų | 83.3 | 27% | 0.273 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -68.1 | -35.1 | 178.2 | -58.2 | 0 | 0 | 0 | 0 | 112.9 | I73 T74 L75 G82 | I73-S77 WeakPolarHBondContact O-CB 3.45Å; I73-S77 PolarHBondContact O-N 2.78Å; I73-S77 PolarHBondContact O-OG 2.94Å; T74-S77 PolarHBondContact O-N 2.95Å; T74-S77 VanDerWaalsContact O-N 3.15Å; L75-S77 VanDerWaalsContact C-N 3.34Å; L75-S77 PolarHBondContact O-N 2.91Å; S77-G82 PolarHBondContact O-N 2.87Å; S77-G82 VanDerWaalsContact O-N 3.08Å |
| 78 | K | 48.5 | Very low | 55.3 | Low | 145 Ų | 145 | 78.1 Ų | 78.1 | 63% | 0.63 | 44% | 0.437 | S | S | * | . | H | α-helix | trans | -73.5 | -35.5 | 174.6 | -68.3 | -174.3 | 82.3 | 174.9 | 0 | 112.1 | T74 L75 G81 | T74-K78 HydrophobicContact CG2-CD 4.24Å; T74-K78 HydrophobicContact CG2-CG 4.37Å; T74-K78 WeakPolarHBondContact O-CG 3.32Å; T74-K78 PolarHBondContact O-N 3.29Å; L75-K78 PolarHBondContact O-N 3.26Å; K78-G81 PolarHBondContact O-N 3.24Å |
| 79 | L | 48.1 | Very low | 54.9 | Low | 154 Ų | 154 | 73.2 Ų | 73.2 | 81% | 0.806 | 42% | 0.419 | S | S | * | . | H | α-helix | trans | -71.2 | -30.5 | 179.1 | -147.9 | 80.6 | 0 | 0 | 0 | 112.5 | L75 N76 G81 | L75-L79 WeakPolarHBondContact O-CB 3.42Å; L75-L79 PolarHBondContact O-N 3.31Å; N76-L79 PolarHBondContact O-N 3.36Å; L79-G81 PolarHBondContact O-N 3.16Å |
| 80 | L | 50.3 | Low | 54.6 | Low | 152 Ų | 152 | 73.7 Ų | 73.7 | 80% | 0.796 | 42% | 0.415 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.2 | 3.2 | 173.6 | -95.4 | 76.1 | 0 | 0 | 0 | 114.1 | N76 | N76-L80 WeakPolarHBondContact O-CD1 3.27Å; N76-L80 PolarHBondContact O-N 2.89Å; N76-L80 VanDerWaalsContact O-N 3.1Å |
| 81 | G | 47.9 | Very low | 54.4 | Low | 70 Ų | 70 | 74.4 Ų | 74.4 | 72% | 0.722 | 42% | 0.419 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 84 | 13.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 115.3 | K78 L79 | K78-G81 PolarHBondContact O-N 3.24Å; L79-G81 PolarHBondContact O-N 3.16Å |
| 82 | G | 54.2 | Low | 54.2 | Low | 35 Ų | 35 | 76.9 Ų | 76.9 | 36% | 0.361 | 43% | 0.434 | S | S | . | . | trans | -80 | 128.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | S77 I84 | S77-G82 PolarHBondContact O-N 2.87Å; S77-G82 VanDerWaalsContact O-N 3.08Å; G82-I84 VanDerWaalsContact C-N 3.32Å; G82-I84 PolarHBondContact O-N 3.46Å | ||
| 83 | N | 52.2 | Low | 54 | Low | 170 Ų | 170 | 78 Ų | 78 | 91% | 0.909 | 44% | 0.438 | S | S | * | . | trans | -91.4 | 61.8 | 173.5 | -160.5 | -65.7 | 0 | 0 | 0 | 110.3 | ||||
| 84 | I | 55.8 | Low | 54.1 | Low | 93 Ų | 93 | 76.8 Ų | 76.8 | 48% | 0.477 | 44% | 0.441 | S | S | . | . | trans | -117.2 | 130.7 | 176 | -55.6 | -176.6 | 0 | 0 | 0 | 108.3 | G82 Q88 | G82-I84 VanDerWaalsContact C-N 3.32Å; G82-I84 PolarHBondContact O-N 3.46Å; I84-Q88 HydrophobicContact CG2-CB 3.88Å | ||
| 85 | S | 56.6 | Low | 54.1 | Low | 61 Ų | 61 | 81.6 Ų | 81.6 | 43% | 0.427 | 46% | 0.459 | S | S | . | . | trans | -65.5 | 142 | 178.6 | -170.7 | 0 | 0 | 0 | 0 | 110.3 | F87 Q88 S89 | S85-F87 PolarHBondContact O-N 2.88Å; S85-F87 VanDerWaalsContact O-N 3.12Å; S85-Q88 WeakPolarHBondContact O-CB 3.23Å; S85-Q88 PolarHBondContact O-N 3.38Å; S85-S89 PolarHBondContact O-N 3.46Å | ||
| 86 | F | 54.7 | Low | 53.8 | Low | 45 Ų | 45 | 80.9 Ų | 80.9 | 20% | 0.197 | 46% | 0.462 | C | S | . | . | H | α-helix | trans | -42.6 | -47.8 | 179.7 | -179.1 | -79.1 | 0 | 0 | 0 | 113 | A70 V71 T74 L90 | A70-F86 VanDerWaalsContact C-CZ 3.47Å; A70-F86 HydrophobicContact CB-CE1 3.61Å; A70-F86 HydrophobicContact CB-CE2 4.28Å; A70-F86 HydrophobicContact CB-CZ 3.34Å; A70-F86 WeakPolarHBondContact O-CE2 3.19Å; V71-F86 HydrophobicContact CB-CE2 4.05Å; V71-F86 HydrophobicContact CB-CZ 4.47Å; V71-F86 HydrophobicContact CG2-CE2 3.6Å; V71-F86 HydrophobicContact CG2-CZ 3.78Å; T74-F86 HydrophobicContact CG2-CB 3.62Å; T74-F86 HydrophobicContact CG2-CD2 3.48Å; T74-F86 VanDerWaalsContact CG2-CD2 3.48Å; T74-F86 HydrophobicContact CG2-CG 3.9Å; T74-F86 WeakPolarHBondContact OG1-CA 3.45Å; T74-F86 WeakPolarHBondContact OG1-CD2 3.36Å; T74-F86 WeakPolarHBondContact OG1-CG 3.34Å; F86-L90 HydrophobicContact CD1-CD1 4.02Å; F86-L90 HydrophobicContact CE1-CD1 3.57Å; F86-L90 PolarHBondContact O-N 2.85Å |
| 87 | F | 51 | Low | 53.8 | Low | 94 Ų | 94 | 82 Ų | 82 | 41% | 0.412 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -74.1 | -30.7 | -173.5 | -71 | -78.5 | 0 | 0 | 0 | 112.6 | D28 P32 S85 L90 C91 | D28-F87 VanDerWaalsContact OD1-C 3.27Å; D28-F87 WeakPolarHBondContact OD1-CB 3.47Å; P32-F87 HydrophobicContact CG-CB 4.47Å; P32-F87 HydrophobicContact CG-CD1 3.92Å; P32-F87 HydrophobicContact CG-CG 4.34Å; S85-F87 PolarHBondContact O-N 2.88Å; S85-F87 VanDerWaalsContact O-N 3.12Å; F87-L90 HydrophobicContact CD1-CD1 4.5Å; F87-L90 WeakPolarHBondContact O-CB 2.88Å; F87-L90 PolarHBondContact O-N 3.28Å; F87-C91 PolarHBondContact O-N 3.09Å; F87-C91 PolarHBondContact O-SG 3.44Å |
| 88 | Q | 54.7 | Low | 53.1 | Low | 45 Ų | 45 | 86.8 Ų | 86.8 | 21% | 0.21 | 49% | 0.494 | C | S | . | . | H | α-helix | trans | -68.7 | -39.5 | 178.8 | -119.9 | 168.5 | 15.2 | 0 | 0 | 111.7 | L24 D28 I84 S85 C91 V92 | L24-Q88 PolarHBondContact O-NE2 2.98Å; D28-Q88 HydrophobicContact CB-CG 4.07Å; D28-Q88 VanDerWaalsContact OD1-CA 3.24Å; D28-Q88 WeakPolarHBondContact OD1-CA 3.26Å; D28-Q88 WeakPolarHBondContact OD1-CB 3.43Å; D28-Q88 WeakPolarHBondContact OD1-CG 3.44Å; D28-Q88 PolarHBondContact OD1-N 3.41Å; I84-Q88 HydrophobicContact CG2-CB 3.88Å; S85-Q88 WeakPolarHBondContact O-CB 3.23Å; S85-Q88 PolarHBondContact O-N 3.38Å; Q88-C91 PolarHBondContact O-N 3.44Å; Q88-V92 WeakPolarHBondContact O-CG2 3.27Å; Q88-V92 PolarHBondContact O-N 2.9Å |
| 89 | S | 59.8 | Low | 52.9 | Low | 28 Ų | 28 | 89.2 Ų | 89.2 | 20% | 0.196 | 53% | 0.525 | C | S | . | . | H | α-helix | trans | -64.9 | -43.9 | 176 | -172 | 0 | 0 | 0 | 0 | 111.4 | S85 C91 V92 L93 | S85-S89 PolarHBondContact O-N 3.46Å; S89-C91 VanDerWaalsContact C-N 3.34Å; S89-C91 PolarHBondContact O-N 2.88Å; S89-V92 PolarHBondContact O-N 2.86Å; S89-L93 PolarHBondContact O-N 3.03Å |
| 90 | L | 54.5 | Low | 53.1 | Low | 38 Ų | 38 | 86 Ų | 86 | 20% | 0.199 | 51% | 0.51 | C | S | . | . | H | α-helix | trans | -57.4 | -43.6 | 173.7 | -100.8 | 176.4 | 0 | 0 | 0 | 112.9 | L35 A70 F86 F87 L93 G94 | L35-L90 HydrophobicContact CD1-CD1 4.28Å; A70-L90 HydrophobicContact CB-CD1 3.43Å; A70-L90 VanDerWaalsContact CB-CD1 3.43Å; A70-L90 HydrophobicContact CB-CD2 3.73Å; A70-L90 HydrophobicContact CB-CG 3.62Å; F86-L90 HydrophobicContact CD1-CD1 4.02Å; F86-L90 HydrophobicContact CE1-CD1 3.57Å; F86-L90 PolarHBondContact O-N 2.85Å; F87-L90 HydrophobicContact CD1-CD1 4.5Å; F87-L90 WeakPolarHBondContact O-CB 2.88Å; F87-L90 PolarHBondContact O-N 3.28Å; L90-L93 PolarHBondContact O-N 3.04Å; L90-G94 PolarHBondContact O-N 3.46Å |
| 91 | C | 58.3 | Low | 53.3 | Low | 17 Ų | 17 | 82.5 Ų | 82.5 | 12% | 0.115 | 50% | 0.495 | C | S | . | . | H | α-helix | trans | -59.6 | -51.4 | 177.7 | -65.8 | 0 | 0 | 0 | 0 | 111.4 | G31 F87 Q88 S89 L93 G94 Y95 | G31-C91 WeakPolarHBondContact CA-SG 3.15Å; F87-C91 PolarHBondContact O-N 3.09Å; F87-C91 PolarHBondContact O-SG 3.44Å; Q88-C91 PolarHBondContact O-N 3.44Å; S89-C91 VanDerWaalsContact C-N 3.34Å; S89-C91 PolarHBondContact O-N 2.88Å; C91-L93 VanDerWaalsContact C-N 3.3Å; C91-L93 PolarHBondContact O-N 3.32Å; C91-G94 PolarHBondContact O-N 3.24Å; C91-G94 VanDerWaalsContact O-N 3.15Å; C91-Y95 HydrophobicContact CB-CE2 4.28Å; C91-Y95 WeakPolarHBondContact O-CD2 3.32Å; C91-Y95 PolarHBondContact O-N 3.45Å |
| 92 | V | 57 | Low | 53.6 | Low | 92 Ų | 92 | 83.2 Ų | 83.2 | 56% | 0.558 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -61.7 | -40.5 | -177.5 | 174 | 0 | 0 | 0 | 0 | 111 | Q88 S89 Y95 C96 | Q88-V92 WeakPolarHBondContact O-CG2 3.27Å; Q88-V92 PolarHBondContact O-N 2.9Å; S89-V92 PolarHBondContact O-N 2.86Å; V92-Y95 PolarHBondContact O-N 2.92Å; V92-C96 PolarHBondContact O-N 3.23Å; V92-C96 VanDerWaalsContact O-N 3.09Å; V92-C96 PolarHBondContact O-SG 3.09Å |
| 93 | L | 57.3 | Low | 53.5 | Low | 81 Ų | 81 | 86.1 Ų | 86.1 | 42% | 0.424 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -63.8 | -40.8 | 175.9 | -120.9 | 152.2 | 0 | 0 | 0 | 112.2 | I73 S89 L90 C91 C96 V97 | I73-L93 HydrophobicContact CD1-CD1 3.79Å; I73-L93 HydrophobicContact CG2-CD1 4.31Å; S89-L93 PolarHBondContact O-N 3.03Å; L90-L93 PolarHBondContact O-N 3.04Å; C91-L93 VanDerWaalsContact C-N 3.3Å; C91-L93 PolarHBondContact O-N 3.32Å; L93-C96 PolarHBondContact O-N 2.93Å; L93-V97 VanDerWaalsContact O-CG2 3.29Å; L93-V97 WeakPolarHBondContact O-CG2 3.22Å; L93-V97 PolarHBondContact O-N 3.06Å |
| 94 | G | 58.2 | Low | 53.6 | Low | 41 Ų | 41 | 80.8 Ų | 80.8 | 42% | 0.423 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -62.1 | -40.6 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | L90 C91 C96 V97 | L90-G94 PolarHBondContact O-N 3.46Å; C91-G94 PolarHBondContact O-N 3.24Å; C91-G94 VanDerWaalsContact O-N 3.15Å; G94-C96 VanDerWaalsContact C-N 3.3Å; G94-C96 PolarHBondContact O-N 3.31Å; G94-V97 PolarHBondContact O-N 2.83Å |
| 95 | Y | 55.5 | Low | 53.5 | Low | 112 Ų | 112 | 80 Ų | 80 | 44% | 0.439 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -66.4 | -29.3 | 175.2 | -74.2 | -66.7 | 0 | 0 | 0 | 113.4 | W27 C91 V92 V97 | W27-Y95 AromaticContact CE3-CE2 3.75Å; W27-Y95 HydrophobicContact CE3-CE2 3.75Å; W27-Y95 AromaticContact CE3-CZ 3.88Å; W27-Y95 HydrophobicContact CH2-CE1 4.38Å; W27-Y95 HydrophobicContact CZ3-CD2 4.12Å; W27-Y95 AromaticContact CZ3-CE1 3.87Å; W27-Y95 HydrophobicContact CZ3-CE1 3.87Å; W27-Y95 AromaticContact CZ3-CE2 3.42Å; W27-Y95 HydrophobicContact CZ3-CE2 3.42Å; W27-Y95 VanDerWaalsContact CZ3-CE2 3.42Å; W27-Y95 AromaticContact CZ3-CZ 3.27Å; W27-Y95 VanDerWaalsContact CZ3-OH 3.31Å; W27-Y95 WeakPolarHBondContact CZ3-OH 3.29Å; C91-Y95 HydrophobicContact CB-CE2 4.28Å; C91-Y95 WeakPolarHBondContact O-CD2 3.32Å; C91-Y95 PolarHBondContact O-N 3.45Å; V92-Y95 PolarHBondContact O-N 2.92Å; Y95-V97 VanDerWaalsContact C-N 3.35Å |
| 96 | C | 51.6 | Low | 53.3 | Low | 97 Ų | 97 | 81.4 Ų | 81.4 | 66% | 0.655 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -80.5 | -14.4 | 178.3 | -67.1 | 0 | 0 | 0 | 0 | 114.1 | V92 L93 G94 | V92-C96 PolarHBondContact O-N 3.23Å; V92-C96 VanDerWaalsContact O-N 3.09Å; V92-C96 PolarHBondContact O-SG 3.09Å; L93-C96 PolarHBondContact O-N 2.93Å; G94-C96 VanDerWaalsContact C-N 3.3Å; G94-C96 PolarHBondContact O-N 3.31Å |
| 97 | V | 51.8 | Low | 53.2 | Low | 112 Ų | 112 | 84.2 Ų | 84.2 | 68% | 0.679 | 49% | 0.486 | S | S | * | . | H | α-helix | trans | -94.1 | -19.1 | -176.1 | 171.2 | 0 | 0 | 0 | 0 | 112.4 | L93 G94 Y95 | L93-V97 VanDerWaalsContact O-CG2 3.29Å; L93-V97 WeakPolarHBondContact O-CG2 3.22Å; L93-V97 PolarHBondContact O-N 3.06Å; G94-V97 PolarHBondContact O-N 2.83Å; Y95-V97 VanDerWaalsContact C-N 3.35Å |
| 98 | L | 37 | Very low | 53.3 | Low | 141 Ų | 141 | 83.3 Ų | 83.3 | 74% | 0.738 | 49% | 0.492 | S | S | * | . | trans | -90.9 | 119.8 | 170.2 | -88.8 | 150.3 | 0 | 0 | 0 | 109.8 | ||||
| 99 | P | 44.3 | Very low | 53.2 | Low | 196 Ų | 196 | 86.8 Ų | 86.8 | 100% | 1.273 | 52% | 0.518 | S | S | * | . | trans | -69.2 | 0 | 175.4 | 29.6 | -34.1 | 0 | 0 | 0 | 113.3 |
Retrieved 99 of 99 residues in 45.3 ms
(Link to these results)