| 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 | Y | 61.8 | Low | 75.5 | Confident | 205 Ų | 205 | 119.5 Ų | 119.5 | 80% | 0.804 | 55% | 0.554 | S | S | * | * | 0 | 112 | 0 | -145.1 | -102 | 0 | 0 | 0 | 108.5 | E5 F6 | Y1-E5 WeakPolarHBondContact CA-OE2 3.46Å; Y1-E5 HydrophobicContact CE1-CB 4.35Å; Y1-E5 HydrophobicContact CE2-CB 4.48Å; Y1-F6 HydrophobicContact CE1-CB 4.16Å; Y1-F6 HydrophobicContact CE1-CD2 4.45Å | |||
| 2 | S | 82.3 | Confident | 75 | Confident | 60 Ų | 60 | 115.3 Ų | 115.3 | 42% | 0.42 | 54% | 0.542 | S | S | . | . | trans | -95.2 | 148.9 | -177 | -179.8 | 0 | 0 | 0 | 0 | 110.7 | K4 E5 F6 | S2-K4 PolarHBondContact O-N 3.42Å; S2-E5 PolarHBondContact N-OE2 3.14Å; S2-E5 WeakPolarHBondContact O-CB 3.42Å; S2-E5 PolarHBondContact O-N 2.98Å; S2-F6 PolarHBondContact O-N 3.02Å | ||
| 3 | I | 86 | Confident | 74.3 | Confident | 130 Ų | 130 | 116.1 Ų | 116.1 | 67% | 0.667 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -52.1 | -28.2 | 175.1 | -66 | 167.8 | 0 | 0 | 0 | 111.6 | K7 | I3-K7 HydrophobicContact CG2-CD 4.38Å; I3-K7 WeakPolarHBondContact O-CG 3.42Å; I3-K7 PolarHBondContact O-N 3.43Å |
| 4 | K | 81.8 | Confident | 73.3 | Confident | 166 Ų | 166 | 115.6 Ų | 115.6 | 72% | 0.722 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -65.9 | -41.8 | 175.7 | -65.4 | -178.4 | 178.8 | -178.7 | 0 | 112.6 | S2 F6 K7 E8 | S2-K4 PolarHBondContact O-N 3.42Å; K4-F6 VanDerWaalsContact C-N 3.34Å; K4-K7 PolarHBondContact O-N 3.11Å; K4-E8 PolarHBondContact O-N 3.17Å |
| 5 | E | 77.2 | Confident | 72.6 | Confident | 90 Ų | 90 | 115.9 Ų | 115.9 | 42% | 0.421 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -66.9 | -39.3 | 179.8 | -61.5 | 174.3 | 143.7 | 0 | 0 | 110.5 | Y1 S2 E8 V9 | Y1-E5 WeakPolarHBondContact CA-OE2 3.46Å; Y1-E5 HydrophobicContact CE1-CB 4.35Å; Y1-E5 HydrophobicContact CE2-CB 4.48Å; S2-E5 PolarHBondContact N-OE2 3.14Å; S2-E5 WeakPolarHBondContact O-CB 3.42Å; S2-E5 PolarHBondContact O-N 2.98Å; E5-E8 PolarHBondContact O-N 3.43Å; E5-V9 WeakPolarHBondContact O-CG2 2.95Å; E5-V9 PolarHBondContact O-N 2.99Å |
| 6 | F | 74.4 | Confident | 71.7 | Confident | 110 Ų | 110 | 112.8 Ų | 112.8 | 48% | 0.482 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -63.4 | -44.9 | 175.5 | -173.7 | -96.1 | 0 | 0 | 0 | 112.5 | Y1 S2 K4 E8 V9 E10 | Y1-F6 HydrophobicContact CE1-CB 4.16Å; Y1-F6 HydrophobicContact CE1-CD2 4.45Å; S2-F6 PolarHBondContact O-N 3.02Å; K4-F6 VanDerWaalsContact C-N 3.34Å; F6-E8 VanDerWaalsContact C-N 3.26Å; F6-E8 PolarHBondContact O-N 3.29Å; F6-V9 PolarHBondContact O-N 2.93Å; F6-E10 HydrophobicContact CD1-CG 4.16Å; F6-E10 HydrophobicContact CE1-CG 3.73Å; F6-E10 WeakPolarHBondContact CE1-OE1 3.49Å; F6-E10 HydrophobicContact CZ-CG 4.11Å; F6-E10 PolarHBondContact O-N 3.03Å |
| 7 | K | 80.1 | Confident | 71.1 | Confident | 133 Ų | 133 | 120.1 Ų | 120.1 | 58% | 0.578 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -63.4 | -33 | 176.8 | -73.4 | 179.5 | 178.6 | -173 | 0 | 112.7 | I3 K4 K11 | I3-K7 HydrophobicContact CG2-CD 4.38Å; I3-K7 WeakPolarHBondContact O-CG 3.42Å; I3-K7 PolarHBondContact O-N 3.43Å; K4-K7 PolarHBondContact O-N 3.11Å; K7-K11 VanDerWaalsContact O-CB 3.24Å; K7-K11 WeakPolarHBondContact O-CB 3.34Å; K7-K11 PolarHBondContact O-N 3.1Å |
| 8 | E | 74.9 | Confident | 70 | Confident | 129 Ų | 129 | 122.8 Ų | 122.8 | 60% | 0.603 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -71.1 | -41.7 | 176.2 | -170.2 | 168.3 | -173.6 | 0 | 0 | 111.1 | K4 E5 F6 K11 V12 | K4-E8 PolarHBondContact O-N 3.17Å; E5-E8 PolarHBondContact O-N 3.43Å; F6-E8 VanDerWaalsContact C-N 3.26Å; F6-E8 PolarHBondContact O-N 3.29Å; E8-K11 WeakPolarHBondContact O-CB 3.27Å; E8-K11 PolarHBondContact O-N 2.97Å; E8-V12 WeakPolarHBondContact O-CB 3.24Å; E8-V12 WeakPolarHBondContact O-CG2 3.49Å; E8-V12 PolarHBondContact O-N 2.87Å |
| 9 | V | 72.4 | Confident | 69.2 | Low | 58 Ų | 58 | 119.4 Ų | 119.4 | 35% | 0.352 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -64.6 | -42 | 173.5 | 174 | 0 | 0 | 0 | 0 | 111.7 | E5 F6 V12 Q13 | E5-V9 WeakPolarHBondContact O-CG2 2.95Å; E5-V9 PolarHBondContact O-N 2.99Å; F6-V9 PolarHBondContact O-N 2.93Å; V9-V12 CarbonylContact O-C 3.6Å; V9-V12 PolarHBondContact O-N 3.39Å; V9-Q13 WeakPolarHBondContact O-CG 3Å; V9-Q13 PolarHBondContact O-N 3.03Å |
| 10 | E | 67.2 | Low | 68.8 | Low | 94 Ų | 94 | 120.3 Ų | 120.3 | 44% | 0.439 | 57% | 0.567 | S | S | . | * | H | α-helix | trans | -62.4 | -45.3 | 173.8 | -81.3 | -169.5 | 132.8 | 0 | 0 | 112 | F6 V12 Q13 L14 | F6-E10 HydrophobicContact CD1-CG 4.16Å; F6-E10 HydrophobicContact CE1-CG 3.73Å; F6-E10 WeakPolarHBondContact CE1-OE1 3.49Å; F6-E10 HydrophobicContact CZ-CG 4.11Å; F6-E10 PolarHBondContact O-N 3.03Å; E10-V12 PolarHBondContact O-N 3.41Å; E10-Q13 PolarHBondContact O-N 2.73Å; E10-L14 WeakPolarHBondContact O-CB 3.17Å; E10-L14 VanDerWaalsContact O-CG 3.25Å; E10-L14 WeakPolarHBondContact O-CG 3.41Å; E10-L14 PolarHBondContact O-N 3.42Å |
| 11 | K | 72.8 | Confident | 68.2 | Low | 139 Ų | 139 | 118.9 Ų | 118.9 | 60% | 0.604 | 56% | 0.562 | S | S | * | * | H | α-helix | trans | -55.8 | -44.5 | 173.6 | -177 | -177.6 | 177.6 | -173.7 | 0 | 109.6 | K7 E8 L14 H15 | K7-K11 VanDerWaalsContact O-CB 3.24Å; K7-K11 WeakPolarHBondContact O-CB 3.34Å; K7-K11 PolarHBondContact O-N 3.1Å; E8-K11 WeakPolarHBondContact O-CB 3.27Å; E8-K11 PolarHBondContact O-N 2.97Å; K11-L14 PolarHBondContact O-N 3.15Å; K11-H15 VanDerWaalsContact C-CD2 3.46Å; K11-H15 PolarHBondContact O-CD2 3.18Å; K11-H15 PolarHBondContact O-N 3.14Å; K11-H15 VanDerWaalsContact O-N 3.14Å; K11-H15 PolarHBondContact O-NE2 3.32Å |
| 12 | V | 69.2 | Low | 67.9 | Low | 69 Ų | 69 | 112.2 Ų | 112.2 | 42% | 0.418 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -64.3 | -43.9 | 179.7 | 175 | 0 | 0 | 0 | 0 | 113.3 | E8 V9 E10 H15 S16 | E8-V12 WeakPolarHBondContact O-CB 3.24Å; E8-V12 WeakPolarHBondContact O-CG2 3.49Å; E8-V12 PolarHBondContact O-N 2.87Å; V9-V12 CarbonylContact O-C 3.6Å; V9-V12 PolarHBondContact O-N 3.39Å; E10-V12 PolarHBondContact O-N 3.41Å; V12-H15 WeakPolarHBondContact CA-CE1 3.41Å; V12-H15 VanDerWaalsContact CA-NE2 3.34Å; V12-H15 WeakPolarHBondContact CA-NE2 3.37Å; V12-H15 PolarHBondContact O-N 3.33Å; V12-H15 PolarHBondContact O-ND1 2.85Å; V12-S16 WeakPolarHBondContact O-CA 3.06Å; V12-S16 WeakPolarHBondContact O-CB 3.4Å; V12-S16 PolarHBondContact O-N 2.82Å |
| 13 | Q | 65.9 | Low | 66.5 | Low | 126 Ų | 126 | 115.1 Ų | 115.1 | 59% | 0.589 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -65.3 | -39.3 | 175.2 | -73.6 | -176.9 | 18.6 | 0 | 0 | 112.5 | V9 E10 H15 S16 | V9-Q13 WeakPolarHBondContact O-CG 3Å; V9-Q13 PolarHBondContact O-N 3.03Å; E10-Q13 PolarHBondContact O-N 2.73Å; Q13-H15 VanDerWaalsContact C-N 3.31Å; Q13-H15 PolarHBondContact O-N 2.78Å; Q13-S16 PolarHBondContact O-N 3Å; Q13-S16 VanDerWaalsContact O-N 3.15Å |
| 14 | L | 60.1 | Low | 65.1 | Low | 109 Ų | 109 | 113.6 Ų | 113.6 | 57% | 0.571 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -64.8 | -32.8 | 178.7 | -76 | 172.3 | 0 | 0 | 0 | 113.1 | E10 K11 | E10-L14 WeakPolarHBondContact O-CB 3.17Å; E10-L14 VanDerWaalsContact O-CG 3.25Å; E10-L14 WeakPolarHBondContact O-CG 3.41Å; E10-L14 PolarHBondContact O-N 3.42Å; K11-L14 PolarHBondContact O-N 3.15Å |
| 15 | H | 62.3 | Low | 64 | Low | 120 Ų | 120 | 106.6 Ų | 106.6 | 56% | 0.556 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -93.5 | -9.9 | 174 | 58.3 | 66.4 | 0 | 0 | 0 | 113.6 | K11 V12 Q13 R17 | K11-H15 VanDerWaalsContact C-CD2 3.46Å; K11-H15 PolarHBondContact O-CD2 3.18Å; K11-H15 PolarHBondContact O-N 3.14Å; K11-H15 VanDerWaalsContact O-N 3.14Å; K11-H15 PolarHBondContact O-NE2 3.32Å; V12-H15 WeakPolarHBondContact CA-CE1 3.41Å; V12-H15 VanDerWaalsContact CA-NE2 3.34Å; V12-H15 WeakPolarHBondContact CA-NE2 3.37Å; V12-H15 PolarHBondContact O-N 3.33Å; V12-H15 PolarHBondContact O-ND1 2.85Å; Q13-H15 VanDerWaalsContact C-N 3.31Å; Q13-H15 PolarHBondContact O-N 2.78Å; H15-R17 PolarHBondContact O-N 3.23Å |
| 16 | S | 58.3 | Low | 63.1 | Low | 66 Ų | 66 | 108.7 Ų | 108.7 | 46% | 0.462 | 54% | 0.536 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.4 | 52 | 177.7 | 176.4 | 0 | 0 | 0 | 0 | 112.7 | V12 Q13 F18 | V12-S16 WeakPolarHBondContact O-CA 3.06Å; V12-S16 WeakPolarHBondContact O-CB 3.4Å; V12-S16 PolarHBondContact O-N 2.82Å; Q13-S16 PolarHBondContact O-N 3Å; Q13-S16 VanDerWaalsContact O-N 3.15Å; S16-F18 VanDerWaalsContact C-N 3.28Å; S16-F18 PolarHBondContact O-N 3.31Å; S16-F18 VanDerWaalsContact O-N 3.1Å |
| 17 | R | 61.7 | Low | 62.4 | Low | 237 Ų | 237 | 112.1 Ų | 112.1 | 89% | 0.894 | 55% | 0.551 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 69.7 | 16.7 | 156.3 | -150.6 | -175 | -173.8 | -179.9 | 2.5 | 115.7 | H15 | H15-R17 PolarHBondContact O-N 3.23Š|
| 18 | F | 51.9 | Low | 62 | Low | 170 Ų | 170 | 107.9 Ų | 107.9 | 75% | 0.746 | 53% | 0.534 | S | S | * | . | trans | -83.5 | 126.5 | 157.4 | -76.3 | -75.5 | 0 | 0 | 0 | 108.4 | S16 Q20 | S16-F18 VanDerWaalsContact C-N 3.28Å; S16-F18 PolarHBondContact O-N 3.31Å; S16-F18 VanDerWaalsContact O-N 3.1Å; F18-Q20 VanDerWaalsContact C-N 3.34Å; F18-Q20 PolarHBondContact O-N 3.19Å | ||
| 19 | P | 53.9 | Low | 62 | Low | 57 Ų | 57 | 105 Ų | 105 | 37% | 0.37 | 53% | 0.525 | S | S | . | . | trans | -60.4 | 102.5 | 175.1 | 15.1 | -18.9 | 0 | 0 | 0 | 107.4 | I21 F45 R48 | P19-I21 PolarHBondContact O-N 2.75Å; P19-F45 HydrophobicContact CB-CE1 4.26Å; P19-F45 HydrophobicContact CG-CD1 4.31Å; P19-F45 HydrophobicContact CG-CE1 3.51Å; P19-F45 HydrophobicContact CG-CZ 4.24Å; P19-R48 VanDerWaalsContact C-NH1 3.33Å | ||
| 20 | Q | 61.7 | Low | 62 | Low | 137 Ų | 137 | 107.3 Ų | 107.3 | 64% | 0.64 | 54% | 0.542 | S | S | * | . | trans | -44.2 | 112.1 | 173.7 | -89.8 | -177.7 | -16.1 | 0 | 0 | 107 | F18 S22 R48 | F18-Q20 VanDerWaalsContact C-N 3.34Å; F18-Q20 PolarHBondContact O-N 3.19Å; Q20-S22 PolarHBondContact O-N 3.37Å; Q20-R48 PolarHBondContact O-NH1 3.18Å | ||
| 21 | I | 56.8 | Low | 62.4 | Low | 92 Ų | 92 | 108.4 Ų | 108.4 | 47% | 0.472 | 55% | 0.55 | S | S | . | * | trans | -65.5 | 120.5 | 171.5 | 50.3 | 171.4 | 0 | 0 | 0 | 104.6 | P19 N23 | P19-I21 PolarHBondContact O-N 2.75Å; I21-N23 PolarHBondContact O-N 2.87Å | ||
| 22 | S | 54.6 | Low | 62.5 | Low | 64 Ų | 64 | 106 Ų | 106 | 45% | 0.448 | 54% | 0.541 | S | S | . | . | trans | -44.5 | 128.7 | 171.5 | 162.6 | 0 | 0 | 0 | 0 | 108.7 | Q20 S24 R25 | Q20-S22 PolarHBondContact O-N 3.37Å; S22-S24 PolarHBondContact O-N 3.22Å; S22-S24 PolarHBondContact OG-N 3.21Å; S22-R25 PolarHBondContact O-N 3.19Å; S22-R25 VanDerWaalsContact O-N 3.11Å | ||
| 23 | N | 53.8 | Low | 62.8 | Low | 122 Ų | 122 | 106.6 Ų | 106.6 | 65% | 0.652 | 54% | 0.536 | S | S | * | . | G | 310 helix | trans | -56.6 | -2.2 | -178.9 | -70.3 | -41.3 | 0 | 0 | 0 | 113.9 | I21 R25 H26 | I21-N23 PolarHBondContact O-N 2.87Å; N23-R25 PolarHBondContact O-N 3.18Å; N23-H26 VanDerWaalsContact CB-CE1 3.48Å; N23-H26 WeakPolarHBondContact CB-CE1 3.02Å; N23-H26 VanDerWaalsContact CG-CE1 3.44Å; N23-H26 PolarHBondContact O-ND1 2.7Å; N23-H26 PolarHBondContact OD1-CE1 3.28Å |
| 24 | S | 55.6 | Low | 63.2 | Low | 98 Ų | 98 | 107.6 Ų | 107.6 | 69% | 0.685 | 55% | 0.545 | S | S | * | . | G | 310 helix | trans | -59.1 | -15.7 | 165 | 178.1 | 0 | 0 | 0 | 0 | 114 | S22 | S22-S24 PolarHBondContact O-N 3.22Å; S22-S24 PolarHBondContact OG-N 3.21Å |
| 25 | R | 59.6 | Low | 64.1 | Low | 19 Ų | 19 | 110.5 Ų | 110.5 | 7% | 0.072 | 55% | 0.553 | C | S | . | * | G | 310 helix | trans | -110.4 | 21.9 | -173 | -72.9 | -175.8 | -77.1 | -133.1 | -16 | 114.9 | S22 N23 F27 I28 E44 | S22-R25 PolarHBondContact O-N 3.19Å; S22-R25 VanDerWaalsContact O-N 3.11Å; N23-R25 PolarHBondContact O-N 3.18Å; R25-F27 PolarHBondContact O-N 3.27Å; R25-F27 VanDerWaalsContact O-N 3.08Å; R25-I28 HydrophobicContact CG-CD1 4.05Å; R25-E44 IonicContact CZ-OE2 3.51Å; R25-E44 VanDerWaalsContact NH1-CG 3.33Å; R25-E44 IonicContact NH1-OE2 3.55Å; R25-E44 IonicContact NH2-OE2 2.74Å; R25-E44 PolarHBondContact NH2-OE2 2.8Å |
| 26 | H | 58.9 | Low | 64.4 | Low | 133 Ų | 133 | 107 Ų | 107 | 62% | 0.616 | 54% | 0.538 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.4 | -9 | 173 | -78.3 | 104 | 0 | 0 | 0 | 114.6 | N23 | N23-H26 VanDerWaalsContact CB-CE1 3.48Å; N23-H26 WeakPolarHBondContact CB-CE1 3.02Å; N23-H26 VanDerWaalsContact CG-CE1 3.44Å; N23-H26 PolarHBondContact O-ND1 2.7Å; N23-H26 PolarHBondContact OD1-CE1 3.28Å |
| 27 | F | 58.8 | Low | 64.9 | Low | 183 Ų | 183 | 108 Ų | 108 | 80% | 0.803 | 54% | 0.543 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -119.5 | 2 | -171.6 | -66.2 | -78.1 | 0 | 0 | 0 | 115.1 | R25 T29 | R25-F27 PolarHBondContact O-N 3.27Å; R25-F27 VanDerWaalsContact O-N 3.08Å; F27-T29 PolarHBondContact O-N 3.22Å |
| 28 | I | 72 | Confident | 64.9 | Low | 44 Ų | 44 | 101.3 Ų | 101.3 | 23% | 0.226 | 53% | 0.528 | C | S | . | . | trans | -86.4 | 113.4 | 176.4 | -62.2 | -179.6 | 0 | 0 | 0 | 108.5 | R25 E32 W33 L36 | R25-I28 HydrophobicContact CG-CD1 4.05Å; I28-E32 HydrophobicContact CG2-CB 3.7Å; I28-W33 HydrophobicContact CB-CZ2 4.48Å; I28-W33 VanDerWaalsContact CG2-CD1 3.48Å; I28-W33 HydrophobicContact CG2-CD2 4.12Å; I28-W33 HydrophobicContact CG2-CG 3.91Å; I28-W33 PolarHBondContact O-NE1 3.36Å; I28-L36 HydrophobicContact CD1-CD1 4.06Å; I28-L36 HydrophobicContact CG2-CD1 4.34Å | ||
| 29 | T | 74.3 | Confident | 65.3 | Low | 68 Ų | 68 | 103.2 Ų | 103.2 | 42% | 0.417 | 53% | 0.53 | S | S | . | . | trans | -69.2 | 150.1 | 177.7 | 62.5 | 0 | 0 | 0 | 0 | 110.6 | F27 N31 E32 W33 | F27-T29 PolarHBondContact O-N 3.22Å; T29-N31 PolarHBondContact O-N 2.8Å; T29-E32 PolarHBondContact N-OE2 2.81Å; T29-E32 WeakPolarHBondContact O-CA 3.07Å; T29-E32 WeakPolarHBondContact O-CB 3.47Å; T29-E32 PolarHBondContact O-N 2.87Å; T29-E32 VanDerWaalsContact OG1-CG 3.25Å; T29-E32 WeakPolarHBondContact OG1-CG 3.27Å; T29-E32 PolarHBondContact OG1-OE2 2.99Å; T29-W33 PolarHBondContact O-N 3.5Å | ||
| 30 | P | 72.4 | Confident | 65.8 | Low | 107 Ų | 107 | 104.3 Ų | 104.3 | 70% | 0.695 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -47.3 | -37.9 | -178.8 | -31.5 | 36.8 | 0 | 0 | 0 | 114.8 | W33 | P30-W33 WeakPolarHBondContact O-CB 3.25Å; P30-W33 PolarHBondContact O-N 2.88Å |
| 31 | N | 75.1 | Confident | 66 | Low | 117 Ų | 117 | 100.8 Ų | 100.8 | 63% | 0.626 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -72.8 | -26.7 | 178.7 | -72.4 | -27 | 0 | 0 | 0 | 113.8 | T29 W33 L34 | T29-N31 PolarHBondContact O-N 2.8Å; N31-W33 VanDerWaalsContact C-N 3.34Å; N31-L34 PolarHBondContact O-N 3.28Å |
| 32 | E | 75.8 | Confident | 66.2 | Low | 88 Ų | 88 | 101.1 Ų | 101.1 | 41% | 0.411 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -75.2 | -27.8 | 175.5 | -71.5 | 169.7 | 148.1 | 0 | 0 | 111.5 | I28 T29 L34 K35 L36 | I28-E32 HydrophobicContact CG2-CB 3.7Å; T29-E32 PolarHBondContact N-OE2 2.81Å; T29-E32 WeakPolarHBondContact O-CA 3.07Å; T29-E32 WeakPolarHBondContact O-CB 3.47Å; T29-E32 PolarHBondContact O-N 2.87Å; T29-E32 VanDerWaalsContact OG1-CG 3.25Å; T29-E32 WeakPolarHBondContact OG1-CG 3.27Å; T29-E32 PolarHBondContact OG1-OE2 2.99Å; E32-L34 PolarHBondContact O-N 2.88Å; E32-K35 WeakPolarHBondContact O-CB 3.38Å; E32-K35 PolarHBondContact O-N 3.36Å; E32-L36 WeakPolarHBondContact O-CG 3.38Å; E32-L36 PolarHBondContact O-N 3.07Å |
| 33 | W | 75.9 | Confident | 66.7 | Low | 82 Ų | 82 | 100.9 Ų | 100.9 | 31% | 0.311 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -58.1 | -36.3 | 172.2 | -70.3 | 86.4 | 0 | 0 | 0 | 112.2 | I28 T29 P30 N31 K35 L36 | I28-W33 HydrophobicContact CB-CZ2 4.48Å; I28-W33 VanDerWaalsContact CG2-CD1 3.48Å; I28-W33 HydrophobicContact CG2-CD2 4.12Å; I28-W33 HydrophobicContact CG2-CG 3.91Å; I28-W33 PolarHBondContact O-NE1 3.36Å; T29-W33 PolarHBondContact O-N 3.5Å; P30-W33 WeakPolarHBondContact O-CB 3.25Å; P30-W33 PolarHBondContact O-N 2.88Å; N31-W33 VanDerWaalsContact C-N 3.34Å; W33-K35 PolarHBondContact O-N 2.92Å; W33-L36 PolarHBondContact O-N 3.38Å |
| 34 | L | 73 | Confident | 67 | Low | 147 Ų | 147 | 97.3 Ų | 97.3 | 77% | 0.77 | 49% | 0.49 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.5 | -18.9 | 177.7 | -60.2 | 175.7 | 0 | 0 | 0 | 113.1 | N31 E32 | N31-L34 PolarHBondContact O-N 3.28Å; E32-L34 PolarHBondContact O-N 2.88Å |
| 35 | K | 80.5 | Confident | 67 | Low | 170 Ų | 170 | 96.8 Ų | 96.8 | 74% | 0.739 | 48% | 0.476 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -93.9 | -10.6 | -179.6 | -62.8 | 179.5 | -178.2 | 178.4 | 0 | 113 | E32 W33 | E32-K35 WeakPolarHBondContact O-CB 3.38Å; E32-K35 PolarHBondContact O-N 3.36Å; W33-K35 PolarHBondContact O-N 2.92Å |
| 36 | L | 67.8 | Low | 66.9 | Low | 47 Ų | 47 | 98.7 Ų | 98.7 | 25% | 0.246 | 49% | 0.491 | C | S | . | . | S | Bend | trans | -76.8 | 136.3 | -178.2 | -65.7 | 170.4 | 0 | 0 | 0 | 109.9 | I28 E32 W33 T38 Y40 | I28-L36 HydrophobicContact CD1-CD1 4.06Å; I28-L36 HydrophobicContact CG2-CD1 4.34Å; E32-L36 WeakPolarHBondContact O-CG 3.38Å; E32-L36 PolarHBondContact O-N 3.07Å; W33-L36 PolarHBondContact O-N 3.38Å; L36-T38 PolarHBondContact O-N 3.19Å; L36-Y40 HydrophobicContact CB-CD1 4.12Å; L36-Y40 HydrophobicContact CB-CG 4.48Å; L36-Y40 HydrophobicContact CD1-CD1 3.64Å; L36-Y40 HydrophobicContact CD1-CE1 3.63Å; L36-Y40 HydrophobicContact CD2-CD1 4.35Å; L36-Y40 HydrophobicContact CG-CD1 4.24Å |
| 37 | P | 69.1 | Low | 66.8 | Low | 86 Ų | 86 | 100.8 Ų | 100.8 | 56% | 0.558 | 49% | 0.493 | S | S | * | . | trans | -54.8 | 139.7 | 172.8 | -24.4 | 33.3 | 0 | 0 | 0 | 110.3 | R39 Y40 | P37-R39 PolarHBondContact O-N 2.98Å; P37-Y40 WeakPolarHBondContact O-CA 3.19Å; P37-Y40 WeakPolarHBondContact O-CB 3.49Å; P37-Y40 PolarHBondContact O-N 3.32Å | ||
| 38 | T | 62.3 | Low | 66.7 | Low | 97 Ų | 97 | 96.2 Ų | 96.2 | 60% | 0.595 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -52 | -33.9 | 177 | -44 | 0 | 0 | 0 | 0 | 111.8 | L36 Y40 I41 E42 | L36-T38 PolarHBondContact O-N 3.19Å; T38-Y40 VanDerWaalsContact C-N 3.26Å; T38-Y40 PolarHBondContact O-N 2.87Å; T38-I41 PolarHBondContact O-N 2.84Å; T38-E42 HydrophobicContact CG2-CG 4.44Å; T38-E42 WeakPolarHBondContact CG2-OE1 3.5Å; T38-E42 WeakPolarHBondContact O-CG 3.44Å; T38-E42 PolarHBondContact O-N 3.36Å |
| 39 | R | 60.5 | Low | 65.9 | Low | 209 Ų | 209 | 100.2 Ų | 100.2 | 79% | 0.789 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -58.2 | -31.5 | 174 | -61.8 | -174.8 | -179.2 | -173.8 | 0.7 | 113.8 | P37 S43 | P37-R39 PolarHBondContact O-N 2.98Å; R39-S43 WeakPolarHBondContact O-CB 3.2Å; R39-S43 PolarHBondContact O-N 3.3Å; R39-S43 PolarHBondContact O-OG 3.18Å |
| 40 | Y | 64.5 | Low | 65.1 | Low | 80 Ų | 80 | 107.1 Ų | 107.1 | 31% | 0.314 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -67.5 | -47.2 | 177.4 | 178.5 | -94.9 | 0 | 0 | 0 | 110.8 | L36 P37 T38 S43 | L36-Y40 HydrophobicContact CB-CD1 4.12Å; L36-Y40 HydrophobicContact CB-CG 4.48Å; L36-Y40 HydrophobicContact CD1-CD1 3.64Å; L36-Y40 HydrophobicContact CD1-CE1 3.63Å; L36-Y40 HydrophobicContact CD2-CD1 4.35Å; L36-Y40 HydrophobicContact CG-CD1 4.24Å; P37-Y40 WeakPolarHBondContact O-CA 3.19Å; P37-Y40 WeakPolarHBondContact O-CB 3.49Å; P37-Y40 PolarHBondContact O-N 3.32Å; T38-Y40 VanDerWaalsContact C-N 3.26Å; T38-Y40 PolarHBondContact O-N 2.87Å; Y40-S43 PolarHBondContact O-N 2.74Å; Y40-S43 PolarHBondContact O-OG 2.92Å |
| 41 | I | 64.3 | Low | 64.2 | Low | 63 Ų | 63 | 108.9 Ų | 108.9 | 32% | 0.323 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -63.4 | -53.7 | 176.9 | -59.2 | 171.1 | 0 | 0 | 0 | 108.4 | T38 S43 E44 F45 | T38-I41 PolarHBondContact O-N 2.84Å; I41-S43 VanDerWaalsContact C-N 3.34Å; I41-S43 PolarHBondContact O-N 3.22Å; I41-E44 PolarHBondContact O-N 3.2Å; I41-F45 HydrophobicContact CG2-CD2 3.88Å; I41-F45 HydrophobicContact CG2-CE2 3.83Å; I41-F45 VanDerWaalsContact O-CD2 3.27Å; I41-F45 WeakPolarHBondContact O-CD2 3.48Å; I41-F45 PolarHBondContact O-N 3.02Å |
| 42 | E | 61.5 | Low | 63.3 | Low | 100 Ų | 100 | 111.8 Ų | 111.8 | 47% | 0.467 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -56.3 | -43.1 | 178.8 | -73.4 | 174.9 | -171.7 | 0 | 0 | 112.8 | T38 E44 F45 C46 | T38-E42 HydrophobicContact CG2-CG 4.44Å; T38-E42 WeakPolarHBondContact CG2-OE1 3.5Å; T38-E42 WeakPolarHBondContact O-CG 3.44Å; T38-E42 PolarHBondContact O-N 3.36Å; E42-E44 VanDerWaalsContact C-N 3.26Å; E42-E44 PolarHBondContact O-N 3.49Å; E42-F45 PolarHBondContact O-N 2.85Å; E42-C46 WeakPolarHBondContact O-CA 3.48Å; E42-C46 WeakPolarHBondContact O-CB 3.42Å; E42-C46 PolarHBondContact O-N 2.78Å; E42-C46 PolarHBondContact O-SG 2.8Å |
| 43 | S | 64.5 | Low | 61.9 | Low | 58 Ų | 58 | 110.4 Ų | 110.4 | 41% | 0.406 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -57.9 | -38.5 | -178.3 | 72.1 | 0 | 0 | 0 | 0 | 112.9 | R39 Y40 I41 R47 | R39-S43 WeakPolarHBondContact O-CB 3.2Å; R39-S43 PolarHBondContact O-N 3.3Å; R39-S43 PolarHBondContact O-OG 3.18Å; Y40-S43 PolarHBondContact O-N 2.74Å; Y40-S43 PolarHBondContact O-OG 2.92Å; I41-S43 VanDerWaalsContact C-N 3.34Å; I41-S43 PolarHBondContact O-N 3.22Å; S43-R47 WeakPolarHBondContact O-CB 3.15Å; S43-R47 PolarHBondContact O-N 2.81Å |
| 44 | E | 60.1 | Low | 60.9 | Low | 47 Ų | 47 | 112.5 Ų | 112.5 | 22% | 0.22 | 55% | 0.549 | C | S | . | . | H | α-helix | trans | -76.8 | -31 | -178.3 | -78.1 | -80.7 | 133.6 | 0 | 0 | 112.8 | R25 I41 E42 R48 | R25-E44 IonicContact CZ-OE2 3.51Å; R25-E44 VanDerWaalsContact NH1-CG 3.33Å; R25-E44 IonicContact NH1-OE2 3.55Å; R25-E44 IonicContact NH2-OE2 2.74Å; R25-E44 PolarHBondContact NH2-OE2 2.8Å; I41-E44 PolarHBondContact O-N 3.2Å; E42-E44 VanDerWaalsContact C-N 3.26Å; E42-E44 PolarHBondContact O-N 3.49Å; E44-R48 PolarHBondContact O-NE 2.75Å |
| 45 | F | 56.6 | Low | 59.8 | Low | 88 Ų | 88 | 110.8 Ų | 110.8 | 39% | 0.386 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -79.3 | -46.3 | 172.4 | -78.3 | -86.9 | 0 | 0 | 0 | 111.5 | P19 I41 E42 R48 R49 | P19-F45 HydrophobicContact CB-CE1 4.26Å; P19-F45 HydrophobicContact CG-CD1 4.31Å; P19-F45 HydrophobicContact CG-CE1 3.51Å; P19-F45 HydrophobicContact CG-CZ 4.24Å; I41-F45 HydrophobicContact CG2-CD2 3.88Å; I41-F45 HydrophobicContact CG2-CE2 3.83Å; I41-F45 VanDerWaalsContact O-CD2 3.27Å; I41-F45 WeakPolarHBondContact O-CD2 3.48Å; I41-F45 PolarHBondContact O-N 3.02Å; E42-F45 PolarHBondContact O-N 2.85Å; F45-R48 PolarHBondContact O-N 3.21Å; F45-R49 WeakPolarHBondContact O-CG 3.47Å; F45-R49 PolarHBondContact O-N 3.42Å |
| 46 | C | 56.3 | Low | 58.1 | Low | 58 Ų | 58 | 108.1 Ų | 108.1 | 39% | 0.392 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -65.8 | -40.9 | 180 | -70 | 0 | 0 | 0 | 0 | 112.4 | E42 R48 R49 R50 | E42-C46 WeakPolarHBondContact O-CA 3.48Å; E42-C46 WeakPolarHBondContact O-CB 3.42Å; E42-C46 PolarHBondContact O-N 2.78Å; E42-C46 PolarHBondContact O-SG 2.8Å; C46-R48 VanDerWaalsContact C-N 3.25Å; C46-R48 PolarHBondContact O-N 3.25Å; C46-R49 PolarHBondContact O-N 3.49Å; C46-R50 WeakPolarHBondContact O-CG 3.5Å; C46-R50 PolarHBondContact O-N 3.08Å |
| 47 | R | 58.3 | Low | 57.4 | Low | 177 Ų | 177 | 114.2 Ų | 114.2 | 67% | 0.668 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -64.7 | -31.4 | 176.2 | -162.1 | 172.1 | 85.4 | 119.7 | 1.5 | 111.8 | S43 | S43-R47 WeakPolarHBondContact O-CB 3.15Å; S43-R47 PolarHBondContact O-N 2.81Å |
| 48 | R | 56.4 | Low | 56.3 | Low | 88 Ų | 88 | 119.1 Ų | 119.1 | 33% | 0.332 | 59% | 0.585 | S | S | . | * | H | α-helix | trans | -76.8 | -35.9 | 171.6 | -82.3 | -171.5 | -78.5 | 177.1 | -6.8 | 113.6 | P19 Q20 E44 F45 C46 N51 | P19-R48 VanDerWaalsContact C-NH1 3.33Å; Q20-R48 PolarHBondContact O-NH1 3.18Å; E44-R48 PolarHBondContact O-NE 2.75Å; F45-R48 PolarHBondContact O-N 3.21Å; C46-R48 VanDerWaalsContact C-N 3.25Å; C46-R48 PolarHBondContact O-N 3.25Å; R48-N51 PolarHBondContact O-N 3.11Å |
| 49 | R | 55.8 | Low | 55.7 | Low | 127 Ų | 127 | 124 Ų | 124 | 48% | 0.479 | 59% | 0.593 | S | S | . | * | H | α-helix | trans | -65.4 | -35 | 174.6 | -71.8 | -165.9 | -168.4 | -169.3 | 4.7 | 113 | F45 C46 N51 K52 | F45-R49 WeakPolarHBondContact O-CG 3.47Å; F45-R49 PolarHBondContact O-N 3.42Å; C46-R49 PolarHBondContact O-N 3.49Å; R49-N51 PolarHBondContact O-N 2.96Å; R49-K52 CarbonylContact O-C 3.52Å; R49-K52 PolarHBondContact O-N 3.34Å; R49-K52 VanDerWaalsContact O-N 3.11Å |
| 50 | R | 56 | Low | 54.9 | Low | 214 Ų | 214 | 121.8 Ų | 121.8 | 81% | 0.808 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.4 | -26.5 | 175.5 | -74.3 | 178.1 | -177.4 | 174.1 | 1.1 | 113.3 | C46 | C46-R50 WeakPolarHBondContact O-CG 3.5Å; C46-R50 PolarHBondContact O-N 3.08Å |
| 51 | N | 53.7 | Low | 54 | Low | 144 Ų | 144 | 122.2 Ų | 122.2 | 77% | 0.77 | 60% | 0.604 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94 | -3.3 | 179.9 | -65.2 | -3.9 | 0 | 0 | 0 | 113.7 | R48 R49 | R48-N51 PolarHBondContact O-N 3.11Å; R49-N51 PolarHBondContact O-N 2.96Å |
| 52 | K | 55.7 | Low | 53.1 | Low | 177 Ų | 177 | 127 Ų | 127 | 77% | 0.77 | 63% | 0.629 | S | S | * | * | S | Bend | trans | -127.4 | 98.2 | 178.6 | -159.1 | 105.9 | 178.1 | -175.9 | 0 | 107.7 | R49 | R49-K52 CarbonylContact O-C 3.52Å; R49-K52 PolarHBondContact O-N 3.34Å; R49-K52 VanDerWaalsContact O-N 3.11Å |
| 53 | G | 46.4 | Very low | 52.4 | Low | 60 Ų | 60 | 126.6 Ų | 126.6 | 62% | 0.619 | 64% | 0.637 | S | S | * | * | trans | -20.2 | 124.7 | -174.9 | 0 | 0 | 0 | 0 | 0 | 116.4 | S55 | G53-S55 PolarHBondContact O-N 3.05Å; G53-S55 PolarHBondContact O-OG 2.82Å | ||
| 54 | S | 55.8 | Low | 51.4 | Low | 126 Ų | 126 | 133 Ų | 133 | 88% | 0.881 | 65% | 0.653 | S | S | * | * | S | Bend | trans | -14 | 93 | 162.8 | 54.5 | 0 | 0 | 0 | 0 | 115.2 | ||
| 55 | S | 50.1 | Low | 51 | Low | 110 Ų | 110 | 139.6 Ų | 139.6 | 77% | 0.769 | 68% | 0.684 | S | S | * | * | trans | -170.2 | 64.7 | 159.2 | 47.6 | 0 | 0 | 0 | 0 | 110.9 | G53 | G53-S55 PolarHBondContact O-N 3.05Å; G53-S55 PolarHBondContact O-OG 2.82Å | ||
| 56 | F | 45.4 | Very low | 50.6 | Low | 114 Ų | 114 | 142.5 Ų | 142.5 | 50% | 0.5 | 70% | 0.699 | S | S | . | * | trans | -149.7 | 46.7 | 158.3 | -160 | -90.5 | 0 | 0 | 0 | 109.7 | R59 | F56-R59 HydrophobicContact CZ-CB 4.43Š| ||
| 57 | L | 52.4 | Low | 50.1 | Low | 175 Ų | 175 | 142.3 Ų | 142.3 | 92% | 0.916 | 71% | 0.706 | S | S | * | * | trans | -114.5 | 33 | 170.2 | -70.5 | -177.3 | 0 | 0 | 0 | 111.2 | ||||
| 58 | E | 45.2 | Very low | 49.8 | Very low | 190 Ų | 190 | 140.5 Ų | 140.5 | 89% | 0.888 | 71% | 0.71 | S | S | * | * | S | Bend | trans | -124.1 | 2.4 | 175.3 | -139.1 | -180 | 172.5 | 0 | 0 | 113.9 | ||
| 59 | R | 50.5 | Low | 49.6 | Very low | 199 Ų | 199 | 143.7 Ų | 143.7 | 75% | 0.751 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -120.6 | 108.3 | 158 | -89.6 | -177.8 | 173.5 | -165.7 | -2.8 | 107.8 | F56 P61 | F56-R59 HydrophobicContact CZ-CB 4.43Å; R59-P61 WeakPolarHBondContact O-CD 3.41Å; R59-P61 VanDerWaalsContact O-N 3.11Å |
| 60 | E | 43.9 | Very low | 49.2 | Very low | 163 Ų | 163 | 143.5 Ų | 143.5 | 76% | 0.762 | 75% | 0.749 | S | S | * | * | trans | -44.8 | 116.5 | 161.2 | -169.7 | 169.9 | 171.9 | 0 | 0 | 107.3 | L62 | E60-L62 PolarHBondContact O-N 3.31Š| ||
| 61 | P | 46.1 | Very low | 48.8 | Very low | 89 Ų | 89 | 137 Ų | 137 | 58% | 0.578 | 74% | 0.736 | S | S | * | * | trans | -65.2 | 112.7 | 167.4 | 9.3 | 2.5 | 0 | 0 | 0 | 104.5 | R59 C63 | R59-P61 WeakPolarHBondContact O-CD 3.41Å; R59-P61 VanDerWaalsContact O-N 3.11Å; P61-C63 HydrophobicContact CB-CB 4.36Å; P61-C63 PolarHBondContact O-N 2.97Å | ||
| 62 | L | 44.9 | Very low | 48.8 | Very low | 162 Ų | 162 | 135 Ų | 135 | 85% | 0.848 | 74% | 0.739 | S | S | * | * | trans | -69.3 | 60.3 | 164.5 | -64 | 178.4 | 0 | 0 | 0 | 108.1 | E60 Y64 | E60-L62 PolarHBondContact O-N 3.31Å; L62-Y64 PolarHBondContact O-N 2.83Å | ||
| 63 | C | 45.5 | Very low | 48.5 | Very low | 93 Ų | 93 | 134 Ų | 134 | 63% | 0.628 | 74% | 0.735 | S | S | * | * | trans | -90.8 | 105.9 | 174.3 | 57.9 | 0 | 0 | 0 | 0 | 107.6 | P61 | P61-C63 HydrophobicContact CB-CB 4.36Å; P61-C63 PolarHBondContact O-N 2.97Å | ||
| 64 | Y | 43.8 | Very low | 48.7 | Very low | 192 Ų | 192 | 140.6 Ų | 140.6 | 75% | 0.753 | 75% | 0.75 | S | S | * | * | trans | 66 | 93.2 | 167.6 | -148.4 | -104.6 | 0 | 0 | 0 | 114.1 | L62 E66 | L62-Y64 PolarHBondContact O-N 2.83Å; Y64-E66 VanDerWaalsContact C-N 3.31Å; Y64-E66 HydrophobicContact CD1-CB 4.36Å; Y64-E66 PolarHBondContact O-N 2.9Å | ||
| 65 | Q | 51.5 | Low | 48 | Very low | 185 Ų | 185 | 139 Ų | 139 | 86% | 0.864 | 74% | 0.744 | S | S | * | * | trans | -58.1 | 108.8 | 147.4 | -83.3 | -78.9 | -12.8 | 0 | 0 | 105.1 | G67 | Q65-G67 VanDerWaalsContact C-N 3.26Å; Q65-G67 PolarHBondContact O-N 3.01Å | ||
| 66 | E | 49.1 | Very low | 48.2 | Very low | 150 Ų | 150 | 141.6 Ų | 141.6 | 70% | 0.701 | 75% | 0.748 | S | S | * | * | trans | -56.4 | 98.5 | 170.8 | -172.8 | 150.8 | -144.9 | 0 | 0 | 106.5 | Y64 N68 | Y64-E66 VanDerWaalsContact C-N 3.31Å; Y64-E66 HydrophobicContact CD1-CB 4.36Å; Y64-E66 PolarHBondContact O-N 2.9Å; E66-N68 PolarHBondContact O-N 3.38Å | ||
| 67 | G | 45.1 | Very low | 48.5 | Very low | 53 Ų | 53 | 141.4 Ų | 141.4 | 55% | 0.546 | 76% | 0.761 | S | S | . | * | trans | -64 | 87.2 | 169.9 | 0 | 0 | 0 | 0 | 0 | 106.4 | Q65 N69 | Q65-G67 VanDerWaalsContact C-N 3.26Å; Q65-G67 PolarHBondContact O-N 3.01Å; G67-N69 PolarHBondContact O-N 3.37Å | ||
| 68 | N | 51.8 | Low | 48.3 | Very low | 140 Ų | 140 | 142.5 Ų | 142.5 | 75% | 0.749 | 76% | 0.761 | S | S | * | * | trans | -43.8 | 113.5 | 159.8 | -79.5 | -33.7 | 0 | 0 | 0 | 106.2 | E66 P70 | E66-N68 PolarHBondContact O-N 3.38Å; N68-P70 WeakPolarHBondContact O-CD 3.49Å | ||
| 69 | N | 54 | Low | 48.4 | Very low | 154 Ų | 154 | 137.1 Ų | 137.1 | 82% | 0.824 | 76% | 0.756 | S | S | * | * | trans | -46.5 | 112.5 | 174.4 | -81 | -83 | 0 | 0 | 0 | 108 | G67 S71 | G67-N69 PolarHBondContact O-N 3.37Å; N69-S71 PolarHBondContact O-N 2.99Å | ||
| 70 | P | 46.2 | Very low | 48.5 | Very low | 124 Ų | 124 | 137.6 Ų | 137.6 | 81% | 0.805 | 76% | 0.759 | S | S | * | * | trans | -72.6 | 95.2 | 167.4 | 29 | -25.8 | 0 | 0 | 0 | 104.6 | N68 A72 | N68-P70 WeakPolarHBondContact O-CD 3.49Å; P70-A72 PolarHBondContact O-N 3.28Å | ||
| 71 | S | 48.4 | Very low | 48.1 | Very low | 77 Ų | 77 | 139.3 Ų | 139.3 | 54% | 0.538 | 77% | 0.765 | S | S | . | * | trans | -38.3 | 116.3 | 165.1 | 156.8 | 0 | 0 | 0 | 0 | 107.7 | N69 K73 | N69-S71 PolarHBondContact O-N 2.99Å; S71-K73 PolarHBondContact O-N 3.49Å; S71-K73 PolarHBondContact O-NZ 3.33Å; S71-K73 PolarHBondContact OG-NZ 3.37Å | ||
| 72 | A | 52.7 | Low | 48 | Very low | 101 Ų | 101 | 138.9 Ų | 138.9 | 84% | 0.835 | 76% | 0.764 | S | S | * | * | S | Bend | trans | -45.8 | 103.6 | -178.8 | 0 | 0 | 0 | 0 | 0 | 110.5 | P70 | P70-A72 PolarHBondContact O-N 3.28Š|
| 73 | K | 50 | Low | 48.3 | Very low | 158 Ų | 158 | 135.8 Ų | 135.8 | 69% | 0.687 | 76% | 0.756 | S | S | * | * | trans | -168.2 | 106.6 | 157.8 | 52.6 | -144.3 | 178 | -67.8 | 0 | 108 | S71 | S71-K73 PolarHBondContact O-N 3.49Å; S71-K73 PolarHBondContact O-NZ 3.33Å; S71-K73 PolarHBondContact OG-NZ 3.37Å | ||
| 74 | E | 50.9 | Low | 48.3 | Very low | 197 Ų | 197 | 139.8 Ų | 139.8 | 92% | 0.921 | 77% | 0.77 | S | S | * | * | trans | -15.4 | 134.7 | 162.3 | -55.8 | 171.8 | 127 | 0 | 0 | 116.3 | ||||
| 75 | A | 40.8 | Very low | 48.2 | Very low | 93 Ų | 93 | 136.4 Ų | 136.4 | 77% | 0.769 | 78% | 0.775 | S | S | * | * | trans | -162.4 | 95.6 | 146.1 | 0 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 76 | I | 54.3 | Low | 47.7 | Very low | 165 Ų | 165 | 135.6 Ų | 135.6 | 85% | 0.846 | 78% | 0.775 | S | S | * | * | trans | -2.5 | 128.7 | 143.4 | 43.9 | 165.1 | 0 | 0 | 0 | 117.2 | ||||
| 77 | S | 50.9 | Low | 47.4 | Very low | 109 Ų | 109 | 132.9 Ų | 132.9 | 76% | 0.762 | 77% | 0.773 | S | S | * | * | 148.4 | 119.4 | 109.2 | 73 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 78 | E | 49.2 | Very low | 47.5 | Very low | 199 Ų | 199 | 139.7 Ų | 139.7 | 93% | 0.93 | 79% | 0.791 | S | S | * | * | trans | 25 | 125.1 | 143.3 | -47.2 | -160.5 | -168.9 | 0 | 0 | 120.6 | ||||
| 79 | G | 46.5 | Very low | 46.9 | Very low | 76 Ų | 76 | 140.9 Ų | 140.9 | 78% | 0.784 | 79% | 0.792 | S | S | * | * | trans | 167.8 | 85.6 | 163.7 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 80 | Y | 52.4 | Low | 46.2 | Very low | 209 Ų | 209 | 144 Ų | 144 | 82% | 0.82 | 79% | 0.792 | S | S | * | * | trans | 62.9 | 97.2 | 140.9 | -141.6 | -108.1 | 0 | 0 | 0 | 118.9 | S82 | Y80-S82 WeakPolarHBondContact CE1-OG 3.25Š| ||
| 81 | F | 36.8 | Very low | 45.7 | Very low | 199 Ų | 199 | 147.2 Ų | 147.2 | 87% | 0.873 | 80% | 0.796 | S | S | * | * | trans | -105.2 | 108.4 | 154.6 | -140 | -90.8 | 0 | 0 | 0 | 108.4 | S83 | F81-S83 PolarHBondContact O-N 3.02Š| ||
| 82 | S | 44.2 | Very low | 45.4 | Very low | 80 Ų | 80 | 151.6 Ų | 151.6 | 56% | 0.559 | 81% | 0.808 | S | S | * | * | trans | -73.2 | 100.3 | 165.6 | -65.8 | 0 | 0 | 0 | 0 | 108.9 | Y80 L84 | Y80-S82 WeakPolarHBondContact CE1-OG 3.25Å; S82-L84 PolarHBondContact O-N 2.84Å | ||
| 83 | S | 50.1 | Low | 44.6 | Very low | 98 Ų | 98 | 154.7 Ų | 154.7 | 69% | 0.685 | 81% | 0.811 | S | S | * | * | trans | -75.6 | 114.1 | 163.8 | 22.9 | 0 | 0 | 0 | 0 | 109 | F81 S85 | F81-S83 PolarHBondContact O-N 3.02Å; S83-S85 PolarHBondContact O-N 2.94Å | ||
| 84 | L | 45.2 | Very low | 44.5 | Very low | 177 Ų | 177 | 156 Ų | 156 | 93% | 0.927 | 82% | 0.819 | S | S | * | * | trans | -60.5 | 101.8 | 160.6 | -72.4 | 167 | 0 | 0 | 0 | 107.6 | S82 L86 | S82-L84 PolarHBondContact O-N 2.84Å; L84-L86 PolarHBondContact O-N 3.43Å; L84-L86 VanDerWaalsContact O-N 3.14Å | ||
| 85 | S | 41.7 | Very low | 43.7 | Very low | 121 Ų | 121 | 154.3 Ų | 154.3 | 85% | 0.846 | 82% | 0.816 | S | S | * | * | trans | -74.8 | 97.2 | 173.9 | 12.3 | 0 | 0 | 0 | 0 | 109.3 | S83 | S83-S85 PolarHBondContact O-N 2.94Š| ||
| 86 | L | 40.5 | Very low | 43.7 | Very low | 167 Ų | 167 | 152.2 Ų | 152.2 | 87% | 0.874 | 80% | 0.804 | S | S | * | * | trans | -114.2 | 92.1 | 156.7 | -168.1 | 81.6 | 0 | 0 | 0 | 108.3 | L84 | L84-L86 PolarHBondContact O-N 3.43Å; L84-L86 VanDerWaalsContact O-N 3.14Å | ||
| 87 | S | 42.8 | Very low | 43 | Very low | 94 Ų | 94 | 150.1 Ų | 150.1 | 66% | 0.657 | 80% | 0.804 | S | S | * | * | trans | -163.3 | 103.6 | 143.6 | -94.9 | 0 | 0 | 0 | 0 | 107.2 | E89 | S87-E89 PolarHBondContact O-N 2.88Š| ||
| 88 | Q | 48.2 | Very low | 42.4 | Very low | 196 Ų | 196 | 150.1 Ų | 150.1 | 92% | 0.916 | 80% | 0.804 | S | S | * | * | trans | -82.5 | 101.6 | 164 | 174.6 | 171.6 | -27.1 | 0 | 0 | 107 | ||||
| 89 | E | 38.4 | Very low | 42.3 | Very low | 164 Ų | 164 | 147.8 Ų | 147.8 | 77% | 0.766 | 80% | 0.797 | S | S | * | * | trans | -140 | 105.7 | 159.5 | 45.3 | -154.1 | 120.3 | 0 | 0 | 107.3 | S87 | S87-E89 PolarHBondContact O-N 2.88Š| ||
| 90 | R | 40.4 | Very low | 41.8 | Very low | 220 Ų | 220 | 150 Ų | 150 | 83% | 0.83 | 80% | 0.8 | S | S | * | * | trans | -91.3 | 116.2 | 175.9 | 175.7 | -159.2 | -92.3 | -134.5 | -2 | 105.9 | ||||
| 91 | E | 35.7 | Very low | 41.1 | Very low | 192 Ų | 192 | 149.8 Ų | 149.8 | 90% | 0.897 | 80% | 0.797 | S | S | * | * | trans | -153.7 | 107.9 | 146.4 | -153.8 | 161.4 | 166.1 | 0 | 0 | 108 | ||||
| 92 | E | 41.3 | Very low | 41.1 | Very low | 169 Ų | 169 | 146.4 Ų | 146.4 | 79% | 0.79 | 80% | 0.797 | S | S | * | * | trans | -76.6 | 128 | 170.9 | -71.6 | 168.3 | 103.3 | 0 | 0 | 108 | ||||
| 93 | D | 36.5 | Very low | 40.9 | Very low | 166 Ų | 166 | 149.4 Ų | 149.4 | 89% | 0.888 | 81% | 0.807 | S | S | * | * | trans | -144 | 140.9 | 145.9 | -141.4 | 9.4 | 0 | 0 | 0 | 110.7 | ||||
| 94 | Q | 46.9 | Very low | 40.7 | Very low | 185 Ų | 185 | 153.4 Ų | 153.4 | 86% | 0.864 | 81% | 0.814 | S | S | * | * | trans | -82 | 175.1 | -162.1 | -67 | -143.5 | 57.9 | 0 | 0 | 114.7 | ||||
| 95 | D | 35.2 | Very low | 40.7 | Very low | 161 Ų | 161 | 150.5 Ų | 150.5 | 86% | 0.861 | 81% | 0.806 | S | S | * | * | trans | 111.4 | 111.3 | 160.4 | -152.4 | 40.2 | 0 | 0 | 0 | 112.3 | ||||
| 96 | G | 40.2 | Very low | 40.7 | Very low | 49 Ų | 49 | 150.5 Ų | 150.5 | 51% | 0.505 | 81% | 0.806 | S | S | . | * | cis | 105.9 | 104.9 | 37.1 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 97 | S | 39.5 | Very low | 40.7 | Very low | 122 Ų | 122 | 150.6 Ų | 150.6 | 85% | 0.853 | 81% | 0.807 | S | S | * | * | trans | 72.4 | 138.2 | 173.4 | 84.4 | 0 | 0 | 0 | 0 | 116 | ||||
| 98 | S | 38.8 | Very low | 40.7 | Very low | 109 Ų | 109 | 155.3 Ų | 155.3 | 76% | 0.762 | 84% | 0.84 | S | S | * | * | -163.3 | 147.3 | 52.8 | 46.3 | 0 | 0 | 0 | 0 | 112.7 | |||||
| 99 | L | 46.2 | Very low | 40.3 | Very low | 150 Ų | 150 | 153.3 Ų | 153.3 | 79% | 0.785 | 84% | 0.836 | S | S | * | * | trans | -65.1 | 128.9 | 174.1 | -176.6 | 90.1 | 0 | 0 | 0 | 111.9 | ||||
| 100 | C | 36.3 | Very low | 40.4 | Very low | 123 Ų | 123 | 152.7 Ų | 152.7 | 83% | 0.831 | 84% | 0.84 | S | S | * | * | trans | -141.5 | 95.6 | 154.3 | -74.2 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 101 | R | 37.8 | Very low | 40.4 | Very low | 204 Ų | 204 | 148.9 Ų | 148.9 | 77% | 0.77 | 84% | 0.84 | S | S | * | * | trans | -69.8 | 138.4 | 159.1 | -75.6 | -173.8 | 178.9 | 176.1 | -0.3 | 108.7 | ||||
| 102 | C | 37 | Very low | 40.7 | Very low | 127 Ų | 127 | 146.4 Ų | 146.4 | 86% | 0.858 | 84% | 0.837 | S | S | * | * | trans | -133.3 | 108.9 | 154.9 | -69.5 | 0 | 0 | 0 | 0 | 108 | ||||
| 103 | D | 39.4 | Very low | 40.7 | Very low | 144 Ų | 144 | 145 Ų | 145 | 77% | 0.77 | 84% | 0.84 | S | S | * | * | P | Polyproline II helix | trans | -66.3 | 144.4 | 171 | -70.4 | -72.6 | 0 | 0 | 0 | 111.4 | ||
| 104 | H | 46 | Very low | 41 | Very low | 181 Ų | 181 | 143.6 Ų | 143.6 | 84% | 0.838 | 84% | 0.837 | S | S | * | * | P | Polyproline II helix | trans | -72.7 | 147.9 | 172.3 | -93.6 | -61.4 | 0 | 0 | 0 | 111.8 | S106 | H104-S106 PolarHBondContact O-N 3.48Š|
| 105 | P | 46.4 | Very low | 40.5 | Very low | 116 Ų | 116 | 140.6 Ų | 140.6 | 75% | 0.753 | 84% | 0.835 | S | S | * | * | P | Polyproline II helix | trans | -79.9 | 118.6 | 163.5 | 30.9 | -28.5 | 0 | 0 | 0 | 110.5 | ||
| 106 | S | 40.6 | Very low | 40.9 | Very low | 122 Ų | 122 | 139.1 Ų | 139.1 | 85% | 0.853 | 83% | 0.833 | S | S | * | * | P | Polyproline II helix | trans | -72.1 | 125.5 | 164.3 | -64.3 | 0 | 0 | 0 | 0 | 109.9 | H104 | H104-S106 PolarHBondContact O-N 3.48Š|
| 107 | N | 41.2 | Very low | 41 | Very low | 169 Ų | 169 | 146.6 Ų | 146.6 | 90% | 0.904 | 86% | 0.86 | S | S | * | * | P | Polyproline II helix | trans | -83 | 124.6 | 166.9 | -87.8 | -19.4 | 0 | 0 | 0 | 110 | ||
| 108 | S | 42.8 | Very low | 41.1 | Very low | 192 Ų | 192 | 148.8 Ų | 148.8 | 100% | 1.343 | 86% | 0.861 | S | S | * | * | trans | -154.2 | 0 | 144.9 | -178.6 | 0 | 0 | 0 | 0 | 109.9 |
Retrieved 108 of 108 residues in 210.5 ms
(Link to these results)