| 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 | 53.5 | Low | 59.7 | Low | 189 Ų | 189 | 93.1 Ų | 93.1 | 93% | 0.931 | 49% | 0.487 | S | S | * | . | 0 | -48.3 | 0 | -71.8 | 179.8 | 75.1 | 0 | 0 | 112.6 | L3 L4 F5 | M1-L3 PolarHBondContact O-N 2.72Å; M1-L4 VanDerWaalsContact O-CB 3.27Å; M1-L4 WeakPolarHBondContact O-CB 3.31Å; M1-L4 PolarHBondContact O-N 2.84Å; M1-F5 WeakPolarHBondContact O-CD2 3.26Å | |||
| 2 | I | 50.6 | Low | 59.4 | Low | 137 Ų | 137 | 95.5 Ų | 95.5 | 70% | 0.703 | 49% | 0.494 | S | S | * | . | H | α-helix | trans | -62 | -41.3 | -173.9 | -65.7 | 146.4 | 0 | 0 | 0 | 114.7 | L4 F5 I6 | I2-L4 PolarHBondContact O-N 3.43Å; I2-L4 VanDerWaalsContact O-N 3.09Å; I2-F5 PolarHBondContact O-N 3.45Å; I2-I6 HydrophobicContact CG2-CD1 3.84Å; I2-I6 HydrophobicContact CG2-CG1 4.42Å; I2-I6 WeakPolarHBondContact O-CG1 3.34Å; I2-I6 PolarHBondContact O-N 3.46Å |
| 3 | L | 58.5 | Low | 59.1 | Low | 142 Ų | 142 | 91.2 Ų | 91.2 | 74% | 0.743 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -56.7 | -32.2 | -177.5 | -164.3 | 75 | 0 | 0 | 0 | 113.1 | M1 L7 | M1-L3 PolarHBondContact O-N 2.72Å; L3-L7 PolarHBondContact O-N 3.39Å; L3-L7 VanDerWaalsContact O-N 3.15Å |
| 4 | L | 58.2 | Low | 58.3 | Low | 45 Ų | 45 | 88 Ų | 88 | 24% | 0.236 | 48% | 0.475 | C | S | . | . | H | α-helix | trans | -70.9 | -45.4 | -177 | -166.6 | 69.8 | 0 | 0 | 0 | 112.2 | M1 I2 I6 L7 L8 L69 F73 | M1-L4 VanDerWaalsContact O-CB 3.27Å; M1-L4 WeakPolarHBondContact O-CB 3.31Å; M1-L4 PolarHBondContact O-N 2.84Å; I2-L4 PolarHBondContact O-N 3.43Å; I2-L4 VanDerWaalsContact O-N 3.09Å; L4-I6 VanDerWaalsContact C-N 3.3Å; L4-I6 PolarHBondContact O-N 2.81Å; L4-L7 WeakPolarHBondContact O-CB 3.27Å; L4-L7 PolarHBondContact O-N 2.98Å; L4-L7 VanDerWaalsContact O-N 3.15Å; L4-L8 HydrophobicContact CG-CD1 4.17Å; L4-L8 WeakPolarHBondContact O-CD1 3.46Å; L4-L8 PolarHBondContact O-N 2.61Å; L4-L69 HydrophobicContact CD2-CD2 4.38Å; L4-F73 HydrophobicContact CD1-CE1 4.36Å; L4-F73 HydrophobicContact CD1-CE2 3.37Å; L4-F73 HydrophobicContact CD1-CZ 3.19Å; L4-F73 HydrophobicContact CD2-CD2 4.42Å; L4-F73 HydrophobicContact CD2-CE2 3.19Å; L4-F73 HydrophobicContact CD2-CZ 3.49Å; L4-F73 VanDerWaalsContact CD2-CZ 3.49Å; L4-F73 HydrophobicContact CG-CE2 3.49Å; L4-F73 VanDerWaalsContact CG-CE2 3.49Å; L4-F73 HydrophobicContact CG-CZ 3.27Å |
| 5 | F | 60.8 | Low | 57.8 | Low | 139 Ų | 139 | 88.3 Ų | 88.3 | 61% | 0.61 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -65.9 | -34.3 | 176.3 | -73.4 | -82.8 | 0 | 0 | 0 | 111.8 | M1 I2 L7 L8 G9 | M1-F5 WeakPolarHBondContact O-CD2 3.26Å; I2-F5 PolarHBondContact O-N 3.45Å; F5-L7 VanDerWaalsContact C-N 3.3Å; F5-L8 PolarHBondContact O-N 3.45Å; F5-G9 PolarHBondContact O-N 3.46Å |
| 6 | I | 65.7 | Low | 57.3 | Low | 94 Ų | 94 | 92.3 Ų | 92.3 | 48% | 0.482 | 50% | 0.495 | S | S | . | . | H | α-helix | trans | -63.9 | -40.4 | 173.4 | -62.4 | 168.8 | 0 | 0 | 0 | 110.1 | I2 L4 G9 L10 | I2-I6 HydrophobicContact CG2-CD1 3.84Å; I2-I6 HydrophobicContact CG2-CG1 4.42Å; I2-I6 WeakPolarHBondContact O-CG1 3.34Å; I2-I6 PolarHBondContact O-N 3.46Å; L4-I6 VanDerWaalsContact C-N 3.3Å; L4-I6 PolarHBondContact O-N 2.81Å; I6-G9 PolarHBondContact O-N 3.23Å; I6-L10 HydrophobicContact CG2-CD1 4.06Å; I6-L10 WeakPolarHBondContact O-CB 3.35Å; I6-L10 WeakPolarHBondContact O-CG 3.47Å; I6-L10 PolarHBondContact O-N 3.19Å |
| 7 | L | 62.9 | Low | 56.6 | Low | 51 Ų | 51 | 91.7 Ų | 91.7 | 27% | 0.267 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -68.7 | -41.2 | 178.1 | -158.9 | 77.3 | 0 | 0 | 0 | 112.4 | L3 L4 F5 L10 L11 W51 F55 | L3-L7 PolarHBondContact O-N 3.39Å; L3-L7 VanDerWaalsContact O-N 3.15Å; L4-L7 WeakPolarHBondContact O-CB 3.27Å; L4-L7 PolarHBondContact O-N 2.98Å; L4-L7 VanDerWaalsContact O-N 3.15Å; F5-L7 VanDerWaalsContact C-N 3.3Å; L7-L10 PolarHBondContact O-N 3.09Å; L7-L11 WeakPolarHBondContact O-CB 3.47Å; L7-L11 PolarHBondContact O-N 2.83Å; L7-W51 HydrophobicContact CD1-CH2 4.26Å; L7-F55 HydrophobicContact CD2-CD1 4.01Å; L7-F55 HydrophobicContact CD2-CE1 3.31Å; L7-F55 HydrophobicContact CD2-CZ 4.01Å |
| 8 | L | 62.9 | Low | 56 | Low | 38 Ų | 38 | 92.8 Ų | 92.8 | 20% | 0.199 | 52% | 0.516 | C | S | . | . | H | α-helix | trans | -63.1 | -44.2 | 172 | -85.2 | 105.1 | 0 | 0 | 0 | 111.8 | L4 F5 L10 L11 E12 F73 L76 | L4-L8 HydrophobicContact CG-CD1 4.17Å; L4-L8 WeakPolarHBondContact O-CD1 3.46Å; L4-L8 PolarHBondContact O-N 2.61Å; F5-L8 PolarHBondContact O-N 3.45Å; L8-L10 VanDerWaalsContact C-N 3.31Å; L8-L10 PolarHBondContact O-N 2.84Å; L8-L11 WeakPolarHBondContact O-CA 3.31Å; L8-L11 WeakPolarHBondContact O-CB 3.48Å; L8-L11 PolarHBondContact O-N 3.15Å; L8-E12 PolarHBondContact O-N 3.22Å; L8-F73 HydrophobicContact CD1-CE1 3.49Å; L8-F73 VanDerWaalsContact CD1-CE1 3.49Å; L8-F73 HydrophobicContact CD1-CZ 3.46Å; L8-F73 VanDerWaalsContact CD1-CZ 3.46Å; L8-F73 HydrophobicContact CD2-CE1 4.46Å; L8-F73 HydrophobicContact CG-CE1 4.21Å; L8-L76 HydrophobicContact CD2-CD2 3.48Å; L8-L76 VanDerWaalsContact CD2-CD2 3.48Å |
| 9 | G | 61.9 | Low | 55.4 | Low | 39 Ų | 39 | 91.4 Ų | 91.4 | 40% | 0.402 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -64.6 | -34.8 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | F5 I6 L11 G13 | F5-G9 PolarHBondContact O-N 3.46Å; I6-G9 PolarHBondContact O-N 3.23Å; G9-L11 VanDerWaalsContact C-N 3.35Å; G9-G13 PolarHBondContact O-N 3.47Å |
| 10 | L | 61.7 | Low | 54.9 | Low | 104 Ų | 104 | 93.9 Ų | 93.9 | 55% | 0.545 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -68.5 | -34.5 | 170.9 | -77.1 | 165.3 | 0 | 0 | 0 | 111.9 | I6 L7 L8 C14 | I6-L10 HydrophobicContact CG2-CD1 4.06Å; I6-L10 WeakPolarHBondContact O-CB 3.35Å; I6-L10 WeakPolarHBondContact O-CG 3.47Å; I6-L10 PolarHBondContact O-N 3.19Å; L7-L10 PolarHBondContact O-N 3.09Å; L8-L10 VanDerWaalsContact C-N 3.31Å; L8-L10 PolarHBondContact O-N 2.84Å; L10-C14 VanDerWaalsContact O-CB 3.23Å; L10-C14 WeakPolarHBondContact O-CB 3.35Å; L10-C14 PolarHBondContact O-N 3.42Å; L10-C14 PolarHBondContact O-SG 3.07Å |
| 11 | L | 59.9 | Low | 54.4 | Low | 46 Ų | 46 | 97.4 Ų | 97.4 | 24% | 0.241 | 54% | 0.537 | C | S | . | . | H | α-helix | trans | -70.7 | -45 | 177.5 | -166.6 | 66.2 | 0 | 0 | 0 | 111.7 | L7 L8 G9 C14 T15 F48 F77 | L7-L11 WeakPolarHBondContact O-CB 3.47Å; L7-L11 PolarHBondContact O-N 2.83Å; L8-L11 WeakPolarHBondContact O-CA 3.31Å; L8-L11 WeakPolarHBondContact O-CB 3.48Å; L8-L11 PolarHBondContact O-N 3.15Å; G9-L11 VanDerWaalsContact C-N 3.35Å; L11-C14 PolarHBondContact O-N 2.8Å; L11-T15 WeakPolarHBondContact O-CG2 3.32Å; L11-T15 PolarHBondContact O-N 3.08Å; L11-T15 PolarHBondContact O-OG1 3.29Å; L11-F48 HydrophobicContact CD1-CE1 3.96Å; L11-F48 HydrophobicContact CD1-CZ 4.26Å; L11-F77 HydrophobicContact CD2-CE1 4.44Å; L11-F77 HydrophobicContact CD2-CE2 4.32Å; L11-F77 HydrophobicContact CD2-CZ 3.62Å |
| 12 | E | 56.7 | Low | 54.1 | Low | 122 Ų | 122 | 94.8 Ų | 94.8 | 57% | 0.57 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -66.3 | -38.8 | 173.4 | -71.6 | -173.2 | 158.5 | 0 | 0 | 111.8 | L8 C14 T15 H16 | L8-E12 PolarHBondContact O-N 3.22Å; E12-C14 VanDerWaalsContact C-N 3.32Å; E12-C14 PolarHBondContact O-N 2.94Å; E12-T15 PolarHBondContact O-N 3.45Å; E12-T15 PolarHBondContact O-OG1 2.92Å; E12-H16 WeakPolarHBondContact O-CB 3.32Å; E12-H16 PolarHBondContact O-N 2.93Å |
| 13 | G | 54.8 | Low | 53.8 | Low | 40 Ų | 40 | 93.8 Ų | 93.8 | 41% | 0.412 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -64.1 | -36.2 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | G9 S17 | G9-G13 PolarHBondContact O-N 3.47Å; G13-S17 VanDerWaalsContact O-CB 3.3Å; G13-S17 WeakPolarHBondContact O-CB 3.43Å; G13-S17 PolarHBondContact O-N 2.94Å |
| 14 | C | 48.3 | Very low | 53.1 | Low | 46 Ų | 46 | 91.1 Ų | 91.1 | 31% | 0.311 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -72.5 | -36.6 | 176.1 | -80.8 | 0 | 0 | 0 | 0 | 112.7 | L10 L11 E12 S18 | L10-C14 VanDerWaalsContact O-CB 3.23Å; L10-C14 WeakPolarHBondContact O-CB 3.35Å; L10-C14 PolarHBondContact O-N 3.42Å; L10-C14 PolarHBondContact O-SG 3.07Å; L11-C14 PolarHBondContact O-N 2.8Å; E12-C14 VanDerWaalsContact C-N 3.32Å; E12-C14 PolarHBondContact O-N 2.94Å; C14-S18 PolarHBondContact O-N 2.83Å |
| 15 | T | 51.2 | Low | 52.6 | Low | 92 Ų | 92 | 95.5 Ų | 95.5 | 56% | 0.564 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -72 | -31 | 174.6 | 56.6 | 0 | 0 | 0 | 0 | 111.9 | L11 E12 | L11-T15 WeakPolarHBondContact O-CG2 3.32Å; L11-T15 PolarHBondContact O-N 3.08Å; L11-T15 PolarHBondContact O-OG1 3.29Å; E12-T15 PolarHBondContact O-N 3.45Å; E12-T15 PolarHBondContact O-OG1 2.92Å |
| 16 | H | 48.7 | Very low | 52 | Low | 153 Ų | 153 | 93.7 Ų | 93.7 | 71% | 0.708 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -77.2 | -31.9 | 174 | -133.2 | 94.8 | 0 | 0 | 0 | 113.2 | E12 S18 A19 | E12-H16 WeakPolarHBondContact O-CB 3.32Å; E12-H16 PolarHBondContact O-N 2.93Å; H16-S18 VanDerWaalsContact C-N 3.3Å; H16-S18 PolarHBondContact O-N 3.35Å; H16-A19 PolarHBondContact O-N 3.26Å; H16-A19 VanDerWaalsContact O-N 3.12Å |
| 17 | S | 46.4 | Very low | 51.2 | Low | 82 Ų | 82 | 97 Ų | 97 | 57% | 0.573 | 58% | 0.577 | S | S | * | * | H | α-helix | trans | -73.7 | -17.1 | 177.6 | -170.5 | 0 | 0 | 0 | 0 | 113.8 | G13 A19 | G13-S17 VanDerWaalsContact O-CB 3.3Å; G13-S17 WeakPolarHBondContact O-CB 3.43Å; G13-S17 PolarHBondContact O-N 2.94Å; S17-A19 VanDerWaalsContact C-N 3.35Å |
| 18 | S | 46.2 | Very low | 50.1 | Low | 112 Ų | 112 | 99.8 Ų | 99.8 | 78% | 0.783 | 60% | 0.596 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.9 | -7.7 | 168.5 | -77.1 | 0 | 0 | 0 | 0 | 113.5 | C14 H16 I20 | C14-S18 PolarHBondContact O-N 2.83Å; H16-S18 VanDerWaalsContact C-N 3.3Å; H16-S18 PolarHBondContact O-N 3.35Å; S18-I20 VanDerWaalsContact C-N 3.32Å; S18-I20 PolarHBondContact O-N 3.42Å |
| 19 | A | 43.3 | Very low | 48.9 | Very low | 66 Ų | 66 | 107.4 Ų | 107.4 | 55% | 0.545 | 63% | 0.628 | S | S | . | * | trans | -96.2 | 51.3 | 170.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | H16 S17 K21 | H16-A19 PolarHBondContact O-N 3.26Å; H16-A19 VanDerWaalsContact O-N 3.12Å; S17-A19 VanDerWaalsContact C-N 3.35Å; A19-K21 VanDerWaalsContact C-N 3.3Å; A19-K21 PolarHBondContact O-N 2.92Å | ||
| 20 | I | 46.8 | Very low | 48.1 | Very low | 141 Ų | 141 | 112 Ų | 112 | 72% | 0.723 | 65% | 0.648 | S | S | * | * | trans | -70.3 | 97.2 | 162.6 | -63.7 | 169.6 | 0 | 0 | 0 | 106.3 | S18 | S18-I20 VanDerWaalsContact C-N 3.32Å; S18-I20 PolarHBondContact O-N 3.42Å | ||
| 21 | K | 44.3 | Very low | 47.3 | Very low | 167 Ų | 167 | 113.1 Ų | 113.1 | 73% | 0.726 | 65% | 0.654 | S | S | * | * | trans | -44.1 | 124.7 | 165.9 | -83.5 | 176.1 | 171.1 | 176.5 | 0 | 109.5 | A19 T23 | A19-K21 VanDerWaalsContact C-N 3.3Å; A19-K21 PolarHBondContact O-N 2.92Å; K21-T23 PolarHBondContact O-N 3.47Å | ||
| 22 | P | 45.5 | Very low | 46.5 | Very low | 134 Ų | 134 | 119.2 Ų | 119.2 | 87% | 0.87 | 69% | 0.687 | S | S | * | * | trans | -74.8 | 87 | 162.1 | 30.6 | -28 | 0 | 0 | 0 | 106.7 | ||||
| 23 | T | 45.4 | Very low | 46.1 | Very low | 117 Ų | 117 | 118.2 Ų | 118.2 | 72% | 0.718 | 69% | 0.69 | S | S | * | * | trans | -113.7 | 90.5 | 170.1 | -52 | 0 | 0 | 0 | 0 | 107.9 | K21 | K21-T23 PolarHBondContact O-N 3.47Š| ||
| 24 | S | 44.1 | Very low | 45.7 | Very low | 86 Ų | 86 | 125.2 Ų | 125.2 | 60% | 0.601 | 71% | 0.712 | S | S | * | * | trans | 168 | 111.1 | 136.5 | -172.6 | 0 | 0 | 0 | 0 | 110 | V26 | S24-V26 PolarHBondContact O-N 2.86Å; S24-V26 VanDerWaalsContact O-N 3.15Å | ||
| 25 | P | 47 | Very low | 45.9 | Very low | 136 Ų | 136 | 129 Ų | 129 | 88% | 0.883 | 73% | 0.733 | S | S | * | * | trans | -85.4 | 66.9 | 170.2 | 35.9 | -29.9 | 0 | 0 | 0 | 108.7 | ||||
| 26 | V | 48.1 | Very low | 45.7 | Very low | 101 Ų | 101 | 129.5 Ų | 129.5 | 61% | 0.612 | 74% | 0.736 | S | S | * | * | trans | -146.4 | 114.4 | 176.5 | -177.1 | 0 | 0 | 0 | 0 | 108.2 | S24 | S24-V26 PolarHBondContact O-N 2.86Å; S24-V26 VanDerWaalsContact O-N 3.15Å | ||
| 27 | L | 49.1 | Very low | 45.8 | Very low | 163 Ų | 163 | 127 Ų | 127 | 85% | 0.853 | 73% | 0.734 | S | S | * | * | trans | 142.2 | 65 | 167 | -77.8 | 163.5 | 0 | 0 | 0 | 107.4 | ||||
| 28 | T | 39.2 | Very low | 46 | Very low | 111 Ų | 111 | 129.5 Ų | 129.5 | 68% | 0.681 | 75% | 0.745 | S | S | * | * | 61.9 | 110.9 | 85.5 | -44.3 | 0 | 0 | 0 | 0 | 112.8 | |||||
| 29 | K | 38.3 | Very low | 46.1 | Very low | 197 Ų | 197 | 129.4 Ų | 129.4 | 86% | 0.857 | 74% | 0.74 | S | S | * | * | trans | 58.4 | 74.2 | 154.3 | -71.7 | 179.3 | 168.5 | 179.4 | 0 | 117.4 | ||||
| 30 | V | 45.5 | Very low | 46.3 | Very low | 137 Ų | 137 | 131.4 Ų | 131.4 | 83% | 0.83 | 75% | 0.75 | S | S | * | * | trans | -144.4 | 99 | 147.3 | -174.8 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 31 | N | 44 | Very low | 46.4 | Very low | 127 Ų | 127 | 128.5 Ų | 128.5 | 68% | 0.679 | 74% | 0.742 | S | S | * | * | trans | 46.2 | 100 | 136.8 | -159.8 | 28.2 | 0 | 0 | 0 | 118.4 | T33 | N31-T33 PolarHBondContact O-N 3.43Å; N31-T33 PolarHBondContact O-OG1 3.46Å | ||
| 32 | N | 44.6 | Very low | 46.5 | Very low | 173 Ų | 173 | 130.7 Ų | 130.7 | 93% | 0.925 | 75% | 0.746 | S | S | * | * | S | Bend | trans | 22.8 | 24.7 | 134.9 | -81.6 | 20.7 | 0 | 0 | 0 | 123 | ||
| 33 | T | 47 | Very low | 46.7 | Very low | 102 Ų | 102 | 130.5 Ų | 130.5 | 63% | 0.626 | 73% | 0.733 | S | S | * | * | trans | -129.3 | 112.9 | 172 | -1.9 | 0 | 0 | 0 | 0 | 107.6 | N31 V35 | N31-T33 PolarHBondContact O-N 3.43Å; N31-T33 PolarHBondContact O-OG1 3.46Å; T33-V35 WeakPolarHBondContact O-CG2 3.46Å; T33-V35 PolarHBondContact O-N 2.96Å | ||
| 34 | E | 47.4 | Very low | 46.7 | Very low | 187 Ų | 187 | 133.7 Ų | 133.7 | 87% | 0.874 | 73% | 0.732 | S | S | * | * | trans | -63.5 | 79.3 | 175.1 | -165.3 | 172.7 | -162.9 | 0 | 0 | 108.7 | T36 | E34-T36 VanDerWaalsContact C-N 3.27Å; E34-T36 PolarHBondContact O-N 3.02Å; E34-T36 VanDerWaalsContact O-N 3.08Å | ||
| 35 | V | 51.5 | Low | 47.3 | Very low | 124 Ų | 124 | 133 Ų | 133 | 75% | 0.752 | 73% | 0.727 | S | S | * | * | trans | -81.5 | 84.6 | 172.8 | -148.1 | 0 | 0 | 0 | 0 | 105.9 | T33 P37 | T33-V35 WeakPolarHBondContact O-CG2 3.46Å; T33-V35 PolarHBondContact O-N 2.96Å; V35-P37 WeakPolarHBondContact O-CD 3.39Å | ||
| 36 | T | 47.7 | Very low | 47.9 | Very low | 104 Ų | 104 | 129.1 Ų | 129.1 | 64% | 0.638 | 70% | 0.703 | S | S | * | * | trans | -55.4 | 114.4 | 167.7 | -44.5 | 0 | 0 | 0 | 0 | 106.7 | E34 T38 | E34-T36 VanDerWaalsContact C-N 3.27Å; E34-T36 PolarHBondContact O-N 3.02Å; E34-T36 VanDerWaalsContact O-N 3.08Å; T36-T38 VanDerWaalsContact C-N 3.32Å; T36-T38 PolarHBondContact O-N 3.15Å | ||
| 37 | P | 51.4 | Low | 48.7 | Very low | 101 Ų | 101 | 131.3 Ų | 131.3 | 66% | 0.656 | 70% | 0.704 | S | S | * | * | trans | -67.1 | 103.3 | 171.4 | 27.1 | -29 | 0 | 0 | 0 | 105.4 | V35 V39 | V35-P37 WeakPolarHBondContact O-CD 3.39Å; P37-V39 VanDerWaalsContact O-CG2 3.28Å; P37-V39 WeakPolarHBondContact O-CG2 3.35Å; P37-V39 PolarHBondContact O-N 3.36Å | ||
| 38 | T | 48.8 | Very low | 49.5 | Very low | 133 Ų | 133 | 126.4 Ų | 126.4 | 82% | 0.816 | 68% | 0.677 | S | S | * | * | trans | -60.9 | 91.3 | 165.2 | -63.2 | 0 | 0 | 0 | 0 | 105.8 | T36 S40 | T36-T38 VanDerWaalsContact C-N 3.32Å; T36-T38 PolarHBondContact O-N 3.15Å; T38-S40 PolarHBondContact O-N 2.85Å | ||
| 39 | V | 49.8 | Very low | 50.7 | Low | 110 Ų | 110 | 129.6 Ų | 129.6 | 67% | 0.667 | 68% | 0.676 | S | S | * | * | trans | -64.7 | 94.1 | 173.1 | -150.6 | 0 | 0 | 0 | 0 | 104.9 | P37 S41 | P37-V39 VanDerWaalsContact O-CG2 3.28Å; P37-V39 WeakPolarHBondContact O-CG2 3.35Å; P37-V39 PolarHBondContact O-N 3.36Å; V39-S41 PolarHBondContact O-N 3.46Å; V39-S41 PolarHBondContact O-OG 3.31Å | ||
| 40 | S | 46.2 | Very low | 52.3 | Low | 109 Ų | 109 | 123.1 Ų | 123.1 | 76% | 0.762 | 66% | 0.655 | S | S | * | * | trans | -66.2 | 66.6 | 166.9 | -178.8 | 0 | 0 | 0 | 0 | 108.2 | T38 | T38-S40 PolarHBondContact O-N 2.85Š| ||
| 41 | S | 49.1 | Very low | 53.7 | Low | 79 Ų | 79 | 122.8 Ų | 122.8 | 55% | 0.552 | 64% | 0.639 | S | S | * | * | trans | -100 | 1.1 | -176.2 | 52 | 0 | 0 | 0 | 0 | 112 | V39 | V39-S41 PolarHBondContact O-N 3.46Å; V39-S41 PolarHBondContact O-OG 3.31Å | ||
| 42 | R | 47.6 | Very low | 55 | Low | 213 Ų | 213 | 118.5 Ų | 118.5 | 80% | 0.804 | 62% | 0.616 | S | S | * | * | S | Bend | trans | -114.2 | -5.7 | -168.8 | -77.3 | -170.1 | -166.1 | 179.4 | 5.2 | 116.9 | ||
| 43 | H | 48.3 | Very low | 56.4 | Low | 131 Ų | 131 | 114.5 Ų | 114.5 | 61% | 0.606 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -90 | -27.6 | -176.8 | -149.5 | -26.1 | 0 | 0 | 0 | 113.9 | S46 | H43-S46 PolarHBondContact O-OG 3.02Å |
| 44 | W | 45.6 | Very low | 57.7 | Low | 183 Ų | 183 | 117.5 Ų | 117.5 | 69% | 0.693 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -79.9 | -33.2 | -178.3 | -153.4 | 65.4 | 0 | 0 | 0 | 112.4 | S46 K47 F48 | W44-S46 VanDerWaalsContact C-N 3.32Å; W44-S46 PolarHBondContact O-N 2.83Å; W44-K47 PolarHBondContact O-N 3.35Å; W44-F48 WeakPolarHBondContact O-CB 3.49Å; W44-F48 PolarHBondContact O-N 3.35Å; W44-F48 VanDerWaalsContact O-N 3.08Å |
| 45 | S | 57.8 | Low | 59.1 | Low | 73 Ų | 73 | 111.1 Ų | 111.1 | 51% | 0.51 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -66.1 | -32.2 | -177.9 | 82.2 | 0 | 0 | 0 | 0 | 112.9 | R49 | S45-R49 WeakPolarHBondContact O-CB 3.49Å; S45-R49 PolarHBondContact O-N 2.85Å |
| 46 | S | 59.6 | Low | 60 | Low | 54 Ų | 54 | 109.1 Ų | 109.1 | 38% | 0.378 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -69.8 | -45.6 | 179.4 | 63.6 | 0 | 0 | 0 | 0 | 112.1 | H43 W44 R49 S50 | H43-S46 PolarHBondContact O-OG 3.02Å; W44-S46 VanDerWaalsContact C-N 3.32Å; W44-S46 PolarHBondContact O-N 2.83Å; S46-R49 PolarHBondContact O-N 3.35Å; S46-S50 WeakPolarHBondContact O-CB 3.45Å; S46-S50 PolarHBondContact O-N 3.43Å; S46-S50 PolarHBondContact O-OG 3.2Å; S46-S50 VanDerWaalsContact O-OG 3.13Å |
| 47 | K | 63.4 | Low | 61.3 | Low | 146 Ų | 146 | 109.6 Ų | 109.6 | 64% | 0.635 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -65.1 | -45.6 | 177.8 | -73.3 | -169.9 | 178.2 | -176.3 | 0 | 111.6 | W44 S50 W51 | W44-K47 PolarHBondContact O-N 3.35Å; K47-S50 PolarHBondContact O-N 3.41Å; K47-W51 VanDerWaalsContact O-CB 3.3Å; K47-W51 WeakPolarHBondContact O-CB 3.44Å; K47-W51 PolarHBondContact O-N 2.76Å |
| 48 | F | 66.8 | Low | 62.4 | Low | 61 Ų | 61 | 109.7 Ų | 109.7 | 27% | 0.268 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -64.4 | -42.3 | 178.1 | -177.8 | -99.2 | 0 | 0 | 0 | 111.5 | L11 W44 W51 L52 | L11-F48 HydrophobicContact CD1-CE1 3.96Å; L11-F48 HydrophobicContact CD1-CZ 4.26Å; W44-F48 WeakPolarHBondContact O-CB 3.49Å; W44-F48 PolarHBondContact O-N 3.35Å; W44-F48 VanDerWaalsContact O-N 3.08Å; F48-W51 HydrophobicContact CD2-CE3 4.11Å; F48-W51 HydrophobicContact CD2-CZ3 4.43Å; F48-W51 AromaticContact CE2-CE3 3.97Å; F48-W51 HydrophobicContact CE2-CE3 3.97Å; F48-W51 AromaticContact CE2-CZ3 3.86Å; F48-W51 HydrophobicContact CE2-CZ3 3.86Å; F48-W51 HydrophobicContact CZ-CZ3 4.49Å; F48-W51 PolarHBondContact O-N 3.16Å; F48-L52 HydrophobicContact CE1-CD2 4.31Å; F48-L52 VanDerWaalsContact O-CB 3.24Å; F48-L52 WeakPolarHBondContact O-CB 3.12Å; F48-L52 PolarHBondContact O-N 3.39Å |
| 49 | R | 63.9 | Low | 63.3 | Low | 177 Ų | 177 | 105.4 Ų | 105.4 | 67% | 0.668 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -63.8 | -45.3 | 177.2 | -179.8 | 176.1 | 155.2 | -157.4 | -6.3 | 111.9 | S45 S46 L52 I53 | S45-R49 WeakPolarHBondContact O-CB 3.49Å; S45-R49 PolarHBondContact O-N 2.85Å; S46-R49 PolarHBondContact O-N 3.35Å; R49-L52 PolarHBondContact O-N 2.88Å; R49-I53 HydrophobicContact CG-CD1 4.09Å; R49-I53 VanDerWaalsContact O-CG1 3.25Å; R49-I53 WeakPolarHBondContact O-CG1 3.48Å; R49-I53 PolarHBondContact O-N 3.32Å |
| 50 | S | 72.4 | Confident | 64.1 | Low | 61 Ų | 61 | 107.9 Ų | 107.9 | 43% | 0.427 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -61.9 | -45.4 | 175.4 | -64.3 | 0 | 0 | 0 | 0 | 111.3 | S46 K47 L52 I53 Y54 | S46-S50 WeakPolarHBondContact O-CB 3.45Å; S46-S50 PolarHBondContact O-N 3.43Å; S46-S50 PolarHBondContact O-OG 3.2Å; S46-S50 VanDerWaalsContact O-OG 3.13Å; K47-S50 PolarHBondContact O-N 3.41Å; S50-L52 VanDerWaalsContact C-N 3.33Å; S50-L52 PolarHBondContact O-N 2.92Å; S50-I53 PolarHBondContact O-N 2.85Å; S50-Y54 WeakPolarHBondContact O-CD2 3.35Å; S50-Y54 PolarHBondContact O-N 3.48Å |
| 51 | W | 74.3 | Confident | 65.2 | Low | 130 Ų | 130 | 107.8 Ų | 107.8 | 49% | 0.492 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -60 | -42.7 | 176 | 177.4 | 78.2 | 0 | 0 | 0 | 112.3 | L7 K47 F48 I53 Y54 F55 | L7-W51 HydrophobicContact CD1-CH2 4.26Å; K47-W51 VanDerWaalsContact O-CB 3.3Å; K47-W51 WeakPolarHBondContact O-CB 3.44Å; K47-W51 PolarHBondContact O-N 2.76Å; F48-W51 HydrophobicContact CD2-CE3 4.11Å; F48-W51 HydrophobicContact CD2-CZ3 4.43Å; F48-W51 AromaticContact CE2-CE3 3.97Å; F48-W51 HydrophobicContact CE2-CE3 3.97Å; F48-W51 AromaticContact CE2-CZ3 3.86Å; F48-W51 HydrophobicContact CE2-CZ3 3.86Å; F48-W51 HydrophobicContact CZ-CZ3 4.49Å; F48-W51 PolarHBondContact O-N 3.16Å; W51-I53 PolarHBondContact O-N 3.25Å; W51-Y54 PolarHBondContact O-N 3.13Å; W51-F55 VanDerWaalsContact O-CB 3.29Å; W51-F55 WeakPolarHBondContact O-CB 3.45Å; W51-F55 PolarHBondContact O-N 2.97Å |
| 52 | L | 72.5 | Confident | 65.9 | Low | 37 Ų | 37 | 110.4 Ų | 110.4 | 19% | 0.194 | 51% | 0.51 | C | S | . | . | H | α-helix | trans | -63 | -40.7 | 177.5 | -174.4 | 68.5 | 0 | 0 | 0 | 111.6 | F48 R49 S50 F55 L56 | F48-L52 HydrophobicContact CE1-CD2 4.31Å; F48-L52 VanDerWaalsContact O-CB 3.24Å; F48-L52 WeakPolarHBondContact O-CB 3.12Å; F48-L52 PolarHBondContact O-N 3.39Å; R49-L52 PolarHBondContact O-N 2.88Å; S50-L52 VanDerWaalsContact C-N 3.33Å; S50-L52 PolarHBondContact O-N 2.92Å; L52-F55 PolarHBondContact O-N 3.39Å; L52-L56 HydrophobicContact CG-CD1 4.2Å; L52-L56 WeakPolarHBondContact O-CB 3.33Å; L52-L56 VanDerWaalsContact O-CG 3.29Å; L52-L56 WeakPolarHBondContact O-CG 3.43Å; L52-L56 PolarHBondContact O-N 3.22Å |
| 53 | I | 73.4 | Confident | 66.6 | Low | 89 Ų | 89 | 104.5 Ų | 104.5 | 46% | 0.456 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -62.9 | -50.6 | 176.5 | -68.1 | 163.4 | 0 | 0 | 0 | 110.4 | R49 S50 W51 F55 L56 E57 | R49-I53 HydrophobicContact CG-CD1 4.09Å; R49-I53 VanDerWaalsContact O-CG1 3.25Å; R49-I53 WeakPolarHBondContact O-CG1 3.48Å; R49-I53 PolarHBondContact O-N 3.32Å; S50-I53 PolarHBondContact O-N 2.85Å; W51-I53 PolarHBondContact O-N 3.25Å; I53-F55 VanDerWaalsContact C-N 3.25Å; I53-F55 PolarHBondContact O-N 3.46Å; I53-L56 PolarHBondContact O-N 3.05Å; I53-E57 WeakPolarHBondContact O-CB 3.47Å; I53-E57 PolarHBondContact O-N 3.05Å |
| 54 | Y | 74.7 | Confident | 67 | Low | 166 Ų | 166 | 100.3 Ų | 100.3 | 65% | 0.651 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -59.8 | -38.1 | 176.7 | -74.2 | -62.4 | 0 | 0 | 0 | 112.2 | S50 W51 E57 L58 | S50-Y54 WeakPolarHBondContact O-CD2 3.35Å; S50-Y54 PolarHBondContact O-N 3.48Å; W51-Y54 PolarHBondContact O-N 3.13Å; Y54-E57 PolarHBondContact O-N 3.43Å; Y54-L58 WeakPolarHBondContact O-CB 3.34Å; Y54-L58 PolarHBondContact O-N 3.19Å |
| 55 | F | 76.2 | Confident | 67.5 | Low | 52 Ų | 52 | 98.8 Ų | 98.8 | 23% | 0.228 | 49% | 0.487 | C | S | . | . | H | α-helix | trans | -66.6 | -42.4 | 177.1 | -178.3 | -100.6 | 0 | 0 | 0 | 112.1 | L7 W51 L52 I53 L58 L59 | L7-F55 HydrophobicContact CD2-CD1 4.01Å; L7-F55 HydrophobicContact CD2-CE1 3.31Å; L7-F55 HydrophobicContact CD2-CZ 4.01Å; W51-F55 VanDerWaalsContact O-CB 3.29Å; W51-F55 WeakPolarHBondContact O-CB 3.45Å; W51-F55 PolarHBondContact O-N 2.97Å; L52-F55 PolarHBondContact O-N 3.39Å; I53-F55 VanDerWaalsContact C-N 3.25Å; I53-F55 PolarHBondContact O-N 3.46Å; F55-L58 PolarHBondContact O-N 2.87Å; F55-L59 HydrophobicContact CD1-CD1 3.67Å; F55-L59 HydrophobicContact CD1-CG 4.24Å; F55-L59 HydrophobicContact CE1-CD1 3.25Å; F55-L59 HydrophobicContact CE1-CD2 4.44Å; F55-L59 HydrophobicContact CE1-CG 3.87Å; F55-L59 HydrophobicContact CZ-CD1 3.92Å; F55-L59 HydrophobicContact CZ-CD2 4.3Å; F55-L59 HydrophobicContact CZ-CG 4.09Å; F55-L59 WeakPolarHBondContact O-CB 3.41Å; F55-L59 WeakPolarHBondContact O-CG 3.23Å; F55-L59 PolarHBondContact O-N 2.91Å |
| 56 | L | 69.8 | Low | 67.4 | Low | 83 Ų | 83 | 104.5 Ų | 104.5 | 44% | 0.435 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -64.9 | -38.4 | 174.7 | -73.8 | 169 | 0 | 0 | 0 | 112 | L52 I53 L59 R60 | L52-L56 HydrophobicContact CG-CD1 4.2Å; L52-L56 WeakPolarHBondContact O-CB 3.33Å; L52-L56 VanDerWaalsContact O-CG 3.29Å; L52-L56 WeakPolarHBondContact O-CG 3.43Å; L52-L56 PolarHBondContact O-N 3.22Å; I53-L56 PolarHBondContact O-N 3.05Å; L56-L59 HydrophobicContact CD2-CD1 4.32Å; L56-L59 WeakPolarHBondContact O-CB 3.42Å; L56-L59 PolarHBondContact O-N 3.35Å; L56-R60 WeakPolarHBondContact O-CB 3.43Å; L56-R60 PolarHBondContact O-N 3.32Å |
| 57 | E | 74.5 | Confident | 67.4 | Low | 114 Ų | 114 | 105.4 Ų | 105.4 | 53% | 0.533 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -67.4 | -39.8 | 176.1 | -167.5 | 170.6 | -162.6 | 0 | 0 | 111.7 | I53 Y54 R60 T61 | I53-E57 WeakPolarHBondContact O-CB 3.47Å; I53-E57 PolarHBondContact O-N 3.05Å; Y54-E57 PolarHBondContact O-N 3.43Å; E57-R60 PolarHBondContact O-N 3.48Å; E57-T61 PolarHBondContact O-N 2.91Å; E57-T61 PolarHBondContact O-OG1 2.88Å |
| 58 | L | 74.6 | Confident | 67.5 | Low | 103 Ų | 103 | 103 Ų | 103 | 54% | 0.539 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -63.3 | -45.3 | 171.5 | -175.2 | 68.3 | 0 | 0 | 0 | 111 | Y54 F55 R60 T61 L62 | Y54-L58 WeakPolarHBondContact O-CB 3.34Å; Y54-L58 PolarHBondContact O-N 3.19Å; F55-L58 PolarHBondContact O-N 2.87Å; L58-R60 VanDerWaalsContact C-N 3.34Å; L58-R60 PolarHBondContact O-N 3.39Å; L58-T61 WeakPolarHBondContact O-CB 3.37Å; L58-T61 PolarHBondContact O-N 2.9Å; L58-T61 VanDerWaalsContact O-N 3.16Å; L58-L62 WeakPolarHBondContact O-CB 3.5Å; L58-L62 PolarHBondContact O-N 2.73Å |
| 59 | L | 67.7 | Low | 67.2 | Low | 43 Ų | 43 | 103.7 Ų | 103.7 | 23% | 0.225 | 50% | 0.503 | C | S | . | . | H | α-helix | trans | -59.1 | -44.1 | 175.1 | -79.7 | 172.3 | 0 | 0 | 0 | 111.6 | F55 L56 T61 L62 F63 | F55-L59 HydrophobicContact CD1-CD1 3.67Å; F55-L59 HydrophobicContact CD1-CG 4.24Å; F55-L59 HydrophobicContact CE1-CD1 3.25Å; F55-L59 HydrophobicContact CE1-CD2 4.44Å; F55-L59 HydrophobicContact CE1-CG 3.87Å; F55-L59 HydrophobicContact CZ-CD1 3.92Å; F55-L59 HydrophobicContact CZ-CD2 4.3Å; F55-L59 HydrophobicContact CZ-CG 4.09Å; F55-L59 WeakPolarHBondContact O-CB 3.41Å; F55-L59 WeakPolarHBondContact O-CG 3.23Å; F55-L59 PolarHBondContact O-N 2.91Å; L56-L59 HydrophobicContact CD2-CD1 4.32Å; L56-L59 WeakPolarHBondContact O-CB 3.42Å; L56-L59 PolarHBondContact O-N 3.35Å; L59-T61 PolarHBondContact O-N 3.35Å; L59-L62 PolarHBondContact O-N 2.89Å; L59-F63 HydrophobicContact CB-CD2 4.49Å; L59-F63 HydrophobicContact CD2-CD2 3.69Å; L59-F63 HydrophobicContact CD2-CE2 3.46Å; L59-F63 VanDerWaalsContact CD2-CE2 3.46Å; L59-F63 WeakPolarHBondContact O-CB 3.29Å; L59-F63 WeakPolarHBondContact O-CD2 3.45Å; L59-F63 PolarHBondContact O-N 3.15Å |
| 60 | R | 66.8 | Low | 67.1 | Low | 161 Ų | 161 | 98.7 Ų | 98.7 | 61% | 0.608 | 49% | 0.489 | S | S | * | . | H | α-helix | trans | -59 | -39.2 | 176.3 | -177.1 | -178.7 | 179.1 | 179.4 | 1.6 | 111.4 | L56 E57 L58 G64 | L56-R60 WeakPolarHBondContact O-CB 3.43Å; L56-R60 PolarHBondContact O-N 3.32Å; E57-R60 PolarHBondContact O-N 3.48Å; L58-R60 VanDerWaalsContact C-N 3.34Å; L58-R60 PolarHBondContact O-N 3.39Å; R60-G64 VanDerWaalsContact O-CA 3.31Å; R60-G64 WeakPolarHBondContact O-CA 3.29Å; R60-G64 PolarHBondContact O-N 2.88Å; R60-G64 VanDerWaalsContact O-N 3.07Å |
| 61 | T | 69.6 | Low | 66.8 | Low | 108 Ų | 108 | 102.5 Ų | 102.5 | 66% | 0.663 | 50% | 0.5 | S | S | * | . | H | α-helix | trans | -72 | -45.2 | 178.4 | -53.2 | 0 | 0 | 0 | 0 | 111.4 | E57 L58 L59 G64 | E57-T61 PolarHBondContact O-N 2.91Å; E57-T61 PolarHBondContact O-OG1 2.88Å; L58-T61 WeakPolarHBondContact O-CB 3.37Å; L58-T61 PolarHBondContact O-N 2.9Å; L58-T61 VanDerWaalsContact O-N 3.16Å; L59-T61 PolarHBondContact O-N 3.35Å; T61-G64 PolarHBondContact O-N 3Å |
| 62 | L | 64.4 | Low | 66.4 | Low | 134 Ų | 134 | 102.5 Ų | 102.5 | 70% | 0.702 | 50% | 0.503 | S | S | * | . | H | α-helix | trans | -71.7 | -41.2 | -175.7 | -150.4 | 86.5 | 0 | 0 | 0 | 112.4 | L58 L59 G64 | L58-L62 WeakPolarHBondContact O-CB 3.5Å; L58-L62 PolarHBondContact O-N 2.73Å; L59-L62 PolarHBondContact O-N 2.89Å; L62-G64 VanDerWaalsContact C-N 3.32Å |
| 63 | F | 62.3 | Low | 66 | Low | 89 Ų | 89 | 102.7 Ų | 102.7 | 39% | 0.39 | 50% | 0.503 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92.1 | 5.2 | 177.7 | -70.4 | -81.5 | 0 | 0 | 0 | 112.9 | L59 L65 N67 | L59-F63 HydrophobicContact CB-CD2 4.49Å; L59-F63 HydrophobicContact CD2-CD2 3.69Å; L59-F63 HydrophobicContact CD2-CE2 3.46Å; L59-F63 VanDerWaalsContact CD2-CE2 3.46Å; L59-F63 WeakPolarHBondContact O-CB 3.29Å; L59-F63 WeakPolarHBondContact O-CD2 3.45Å; L59-F63 PolarHBondContact O-N 3.15Å; F63-L65 PolarHBondContact O-N 3.39Å; F63-N67 PolarHBondContact O-ND2 3.12Å |
| 64 | G | 57 | Low | 65.5 | Low | 42 Ų | 42 | 103.5 Ų | 103.5 | 43% | 0.433 | 51% | 0.507 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 25.1 | 87.3 | 171.6 | 0 | 0 | 0 | 0 | 0 | 115.4 | R60 T61 L62 K66 | R60-G64 VanDerWaalsContact O-CA 3.31Å; R60-G64 WeakPolarHBondContact O-CA 3.29Å; R60-G64 PolarHBondContact O-N 2.88Å; R60-G64 VanDerWaalsContact O-N 3.07Å; T61-G64 PolarHBondContact O-N 3Å; L62-G64 VanDerWaalsContact C-N 3.32Å; G64-K66 VanDerWaalsContact O-CB 3.26Å; G64-K66 WeakPolarHBondContact O-CB 3.47Å; G64-K66 PolarHBondContact O-N 2.89Å |
| 65 | L | 55 | Low | 65 | Low | 152 Ų | 152 | 99 Ų | 99 | 80% | 0.796 | 50% | 0.5 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 39.6 | 0.4 | 166.5 | -146.1 | 95.5 | 0 | 0 | 0 | 120 | F63 | F63-L65 PolarHBondContact O-N 3.39Š|
| 66 | K | 56.9 | Low | 64.3 | Low | 192 Ų | 192 | 100.8 Ų | 100.8 | 84% | 0.835 | 51% | 0.511 | S | S | * | . | trans | -127.8 | 12.2 | -159.3 | -143.7 | -178.2 | -179.4 | -175.7 | 0 | 113.3 | G64 | G64-K66 VanDerWaalsContact O-CB 3.26Å; G64-K66 WeakPolarHBondContact O-CB 3.47Å; G64-K66 PolarHBondContact O-N 2.89Å | ||
| 67 | N | 59.9 | Low | 63.8 | Low | 74 Ų | 74 | 100.7 Ų | 100.7 | 40% | 0.396 | 51% | 0.508 | S | S | . | . | trans | -110.5 | 116 | -179.2 | -72.8 | -47.1 | 0 | 0 | 0 | 109.4 | F63 L69 M70 | F63-N67 PolarHBondContact O-ND2 3.12Å; N67-L69 HydrophobicContact CB-CB 4.26Å; N67-L69 PolarHBondContact O-N 3.42Å; N67-M70 PolarHBondContact O-N 3.41Å | ||
| 68 | D | 64.1 | Low | 62.9 | Low | 96 Ų | 96 | 101.3 Ų | 101.3 | 51% | 0.513 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -35.5 | -26.1 | 162.4 | 173.3 | 65.1 | 0 | 0 | 0 | 113.4 | E71 K72 | D68-E71 PolarHBondContact O-N 2.89Å; D68-K72 WeakPolarHBondContact O-CG 3.48Å; D68-K72 PolarHBondContact O-N 3.44Å; D68-K72 IonicContact OD1-NZ 3.88Å; D68-K72 VanDerWaalsContact OD2-CE 3.31Å; D68-K72 WeakPolarHBondContact OD2-CE 3.07Å; D68-K72 IonicContact OD2-NZ 2.72Å; D68-K72 PolarHBondContact OD2-NZ 3.36Å |
| 69 | L | 62.2 | Low | 61.8 | Low | 74 Ų | 74 | 105 Ų | 105 | 39% | 0.387 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.5 | -39.8 | 174.8 | -160.3 | 143 | 0 | 0 | 0 | 113.6 | L4 N67 K72 F73 | L4-L69 HydrophobicContact CD2-CD2 4.38Å; N67-L69 HydrophobicContact CB-CB 4.26Å; N67-L69 PolarHBondContact O-N 3.42Å; L69-K72 PolarHBondContact O-N 2.79Å; L69-F73 HydrophobicContact CD2-CD2 3.69Å; L69-F73 HydrophobicContact CD2-CE2 3.77Å; L69-F73 HydrophobicContact CG-CD2 4.47Å; L69-F73 WeakPolarHBondContact O-CB 3.48Å; L69-F73 WeakPolarHBondContact O-CD2 3.3Å; L69-F73 PolarHBondContact O-N 3.27Å |
| 70 | M | 61.3 | Low | 61.2 | Low | 73 Ų | 73 | 107 Ų | 107 | 36% | 0.36 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -66.9 | -40.8 | 177 | -118.4 | -93.9 | 85 | 0 | 0 | 111 | N67 F73 L74 | N67-M70 PolarHBondContact O-N 3.41Å; M70-F73 HydrophobicContact CE-CB 4.23Å; M70-F73 WeakPolarHBondContact O-CB 3.25Å; M70-F73 PolarHBondContact O-N 2.97Å; M70-L74 HydrophobicContact CE-CD1 3.91Å; M70-L74 HydrophobicContact CE-CG 3.87Å; M70-L74 WeakPolarHBondContact O-CD1 3.24Å; M70-L74 WeakPolarHBondContact O-CG 3.3Å; M70-L74 PolarHBondContact O-N 3.06Å; M70-L74 HydrophobicContact SD-CD1 4.18Å |
| 71 | E | 66 | Low | 60.2 | Low | 141 Ų | 141 | 103.6 Ų | 103.6 | 66% | 0.659 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -64.5 | -44.2 | 174.5 | -71.9 | -171.3 | 164 | 0 | 0 | 111.8 | D68 F73 L74 S75 | D68-E71 PolarHBondContact O-N 2.89Å; E71-F73 PolarHBondContact O-N 3.44Å; E71-L74 PolarHBondContact O-N 3.12Å; E71-S75 VanDerWaalsContact O-CB 3.32Å; E71-S75 WeakPolarHBondContact O-CB 2.98Å; E71-S75 PolarHBondContact O-N 3.35Å |
| 72 | K | 65.1 | Low | 58.8 | Low | 129 Ų | 129 | 104.1 Ų | 104.1 | 56% | 0.561 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -60.4 | -37.1 | 174 | -79.7 | 173.7 | 177.7 | 161 | 0 | 112.1 | D68 L69 L76 | D68-K72 WeakPolarHBondContact O-CG 3.48Å; D68-K72 PolarHBondContact O-N 3.44Å; D68-K72 IonicContact OD1-NZ 3.88Å; D68-K72 VanDerWaalsContact OD2-CE 3.31Å; D68-K72 WeakPolarHBondContact OD2-CE 3.07Å; D68-K72 IonicContact OD2-NZ 2.72Å; D68-K72 PolarHBondContact OD2-NZ 3.36Å; L69-K72 PolarHBondContact O-N 2.79Å; K72-L76 WeakPolarHBondContact O-CB 3.28Å; K72-L76 PolarHBondContact O-N 3.41Å |
| 73 | F | 63.8 | Low | 57.8 | Low | 42 Ų | 42 | 102.7 Ų | 102.7 | 18% | 0.184 | 54% | 0.536 | C | S | . | . | H | α-helix | trans | -64.7 | -49.3 | 174.8 | -107.5 | -74.7 | 0 | 0 | 0 | 113.6 | L4 L8 L69 M70 E71 S75 L76 F77 | L4-F73 HydrophobicContact CD1-CE1 4.36Å; L4-F73 HydrophobicContact CD1-CE2 3.37Å; L4-F73 HydrophobicContact CD1-CZ 3.19Å; L4-F73 HydrophobicContact CD2-CD2 4.42Å; L4-F73 HydrophobicContact CD2-CE2 3.19Å; L4-F73 HydrophobicContact CD2-CZ 3.49Å; L4-F73 VanDerWaalsContact CD2-CZ 3.49Å; L4-F73 HydrophobicContact CG-CE2 3.49Å; L4-F73 VanDerWaalsContact CG-CE2 3.49Å; L4-F73 HydrophobicContact CG-CZ 3.27Å; L8-F73 HydrophobicContact CD1-CE1 3.49Å; L8-F73 VanDerWaalsContact CD1-CE1 3.49Å; L8-F73 HydrophobicContact CD1-CZ 3.46Å; L8-F73 VanDerWaalsContact CD1-CZ 3.46Å; L8-F73 HydrophobicContact CD2-CE1 4.46Å; L8-F73 HydrophobicContact CG-CE1 4.21Å; L69-F73 HydrophobicContact CD2-CD2 3.69Å; L69-F73 HydrophobicContact CD2-CE2 3.77Å; L69-F73 HydrophobicContact CG-CD2 4.47Å; L69-F73 WeakPolarHBondContact O-CB 3.48Å; L69-F73 WeakPolarHBondContact O-CD2 3.3Å; L69-F73 PolarHBondContact O-N 3.27Å; M70-F73 HydrophobicContact CE-CB 4.23Å; M70-F73 WeakPolarHBondContact O-CB 3.25Å; M70-F73 PolarHBondContact O-N 2.97Å; E71-F73 PolarHBondContact O-N 3.44Å; F73-S75 VanDerWaalsContact C-N 3.28Å; F73-S75 PolarHBondContact O-N 3.33Å; F73-L76 PolarHBondContact O-N 3.08Å; F73-F77 PolarHBondContact O-N 2.92Å |
| 74 | L | 63.1 | Low | 56.6 | Low | 106 Ų | 106 | 103.3 Ų | 103.3 | 56% | 0.555 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -60.1 | -43.5 | 177.4 | -79.4 | 156.8 | 0 | 0 | 0 | 110.2 | M70 E71 L76 F77 D78 | M70-L74 HydrophobicContact CE-CD1 3.91Å; M70-L74 HydrophobicContact CE-CG 3.87Å; M70-L74 WeakPolarHBondContact O-CD1 3.24Å; M70-L74 WeakPolarHBondContact O-CG 3.3Å; M70-L74 PolarHBondContact O-N 3.06Å; M70-L74 HydrophobicContact SD-CD1 4.18Å; E71-L74 PolarHBondContact O-N 3.12Å; L74-L76 PolarHBondContact O-N 3.35Å; L74-F77 PolarHBondContact O-N 3.44Å; L74-D78 WeakPolarHBondContact O-CB 3.2Å; L74-D78 PolarHBondContact O-N 2.91Å |
| 75 | S | 65 | Low | 56 | Low | 70 Ų | 70 | 107 Ų | 107 | 49% | 0.49 | 56% | 0.561 | S | S | . | * | H | α-helix | trans | -61.9 | -40.2 | 175.8 | -178.4 | 0 | 0 | 0 | 0 | 112.6 | E71 F73 K79 | E71-S75 VanDerWaalsContact O-CB 3.32Å; E71-S75 WeakPolarHBondContact O-CB 2.98Å; E71-S75 PolarHBondContact O-N 3.35Å; F73-S75 VanDerWaalsContact C-N 3.28Å; F73-S75 PolarHBondContact O-N 3.33Å; S75-K79 WeakPolarHBondContact O-CB 3.49Å; S75-K79 PolarHBondContact O-N 2.96Å; S75-K79 VanDerWaalsContact O-N 3.08Å |
| 76 | L | 61.5 | Low | 55.2 | Low | 90 Ų | 90 | 105 Ų | 105 | 47% | 0.471 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -69.3 | -39.1 | 178.2 | -151.8 | 100.6 | 0 | 0 | 0 | 111.8 | L8 K72 F73 L74 K79 T80 | L8-L76 HydrophobicContact CD2-CD2 3.48Å; L8-L76 VanDerWaalsContact CD2-CD2 3.48Å; K72-L76 WeakPolarHBondContact O-CB 3.28Å; K72-L76 PolarHBondContact O-N 3.41Å; F73-L76 PolarHBondContact O-N 3.08Å; L74-L76 PolarHBondContact O-N 3.35Å; L76-K79 PolarHBondContact O-N 2.72Å; L76-T80 PolarHBondContact O-N 3.15Å; L76-T80 VanDerWaalsContact O-N 3.13Å; L76-T80 PolarHBondContact O-OG1 2.73Å |
| 77 | F | 59 | Low | 55 | Low | 82 Ų | 82 | 103.6 Ų | 103.6 | 36% | 0.36 | 55% | 0.549 | S | S | . | . | H | α-helix | trans | -63.9 | -45.8 | 174.8 | -109 | -89.4 | 0 | 0 | 0 | 111.3 | L11 F73 L74 K79 T80 H81 | L11-F77 HydrophobicContact CD2-CE1 4.44Å; L11-F77 HydrophobicContact CD2-CE2 4.32Å; L11-F77 HydrophobicContact CD2-CZ 3.62Å; F73-F77 PolarHBondContact O-N 2.92Å; L74-F77 PolarHBondContact O-N 3.44Å; F77-K79 VanDerWaalsContact C-N 3.27Å; F77-K79 PolarHBondContact O-N 3.28Å; F77-T80 PolarHBondContact O-N 3.18Å; F77-T80 PolarHBondContact O-OG1 2.8Å; F77-H81 WeakPolarHBondContact O-CB 3.15Å; F77-H81 PolarHBondContact O-N 3.13Å |
| 78 | D | 55.3 | Low | 54 | Low | 127 Ų | 127 | 107.7 Ų | 107.7 | 68% | 0.679 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -60.1 | -39.6 | 178.2 | -166.1 | 60.9 | 0 | 0 | 0 | 111.4 | L74 T80 H81 | L74-D78 WeakPolarHBondContact O-CB 3.2Å; L74-D78 PolarHBondContact O-N 2.91Å; D78-T80 PolarHBondContact O-N 3.46Å; D78-H81 CarbonylContact O-C 3.37Å; D78-H81 PolarHBondContact O-N 2.93Å |
| 79 | K | 52.5 | Low | 53.2 | Low | 179 Ų | 179 | 110.8 Ų | 110.8 | 78% | 0.778 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -73.3 | -26.4 | -179.8 | -135.3 | 164.9 | -171.7 | 168.1 | 0 | 114.5 | S75 L76 F77 | S75-K79 WeakPolarHBondContact O-CB 3.49Å; S75-K79 PolarHBondContact O-N 2.96Å; S75-K79 VanDerWaalsContact O-N 3.08Å; L76-K79 PolarHBondContact O-N 2.72Å; F77-K79 VanDerWaalsContact C-N 3.27Å; F77-K79 PolarHBondContact O-N 3.28Å |
| 80 | T | 54.4 | Low | 52.5 | Low | 87 Ų | 87 | 116.3 Ų | 116.3 | 53% | 0.534 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -92.3 | -15.7 | 176.6 | 44 | 0 | 0 | 0 | 0 | 112.5 | L76 F77 D78 | L76-T80 PolarHBondContact O-N 3.15Å; L76-T80 VanDerWaalsContact O-N 3.13Å; L76-T80 PolarHBondContact O-OG1 2.73Å; F77-T80 PolarHBondContact O-N 3.18Å; F77-T80 PolarHBondContact O-OG1 2.8Å; D78-T80 PolarHBondContact O-N 3.46Å |
| 81 | H | 45.1 | Very low | 52.1 | Low | 89 Ų | 89 | 118.5 Ų | 118.5 | 41% | 0.412 | 63% | 0.631 | S | S | . | * | trans | -118.3 | 64.2 | 175.3 | -85.8 | -96.5 | 0 | 0 | 0 | 112.5 | F77 D78 V83 | F77-H81 WeakPolarHBondContact O-CB 3.15Å; F77-H81 PolarHBondContact O-N 3.13Å; D78-H81 CarbonylContact O-C 3.37Å; D78-H81 PolarHBondContact O-N 2.93Å; H81-V83 PolarHBondContact O-N 2.86Å | ||
| 82 | S | 41.2 | Very low | 51.4 | Low | 118 Ų | 118 | 117.3 Ų | 117.3 | 83% | 0.825 | 63% | 0.629 | S | S | * | * | trans | -64.2 | 30.3 | 152.8 | 63.7 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 83 | V | 42.3 | Very low | 50.6 | Low | 104 Ų | 104 | 116.6 Ų | 116.6 | 63% | 0.63 | 63% | 0.633 | S | S | * | * | S | Bend | trans | -123 | 79.6 | 173.2 | -174.5 | 0 | 0 | 0 | 0 | 106.4 | H81 L85 | H81-V83 PolarHBondContact O-N 2.86Å; V83-L85 PolarHBondContact O-N 3.08Å |
| 84 | S | 38 | Very low | 49.8 | Very low | 103 Ų | 103 | 121 Ų | 121 | 72% | 0.72 | 66% | 0.659 | S | S | * | * | trans | 39.5 | 75.3 | 145.9 | 177.5 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 85 | L | 44.2 | Very low | 49 | Very low | 120 Ų | 120 | 121.9 Ų | 121.9 | 63% | 0.628 | 67% | 0.666 | S | S | * | * | trans | -116.7 | 68.2 | 154.6 | -93.1 | 159.4 | 0 | 0 | 0 | 109.3 | V83 F87 | V83-L85 PolarHBondContact O-N 3.08Å; L85-F87 VanDerWaalsContact C-N 3.25Å; L85-F87 HydrophobicContact CB-CD2 4.29Å; L85-F87 HydrophobicContact CB-CE2 4.18Å; L85-F87 HydrophobicContact CD2-CD2 4.25Å; L85-F87 HydrophobicContact CD2-CE2 3.59Å; L85-F87 HydrophobicContact CD2-CZ 3.93Å; L85-F87 HydrophobicContact CG-CE2 4.32Å; L85-F87 PolarHBondContact O-N 3.32Å | ||
| 86 | T | 39.3 | Very low | 47.9 | Very low | 109 Ų | 109 | 125.4 Ų | 125.4 | 67% | 0.669 | 68% | 0.678 | S | S | * | * | trans | -62.9 | 89.2 | 163.2 | -46.6 | 0 | 0 | 0 | 0 | 108.3 | H88 | T86-H88 VanDerWaalsContact C-N 3.32Å; T86-H88 PolarHBondContact O-N 2.76Å; T86-H88 VanDerWaalsContact O-N 3.12Å | ||
| 87 | F | 52 | Low | 47 | Very low | 163 Ų | 163 | 127.9 Ų | 127.9 | 72% | 0.715 | 69% | 0.693 | S | S | * | * | trans | -76.4 | 91.2 | 162.1 | -80.2 | -82 | 0 | 0 | 0 | 107.7 | L85 L89 | L85-F87 VanDerWaalsContact C-N 3.25Å; L85-F87 HydrophobicContact CB-CD2 4.29Å; L85-F87 HydrophobicContact CB-CE2 4.18Å; L85-F87 HydrophobicContact CD2-CD2 4.25Å; L85-F87 HydrophobicContact CD2-CE2 3.59Å; L85-F87 HydrophobicContact CD2-CZ 3.93Å; L85-F87 HydrophobicContact CG-CE2 4.32Å; L85-F87 PolarHBondContact O-N 3.32Å; F87-L89 PolarHBondContact O-N 2.67Å; F87-L89 VanDerWaalsContact O-N 3.15Å | ||
| 88 | H | 38.7 | Very low | 46 | Very low | 159 Ų | 159 | 131.5 Ų | 131.5 | 74% | 0.736 | 72% | 0.718 | S | S | * | * | trans | -66.2 | 104 | 159.4 | -109 | -88.1 | 0 | 0 | 0 | 107.6 | T86 | T86-H88 VanDerWaalsContact C-N 3.32Å; T86-H88 PolarHBondContact O-N 2.76Å; T86-H88 VanDerWaalsContact O-N 3.12Å | ||
| 89 | L | 47.2 | Very low | 45.3 | Very low | 161 Ų | 161 | 131.8 Ų | 131.8 | 84% | 0.843 | 72% | 0.721 | S | S | * | * | trans | -105.4 | 87.4 | 161.3 | -88.3 | 156 | 0 | 0 | 0 | 106.9 | F87 | F87-L89 PolarHBondContact O-N 2.67Å; F87-L89 VanDerWaalsContact O-N 3.15Å | ||
| 90 | T | 48.2 | Very low | 44.6 | Very low | 190 Ų | 190 | 127.5 Ų | 127.5 | 100% | 1.166 | 72% | 0.716 | S | S | * | * | trans | -91.8 | 0 | 147.4 | -43.1 | 0 | 0 | 0 | 0 | 106.5 |
Retrieved 90 of 90 residues in 137.4 ms
(Link to these results)