| 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 | 34.3 | Very low | 42.7 | Very low | 166 Ų | 166 | 94.4 Ų | 94.4 | 82% | 0.818 | 64% | 0.636 | S | S | * | * | 0 | 134.2 | 0 | -66.9 | 177.6 | -159.1 | 0 | 0 | 108.3 | M379 | M1-M379 HydrophobicContact CE-CE 3.98Š| |||
| 2 | P | 26.6 | Very low | 44.8 | Very low | 117 Ų | 117 | 96.8 Ų | 96.8 | 76% | 0.76 | 65% | 0.646 | S | S | * | * | P | Polyproline II helix | trans | -57.8 | 143.2 | 154.9 | 26.5 | -30 | 0 | 0 | 0 | 108.2 | A4 | P2-A4 PolarHBondContact O-N 3.21Š|
| 3 | P | 34 | Very low | 47.3 | Very low | 77 Ų | 77 | 91.1 Ų | 91.1 | 50% | 0.5 | 61% | 0.607 | S | S | . | * | P | Polyproline II helix | trans | -58.5 | 134.6 | 178.5 | 23.6 | -30.5 | 0 | 0 | 0 | 108.8 | V5 K141 | P3-V5 PolarHBondContact O-N 3.48Å; P3-K141 HydrophobicContact CB-CG 4.28Å |
| 4 | A | 38.3 | Very low | 49.5 | Very low | 67 Ų | 67 | 89.4 Ų | 89.4 | 55% | 0.554 | 60% | 0.596 | S | S | * | * | P | Polyproline II helix | trans | -54 | 117.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 108.8 | P2 G6 Y140 | P2-A4 PolarHBondContact O-N 3.21Å; A4-G6 PolarHBondContact O-N 2.97Å; A4-G6 VanDerWaalsContact O-N 3.09Å; A4-Y140 HydrophobicContact CB-CE1 4.39Å; A4-Y140 WeakPolarHBondContact CB-OH 3.46Å; A4-Y140 WeakPolarHBondContact O-CE1 3.44Å; A4-Y140 PolarHBondContact O-OH 3.22Å |
| 5 | V | 36.2 | Very low | 51.5 | Low | 154 Ų | 154 | 85.7 Ų | 85.7 | 93% | 0.933 | 57% | 0.568 | S | S | * | * | S | Bend | trans | -77.7 | 97.3 | 178.7 | -179 | 0 | 0 | 0 | 0 | 106.1 | P3 | P3-V5 PolarHBondContact O-N 3.48Š|
| 6 | G | 44.6 | Very low | 53.6 | Low | 55 Ų | 55 | 81.3 Ų | 81.3 | 57% | 0.567 | 54% | 0.542 | S | S | * | . | trans | 145 | 75.7 | -175.7 | 0 | 0 | 0 | 0 | 0 | 111.1 | A4 Y140 | A4-G6 PolarHBondContact O-N 2.97Å; A4-G6 VanDerWaalsContact O-N 3.09Å; G6-Y140 PolarHBondContact O-OH 3.15Å | ||
| 7 | G | 44.1 | Very low | 55.7 | Low | 47 Ų | 47 | 80.3 Ų | 80.3 | 49% | 0.485 | 55% | 0.549 | S | S | . | . | trans | -61.3 | 162.3 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | V9 | G7-V9 PolarHBondContact O-N 2.98Š| ||
| 8 | P | 51.1 | Low | 57.7 | Low | 61 Ų | 61 | 83.6 Ų | 83.6 | 40% | 0.396 | 55% | 0.548 | S | S | . | . | trans | -57.7 | 124.9 | 178.1 | -15.4 | 27.2 | 0 | 0 | 0 | 110.6 | G10 Y11 P13 | P8-G10 PolarHBondContact O-N 3.07Å; P8-G10 VanDerWaalsContact O-N 3.12Å; P8-Y11 PolarHBondContact O-N 2.93Å; P8-P13 HydrophobicContact CG-CG 4.23Å | ||
| 9 | V | 43.9 | Very low | 59.4 | Low | 157 Ų | 157 | 79.2 Ų | 79.2 | 95% | 0.952 | 52% | 0.519 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.7 | 114.8 | 176.1 | -172.7 | 0 | 0 | 0 | 0 | 108.4 | G7 | G7-V9 PolarHBondContact O-N 2.98Š|
| 10 | G | 53.9 | Low | 61.2 | Low | 77 Ų | 77 | 79.5 Ų | 79.5 | 79% | 0.794 | 51% | 0.509 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 100.4 | -3.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 116.9 | P8 | P8-G10 PolarHBondContact O-N 3.07Å; P8-G10 VanDerWaalsContact O-N 3.12Å |
| 11 | Y | 62.8 | Low | 62.8 | Low | 60 Ų | 60 | 76.9 Ų | 76.9 | 24% | 0.235 | 50% | 0.495 | C | S | . | . | trans | -154.9 | 119 | 172.9 | 172.4 | -102.1 | 0 | 0 | 0 | 111.1 | P8 P13 P14 K137 I198 | P8-Y11 PolarHBondContact O-N 2.93Å; Y11-P13 HydrophobicContact CD1-CG 4.21Å; Y11-P13 HydrophobicContact CE1-CB 4.26Å; Y11-P13 HydrophobicContact CE1-CG 3.98Å; Y11-P13 WeakPolarHBondContact O-CD 3.27Å; Y11-P14 VanDerWaalsContact OH-CD 3.26Å; Y11-P14 WeakPolarHBondContact OH-CD 3.38Å; Y11-K137 VanDerWaalsContact CE1-O 3.3Å; Y11-K137 WeakPolarHBondContact CE1-O 3.13Å; Y11-K137 PolarHBondContact OH-O 3.2Å; Y11-I198 HydrophobicContact CE2-CB 4.17Å; Y11-I198 HydrophobicContact CE2-CG2 3.48Å; Y11-I198 VanDerWaalsContact CE2-CG2 3.48Å; Y11-I198 WeakPolarHBondContact OH-CB 3.43Å; Y11-I198 WeakPolarHBondContact OH-CG2 3.27Å | ||
| 12 | T | 68.3 | Low | 65.6 | Low | 124 Ų | 124 | 69 Ų | 69 | 76% | 0.761 | 46% | 0.456 | S | S | * | . | trans | -89.3 | 117.3 | 171.9 | 44.3 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 13 | P | 77 | Confident | 68.8 | Low | 22 Ų | 22 | 63.8 Ų | 63.8 | 14% | 0.143 | 42% | 0.422 | C | S | . | . | trans | -61.3 | 138.2 | 175.7 | -27.5 | 40.5 | 0 | 0 | 0 | 110.7 | P8 Y11 D15 | P8-P13 HydrophobicContact CG-CG 4.23Å; Y11-P13 HydrophobicContact CD1-CG 4.21Å; Y11-P13 HydrophobicContact CE1-CB 4.26Å; Y11-P13 HydrophobicContact CE1-CG 3.98Å; Y11-P13 WeakPolarHBondContact O-CD 3.27Å; P13-D15 PolarHBondContact O-N 3.35Å | ||
| 14 | P | 77.4 | Confident | 71.8 | Confident | 68 Ų | 68 | 65 Ų | 65 | 44% | 0.442 | 42% | 0.423 | S | S | . | . | trans | -67.3 | -21.7 | -175.1 | 24.5 | -34 | 0 | 0 | 0 | 113.6 | Y11 G16 Y138 I198 | Y11-P14 VanDerWaalsContact OH-CD 3.26Å; Y11-P14 WeakPolarHBondContact OH-CD 3.38Å; P14-G16 PolarHBondContact O-N 3.48Å; P14-Y138 WeakPolarHBondContact CD-O 3.44Å; P14-Y138 HydrophobicContact CG-CD1 3.91Å; P14-I198 HydrophobicContact CG-CD1 3.97Å | ||
| 15 | D | 79.9 | Confident | 74.5 | Confident | 33 Ų | 33 | 61.8 Ų | 61.8 | 18% | 0.176 | 40% | 0.397 | C | S | . | . | trans | 50.7 | 31.4 | 176.1 | -90.9 | -43 | 0 | 0 | 0 | 114 | P13 Y138 F139 Y140 K141 R142 | P13-D15 PolarHBondContact O-N 3.35Å; D15-Y138 PolarHBondContact N-O 2.86Å; D15-F139 VanDerWaalsContact OD1-CA 3.27Å; D15-F139 WeakPolarHBondContact OD1-CA 3.31Å; D15-Y140 PolarHBondContact OD1-N 3.39Å; D15-K141 PolarHBondContact OD1-N 3.1Å; D15-K141 VanDerWaalsContact OD1-N 3.09Å; D15-K141 WeakPolarHBondContact OD2-CB 3.33Å; D15-K141 PolarHBondContact OD2-N 3.2Å; D15-R142 PolarHBondContact OD1-N 3.45Å | ||
| 16 | G | 84.9 | Confident | 77.3 | Confident | 16 Ų | 16 | 54.4 Ų | 54.4 | 17% | 0.165 | 35% | 0.352 | C | S | . | . | S | Bend | trans | 169.4 | -163.2 | -177.9 | 0 | 0 | 0 | 0 | 0 | 114.2 | P14 W18 G19 | P14-G16 PolarHBondContact O-N 3.48Å; G16-W18 PolarHBondContact O-N 2.9Å; G16-G19 PolarHBondContact O-N 2.71Å |
| 17 | G | 90.1 | Very high | 79.7 | Confident | 64 Ų | 64 | 54.6 Ų | 54.6 | 66% | 0.66 | 34% | 0.338 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58.4 | -123.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113 | G19 W20 | G17-G19 PolarHBondContact O-N 2.93Å; G17-W20 PolarHBondContact O-N 3.16Å; G17-W20 VanDerWaalsContact O-N 3.08Å |
| 18 | W | 91.7 | Very high | 82.2 | Confident | 139 Ų | 139 | 54.5 Ų | 54.5 | 53% | 0.527 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -60.2 | -17.4 | 177.4 | -160.2 | -90.2 | 0 | 0 | 0 | 113.6 | G16 W20 A21 V22 Y138 L194 | G16-W18 PolarHBondContact O-N 2.9Å; W18-W20 PolarHBondContact O-N 3.18Å; W18-A21 HydrophobicContact CD2-CB 4.29Å; W18-A21 HydrophobicContact CG-CB 4.47Å; W18-A21 WeakPolarHBondContact O-CB 3.27Å; W18-A21 PolarHBondContact O-N 3.03Å; W18-A21 VanDerWaalsContact O-N 3.11Å; W18-V22 PolarHBondContact O-N 3.4Å; W18-Y138 HydrophobicContact CB-CE1 4.24Å; W18-L194 PolarHBondContact NE1-O 3.27Å |
| 19 | G | 90.2 | Very high | 84.3 | Confident | 0 Ų | 0 | 51.6 Ų | 51.6 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -55.8 | -34.5 | 171.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | G16 G17 V22 V23 F139 | G16-G19 PolarHBondContact O-N 2.71Å; G17-G19 PolarHBondContact O-N 2.93Å; G19-V22 WeakPolarHBondContact O-CB 3.23Å; G19-V22 PolarHBondContact O-N 3.46Å; G19-V23 WeakPolarHBondContact O-CG2 3.49Å; G19-V23 PolarHBondContact O-N 3Å; G19-F139 WeakPolarHBondContact O-CE2 3.13Å |
| 20 | W | 94.2 | Very high | 86.6 | Confident | 85 Ų | 85 | 44.1 Ų | 44.1 | 32% | 0.322 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -71.2 | -34.5 | 176.9 | -65 | 115.6 | 0 | 0 | 0 | 112.9 | G17 W18 V22 V23 I24 F139 L145 L149 | G17-W20 PolarHBondContact O-N 3.16Å; G17-W20 VanDerWaalsContact O-N 3.08Å; W18-W20 PolarHBondContact O-N 3.18Å; W20-V22 VanDerWaalsContact C-N 3.31Å; W20-V23 HydrophobicContact CE3-CB 4.47Å; W20-V23 HydrophobicContact CE3-CG2 4.33Å; W20-V23 WeakPolarHBondContact O-CB 3.26Å; W20-V23 PolarHBondContact O-N 3.38Å; W20-I24 WeakPolarHBondContact O-CG1 3.37Å; W20-I24 PolarHBondContact O-N 2.67Å; W20-I24 VanDerWaalsContact O-N 3.09Å; W20-F139 HydrophobicContact CD2-CZ 4.09Å; W20-F139 HydrophobicContact CE3-CZ 4.29Å; W20-F139 HydrophobicContact CZ2-CE1 4.29Å; W20-L145 HydrophobicContact CH2-CD2 3.96Å; W20-L145 HydrophobicContact CH2-CG 4.45Å; W20-L149 HydrophobicContact CZ3-CD1 3.76Å |
| 21 | A | 94.8 | Very high | 88.6 | Confident | 25 Ų | 25 | 40.4 Ų | 40.4 | 21% | 0.207 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -64.8 | -38.1 | 170.5 | 0 | 0 | 0 | 0 | 0 | 111.5 | W18 V23 I24 G25 | W18-A21 HydrophobicContact CD2-CB 4.29Å; W18-A21 HydrophobicContact CG-CB 4.47Å; W18-A21 WeakPolarHBondContact O-CB 3.27Å; W18-A21 PolarHBondContact O-N 3.03Å; W18-A21 VanDerWaalsContact O-N 3.11Å; A21-V23 VanDerWaalsContact C-N 3.33Å; A21-V23 PolarHBondContact O-N 3.34Å; A21-I24 PolarHBondContact O-N 3.17Å; A21-G25 PolarHBondContact O-N 3.03Å |
| 22 | V | 93.8 | Very high | 90.2 | Very high | 0 Ų | 0 | 38.1 Ų | 38.1 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -62.7 | -38.1 | 172.3 | 164.7 | 0 | 0 | 0 | 0 | 111.8 | W18 G19 W20 G25 A26 M134 Y138 M195 | W18-V22 PolarHBondContact O-N 3.4Å; G19-V22 WeakPolarHBondContact O-CB 3.23Å; G19-V22 PolarHBondContact O-N 3.46Å; W20-V22 VanDerWaalsContact C-N 3.31Å; V22-G25 PolarHBondContact O-N 3.02Å; V22-A26 WeakPolarHBondContact O-CB 3.4Å; V22-A26 PolarHBondContact O-N 3.02Å; V22-M134 HydrophobicContact CG1-CB 4.13Å; V22-Y138 HydrophobicContact CG1-CD2 4.29Å; V22-Y138 HydrophobicContact CG2-CD1 4.46Å; V22-Y138 HydrophobicContact CG2-CD2 4.23Å; V22-Y138 HydrophobicContact CG2-CE1 4.04Å; V22-Y138 HydrophobicContact CG2-CE2 3.86Å; V22-M195 HydrophobicContact CB-SD 4.41Å; V22-M195 HydrophobicContact CG1-CE 4.3Å; V22-M195 HydrophobicContact CG1-SD 3.7Å; V22-M195 HydrophobicContact CG2-SD 4.36Å; V22-M195 WeakPolarHBondContact O-CE 3.4Å |
| 23 | V | 94.4 | Very high | 91.4 | Very high | 8 Ų | 8 | 32.2 Ų | 32.2 | 5% | 0.048 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -63.2 | -40.6 | 174.4 | 170.6 | 0 | 0 | 0 | 0 | 111.3 | G19 W20 A21 A26 F27 F139 A146 L149 | G19-V23 WeakPolarHBondContact O-CG2 3.49Å; G19-V23 PolarHBondContact O-N 3Å; W20-V23 HydrophobicContact CE3-CB 4.47Å; W20-V23 HydrophobicContact CE3-CG2 4.33Å; W20-V23 WeakPolarHBondContact O-CB 3.26Å; W20-V23 PolarHBondContact O-N 3.38Å; A21-V23 VanDerWaalsContact C-N 3.33Å; A21-V23 PolarHBondContact O-N 3.34Å; V23-A26 PolarHBondContact O-N 3.09Å; V23-F27 WeakPolarHBondContact O-CB 3.4Å; V23-F27 PolarHBondContact O-N 2.97Å; V23-F139 HydrophobicContact CG2-CD2 4.41Å; V23-F139 HydrophobicContact CG2-CE2 3.65Å; V23-F139 HydrophobicContact CG2-CZ 4.28Å; V23-A146 HydrophobicContact CG2-CB 3.74Å; V23-L149 HydrophobicContact CG1-CB 3.93Å; V23-L149 HydrophobicContact CG1-CD1 4.49Å |
| 24 | I | 95.8 | Very high | 92.2 | Very high | 102 Ų | 102 | 32.7 Ų | 32.7 | 52% | 0.523 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -63.8 | -44.9 | 174.8 | -64.3 | 167.5 | 0 | 0 | 0 | 110.8 | W20 A21 A26 F27 I28 | W20-I24 WeakPolarHBondContact O-CG1 3.37Å; W20-I24 PolarHBondContact O-N 2.67Å; W20-I24 VanDerWaalsContact O-N 3.09Å; A21-I24 PolarHBondContact O-N 3.17Å; I24-A26 VanDerWaalsContact C-N 3.3Å; I24-A26 PolarHBondContact O-N 3.17Å; I24-F27 WeakPolarHBondContact O-CB 3.43Å; I24-F27 PolarHBondContact O-N 3.29Å; I24-I28 HydrophobicContact CG2-CD1 4.3Å; I24-I28 WeakPolarHBondContact O-CG1 3.39Å; I24-I28 PolarHBondContact O-N 3.35Å; I24-I28 VanDerWaalsContact O-N 3.11Å |
| 25 | G | 95.6 | Very high | 93 | Very high | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -59.4 | -42.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112 | A21 V22 I28 S29 | A21-G25 PolarHBondContact O-N 3.03Å; V22-G25 PolarHBondContact O-N 3.02Å; G25-I28 PolarHBondContact O-N 3.09Å; G25-S29 PolarHBondContact O-N 3.02Å; G25-S29 PolarHBondContact O-OG 2.81Å |
| 26 | A | 94.4 | Very high | 93.7 | Very high | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -67.6 | -36.4 | 176.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | V22 V23 I24 I28 S29 I30 A131 I135 A150 M195 | V22-A26 WeakPolarHBondContact O-CB 3.4Å; V22-A26 PolarHBondContact O-N 3.02Å; V23-A26 PolarHBondContact O-N 3.09Å; I24-A26 VanDerWaalsContact C-N 3.3Å; I24-A26 PolarHBondContact O-N 3.17Å; A26-I28 VanDerWaalsContact C-N 3.32Å; A26-I28 PolarHBondContact O-N 3.07Å; A26-S29 PolarHBondContact O-N 3.32Å; A26-I30 HydrophobicContact CB-CD1 4.39Å; A26-I30 WeakPolarHBondContact O-CB 3.39Å; A26-I30 WeakPolarHBondContact O-CG1 3.48Å; A26-I30 PolarHBondContact O-N 3Å; A26-A131 HydrophobicContact CB-CB 3.94Å; A26-I135 HydrophobicContact CB-CD1 3.55Å; A26-I135 HydrophobicContact CB-CG1 3.98Å; A26-A150 HydrophobicContact CB-CB 3.92Å; A26-M195 HydrophobicContact CB-CE 4.11Å; A26-M195 VanDerWaalsContact N-CE 3.35Å |
| 27 | F | 95.8 | Very high | 94.1 | Very high | 58 Ų | 58 | 27.2 Ų | 27.2 | 25% | 0.254 | 14% | 0.141 | S | C | . | . | H | α-helix | trans | -57.1 | -46.1 | 174.1 | -177.7 | -84.8 | 0 | 0 | 0 | 111.3 | V23 I24 G31 L149 G153 V156 F157 | V23-F27 WeakPolarHBondContact O-CB 3.4Å; V23-F27 PolarHBondContact O-N 2.97Å; I24-F27 WeakPolarHBondContact O-CB 3.43Å; I24-F27 PolarHBondContact O-N 3.29Å; F27-G31 WeakPolarHBondContact O-CA 3.4Å; F27-G31 PolarHBondContact O-N 2.86Å; F27-L149 WeakPolarHBondContact CD2-O 3.4Å; F27-G153 VanDerWaalsContact CE2-N 3.28Å; F27-G153 VanDerWaalsContact CZ-CA 3.43Å; F27-V156 HydrophobicContact CE1-CG1 4.44Å; F27-V156 HydrophobicContact CZ-CB 4Å; F27-V156 HydrophobicContact CZ-CG1 4.12Å; F27-V156 HydrophobicContact CZ-CG2 4.07Å; F27-F157 AromaticContact CD1-CE2 3.86Å; F27-F157 HydrophobicContact CD1-CE2 3.86Å; F27-F157 HydrophobicContact CE1-CD2 4.14Å; F27-F157 AromaticContact CE1-CE2 3.66Å; F27-F157 HydrophobicContact CE1-CE2 3.66Å |
| 28 | I | 96.2 | Very high | 94.3 | Very high | 45 Ų | 45 | 24.7 Ų | 24.7 | 23% | 0.231 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -66.9 | -49.4 | 178.1 | -63.4 | 167 | 0 | 0 | 0 | 110.6 | I24 G25 A26 G31 F32 F157 A191 | I24-I28 HydrophobicContact CG2-CD1 4.3Å; I24-I28 WeakPolarHBondContact O-CG1 3.39Å; I24-I28 PolarHBondContact O-N 3.35Å; I24-I28 VanDerWaalsContact O-N 3.11Å; G25-I28 PolarHBondContact O-N 3.09Å; A26-I28 VanDerWaalsContact C-N 3.32Å; A26-I28 PolarHBondContact O-N 3.07Å; I28-G31 PolarHBondContact O-N 3.34Å; I28-F32 HydrophobicContact CG2-CD2 3.72Å; I28-F32 HydrophobicContact CG2-CE2 3.75Å; I28-F32 WeakPolarHBondContact O-CD2 3.45Å; I28-F32 PolarHBondContact O-N 3.08Å; I28-F157 HydrophobicContact CB-CZ 4.31Å; I28-F157 HydrophobicContact CG1-CZ 4.21Å; I28-F157 HydrophobicContact CG2-CZ 4.18Å; I28-A191 HydrophobicContact CB-CB 4.03Å; I28-A191 HydrophobicContact CG2-CB 3.97Å |
| 29 | S | 95.2 | Very high | 94.4 | Very high | 0 Ų | 0 | 18.1 Ų | 18.1 | 0% | 0 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -64 | -46.3 | -178.1 | -66.1 | 0 | 0 | 0 | 0 | 112.6 | G25 A26 G31 S33 M89 | G25-S29 PolarHBondContact O-N 3.02Å; G25-S29 PolarHBondContact O-OG 2.81Å; A26-S29 PolarHBondContact O-N 3.32Å; S29-G31 VanDerWaalsContact C-N 3.33Å; S29-S33 VanDerWaalsContact O-CB 3.31Å; S29-S33 WeakPolarHBondContact O-CB 3.13Å; S29-S33 PolarHBondContact O-N 2.94Å; S29-S33 PolarHBondContact O-OG 3.17Å; S29-M89 WeakPolarHBondContact OG-CE 3.49Å |
| 30 | I | 93.4 | Very high | 94.5 | Very high | 0 Ų | 0 | 18.1 Ų | 18.1 | 0% | 0 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -67.1 | -38.9 | 176.7 | -65.2 | 173.7 | 0 | 0 | 0 | 110.3 | A26 S33 Y34 L128 A131 L132 A150 M151 | A26-I30 HydrophobicContact CB-CD1 4.39Å; A26-I30 WeakPolarHBondContact O-CB 3.39Å; A26-I30 WeakPolarHBondContact O-CG1 3.48Å; A26-I30 PolarHBondContact O-N 3Å; I30-S33 PolarHBondContact O-N 3.27Å; I30-Y34 HydrophobicContact CG2-CD2 3.71Å; I30-Y34 HydrophobicContact CG2-CE2 4.05Å; I30-Y34 PolarHBondContact O-N 3.22Å; I30-L128 HydrophobicContact CB-CD1 4.5Å; I30-L128 HydrophobicContact CG1-CD1 3.9Å; I30-L128 HydrophobicContact CG2-CD1 4.43Å; I30-A131 HydrophobicContact CG1-CB 4.43Å; I30-L132 HydrophobicContact CD1-CD2 3.84Å; I30-L132 HydrophobicContact CD1-CG 4.38Å; I30-A150 HydrophobicContact CD1-CB 3.8Å; I30-M151 HydrophobicContact CD1-SD 4.3Å; I30-M151 HydrophobicContact CG2-SD 3.86Å |
| 31 | G | 95.1 | Very high | 94.5 | Very high | 0 Ų | 0 | 14.1 Ų | 14.1 | 0% | 0 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -51.6 | -61.8 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | F27 I28 S29 A35 | F27-G31 WeakPolarHBondContact O-CA 3.4Å; F27-G31 PolarHBondContact O-N 2.86Å; I28-G31 PolarHBondContact O-N 3.34Å; S29-G31 VanDerWaalsContact C-N 3.33Å; G31-A35 WeakPolarHBondContact O-CB 3.34Å; G31-A35 PolarHBondContact O-N 3.12Å |
| 32 | F | 95.8 | Very high | 94.4 | Very high | 11 Ų | 11 | 13 Ų | 13 | 5% | 0.048 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -61.3 | -46.4 | 177.5 | -79.6 | -62.3 | 0 | 0 | 0 | 112.8 | I28 Y34 F36 F157 L161 L184 L185 C188 | I28-F32 HydrophobicContact CG2-CD2 3.72Å; I28-F32 HydrophobicContact CG2-CE2 3.75Å; I28-F32 WeakPolarHBondContact O-CD2 3.45Å; I28-F32 PolarHBondContact O-N 3.08Å; F32-Y34 PolarHBondContact O-N 2.97Å; F32-F36 WeakPolarHBondContact O-CB 3.44Å; F32-F36 PolarHBondContact O-N 2.95Å; F32-F157 AromaticContact CD1-CD1 3.97Å; F32-F157 HydrophobicContact CD1-CD1 3.97Å; F32-F157 HydrophobicContact CD1-CE1 4.14Å; F32-F157 HydrophobicContact CD2-CD1 4.2Å; F32-F157 AromaticContact CD2-CE1 3.66Å; F32-F157 HydrophobicContact CD2-CE1 3.66Å; F32-F157 HydrophobicContact CD2-CZ 4.49Å; F32-F157 AromaticContact CE1-CD1 3.99Å; F32-F157 HydrophobicContact CE1-CD1 3.99Å; F32-F157 AromaticContact CE1-CE1 3.93Å; F32-F157 HydrophobicContact CE1-CE1 3.93Å; F32-F157 HydrophobicContact CE2-CD1 4.25Å; F32-F157 AromaticContact CE2-CE1 3.45Å; F32-F157 HydrophobicContact CE2-CE1 3.45Å; F32-F157 VanDerWaalsContact CE2-CE1 3.45Å; F32-F157 HydrophobicContact CE2-CZ 4.3Å; F32-F157 HydrophobicContact CG-CD1 4.08Å; F32-F157 HydrophobicContact CG-CE1 4.02Å; F32-F157 HydrophobicContact CZ-CD1 4.14Å; F32-F157 AromaticContact CZ-CE1 3.59Å; F32-F157 HydrophobicContact CZ-CE1 3.59Å; F32-L161 HydrophobicContact CD1-CD1 4.21Å; F32-L161 HydrophobicContact CE1-CD1 4.24Å; F32-L184 HydrophobicContact CE1-CB 4.31Å; F32-L184 HydrophobicContact CZ-CB 4.19Å; F32-L185 HydrophobicContact CB-CD2 3.94Å; F32-L185 HydrophobicContact CD1-CD2 3.63Å; F32-L185 HydrophobicContact CE1-CD2 4.27Å; F32-L185 HydrophobicContact CG-CD2 3.87Å; F32-C188 VanDerWaalsContact CD2-SG 3.52Å |
| 33 | S | 94.6 | Very high | 94.3 | Very high | 0 Ų | 0 | 13 Ų | 13 | 0% | 0 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -56.4 | -44.9 | -178.3 | -70.1 | 0 | 0 | 0 | 0 | 113.4 | S29 I30 P37 L124 | S29-S33 VanDerWaalsContact O-CB 3.31Å; S29-S33 WeakPolarHBondContact O-CB 3.13Å; S29-S33 PolarHBondContact O-N 2.94Å; S29-S33 PolarHBondContact O-OG 3.17Å; I30-S33 PolarHBondContact O-N 3.27Å; S33-P37 VanDerWaalsContact O-CD 3.24Å; S33-P37 WeakPolarHBondContact O-CD 3.5Å; S33-L124 PolarHBondContact OG-O 3.3Å |
| 34 | Y | 92.4 | Very high | 94.2 | Very high | 33 Ų | 33 | 12.6 Ų | 12.6 | 13% | 0.129 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -91.2 | -30.8 | -178.5 | -76.9 | -63.5 | 0 | 0 | 0 | 114.8 | I30 F32 K38 M69 Y70 L128 M151 S154 | I30-Y34 HydrophobicContact CG2-CD2 3.71Å; I30-Y34 HydrophobicContact CG2-CE2 4.05Å; I30-Y34 PolarHBondContact O-N 3.22Å; F32-Y34 PolarHBondContact O-N 2.97Å; Y34-K38 WeakPolarHBondContact O-CD 3.44Å; Y34-M69 HydrophobicContact CD1-CE 3.81Å; Y34-M69 HydrophobicContact CE1-CE 3.83Å; Y34-Y70 HydrophobicContact CE1-CE1 4.17Å; Y34-L128 HydrophobicContact CD2-CD1 4.3Å; Y34-L128 HydrophobicContact CE1-CD2 4.41Å; Y34-L128 HydrophobicContact CE2-CD1 3.65Å; Y34-L128 HydrophobicContact CE2-CD2 4.08Å; Y34-M151 HydrophobicContact CE2-CE 4.21Å; Y34-M151 HydrophobicContact CE2-SD 4.44Å; Y34-S154 WeakPolarHBondContact CB-OG 3.46Å |
| 35 | A | 94.8 | Very high | 93.9 | Very high | 0 Ų | 0 | 11.6 Ų | 11.6 | 0% | 0 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -80.6 | -36.1 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112 | G31 K38 S39 F157 L158 L161 | G31-A35 WeakPolarHBondContact O-CB 3.34Å; G31-A35 PolarHBondContact O-N 3.12Å; A35-K38 WeakPolarHBondContact O-CB 3.42Å; A35-K38 PolarHBondContact O-N 2.91Å; A35-K38 VanDerWaalsContact O-N 3.08Å; A35-S39 WeakPolarHBondContact O-CB 3.43Å; A35-S39 PolarHBondContact O-N 3.2Å; A35-S39 PolarHBondContact O-OG 2.9Å; A35-F157 HydrophobicContact CB-CB 3.65Å; A35-L158 HydrophobicContact CB-CB 3.93Å; A35-L161 HydrophobicContact CB-CD1 4.31Å |
| 36 | F | 95.1 | Very high | 93.6 | Very high | 1 Ų | 1 | 13 Ų | 13 | 0% | 0.004 | 6% | 0.058 | C | C | . | . | H | α-helix | trans | -59.7 | -47.9 | -171.9 | -166.2 | -91.6 | 0 | 0 | 0 | 112.9 | F32 K38 S39 I40 M65 L100 L124 L181 L185 | F32-F36 WeakPolarHBondContact O-CB 3.44Å; F32-F36 PolarHBondContact O-N 2.95Å; F36-K38 PolarHBondContact O-N 3.43Å; F36-K38 VanDerWaalsContact O-N 3.16Å; F36-S39 WeakPolarHBondContact CA-OG 3.49Å; F36-S39 PolarHBondContact O-N 3.3Å; F36-S39 VanDerWaalsContact O-N 3.15Å; F36-S39 PolarHBondContact O-OG 3.1Å; F36-I40 HydrophobicContact CE1-CD1 3.88Å; F36-I40 HydrophobicContact CZ-CD1 4.12Å; F36-I40 PolarHBondContact O-N 3.03Å; F36-M65 HydrophobicContact CD1-CE 4.25Å; F36-M65 HydrophobicContact CD1-SD 3.97Å; F36-M65 HydrophobicContact CE1-SD 4.44Å; F36-L100 HydrophobicContact CE1-CD1 3.99Å; F36-L100 HydrophobicContact CE1-CD2 3.85Å; F36-L100 HydrophobicContact CE1-CG 4.31Å; F36-L100 HydrophobicContact CE2-CD2 3.82Å; F36-L100 HydrophobicContact CZ-CD1 4.23Å; F36-L100 HydrophobicContact CZ-CD2 3.22Å; F36-L100 HydrophobicContact CZ-CG 4.05Å; F36-L124 HydrophobicContact CB-CD1 4.46Å; F36-L181 HydrophobicContact CE2-CB 4.07Å; F36-L181 HydrophobicContact CE2-CD1 4.27Å; F36-L181 HydrophobicContact CE2-CD2 4.1Å; F36-L181 HydrophobicContact CE2-CG 4.38Å; F36-L181 HydrophobicContact CZ-CB 4.35Å; F36-L181 HydrophobicContact CZ-CD1 4.4Å; F36-L185 HydrophobicContact CD1-CD1 4.38Å; F36-L185 HydrophobicContact CD2-CD1 4.36Å; F36-L185 HydrophobicContact CD2-CD2 4.11Å; F36-L185 HydrophobicContact CD2-CG 4.38Å; F36-L185 HydrophobicContact CE1-CD1 4.29Å; F36-L185 HydrophobicContact CE2-CD1 4.27Å; F36-L185 HydrophobicContact CE2-CG 4.4Å; F36-L185 HydrophobicContact CG-CD1 4.45Å; F36-L185 HydrophobicContact CG-CD2 4.36Å; F36-L185 HydrophobicContact CZ-CD1 4.29Å |
| 37 | P | 93.9 | Very high | 93.4 | Very high | 1 Ų | 1 | 13 Ų | 13 | 1% | 0.006 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -59.8 | -27.7 | 176.5 | -23.9 | 34.9 | 0 | 0 | 0 | 115.5 | S33 T41 M65 L66 L124 | S33-P37 VanDerWaalsContact O-CD 3.24Å; S33-P37 WeakPolarHBondContact O-CD 3.5Å; P37-T41 WeakPolarHBondContact O-CG2 3.34Å; P37-M65 HydrophobicContact CB-CE 3.64Å; P37-M65 HydrophobicContact CB-CG 4.5Å; P37-M65 HydrophobicContact CB-SD 4.38Å; P37-M65 HydrophobicContact CG-CE 3.86Å; P37-M65 HydrophobicContact CG-CG 4.04Å; P37-M65 HydrophobicContact CG-SD 3.95Å; P37-L66 HydrophobicContact CB-CD1 4.38Å; P37-L66 HydrophobicContact CB-CD2 3.79Å; P37-L66 HydrophobicContact CB-CG 3.79Å; P37-L66 HydrophobicContact CG-CD2 3.86Å; P37-L66 HydrophobicContact CG-CG 4.26Å; P37-L124 HydrophobicContact CG-CD1 4.31Å |
| 38 | K | 92.8 | Very high | 93.2 | Very high | 11 Ų | 11 | 11 Ų | 11 | 5% | 0.048 | 5% | 0.05 | C | C | . | . | H | α-helix | trans | -84.9 | -36.6 | 178.9 | -57.9 | 175.8 | 178.4 | -175 | 0 | 111.3 | Y34 A35 F36 T41 L158 L281 | Y34-K38 WeakPolarHBondContact O-CD 3.44Å; A35-K38 WeakPolarHBondContact O-CB 3.42Å; A35-K38 PolarHBondContact O-N 2.91Å; A35-K38 VanDerWaalsContact O-N 3.08Å; F36-K38 PolarHBondContact O-N 3.43Å; F36-K38 VanDerWaalsContact O-N 3.16Å; K38-T41 WeakPolarHBondContact O-CG2 3.33Å; K38-T41 PolarHBondContact O-OG1 3.34Å; K38-L158 HydrophobicContact CB-CD1 3.7Å; K38-L158 HydrophobicContact CB-CD2 4.21Å; K38-L158 HydrophobicContact CD-CD2 3.85Å; K38-L281 HydrophobicContact CB-CD2 3.68Å; K38-L281 HydrophobicContact CD-CD1 3.95Å; K38-L281 HydrophobicContact CD-CD2 3.73Å; K38-L281 HydrophobicContact CG-CD2 3.5Å |
| 39 | S | 94.1 | Very high | 92.9 | Very high | 0 Ų | 0 | 12.9 Ų | 12.9 | 0% | 0 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -74.8 | -25.6 | -178.6 | 72.9 | 0 | 0 | 0 | 0 | 113.3 | A35 F36 T41 V42 N165 | A35-S39 WeakPolarHBondContact O-CB 3.43Å; A35-S39 PolarHBondContact O-N 3.2Å; A35-S39 PolarHBondContact O-OG 2.9Å; F36-S39 WeakPolarHBondContact CA-OG 3.49Å; F36-S39 PolarHBondContact O-N 3.3Å; F36-S39 VanDerWaalsContact O-N 3.15Å; F36-S39 PolarHBondContact O-OG 3.1Å; S39-T41 PolarHBondContact O-N 3.43Å; S39-V42 WeakPolarHBondContact O-CG1 3.41Å; S39-V42 WeakPolarHBondContact O-CG2 3.45Å; S39-N165 WeakPolarHBondContact CB-ND2 3.43Å; S39-N165 PolarHBondContact O-ND2 2.87Å; S39-N165 PolarHBondContact OG-ND2 3.07Å |
| 40 | I | 93 | Very high | 92.7 | Very high | 1 Ų | 1 | 16.3 Ų | 16.3 | 1% | 0.005 | 9% | 0.085 | C | C | . | . | G | 310 helix | trans | -74.5 | -14.5 | 179.8 | -154.2 | 166.8 | 0 | 0 | 0 | 112.5 | F36 V42 F43 F44 M65 I116 F178 | F36-I40 HydrophobicContact CE1-CD1 3.88Å; F36-I40 HydrophobicContact CZ-CD1 4.12Å; F36-I40 PolarHBondContact O-N 3.03Å; I40-V42 PolarHBondContact O-N 2.95Å; I40-F43 HydrophobicContact CG1-CD2 3.86Å; I40-F43 HydrophobicContact CG1-CE2 4.39Å; I40-F43 WeakPolarHBondContact O-CD2 3.38Å; I40-F43 PolarHBondContact O-N 3.32Å; I40-F43 VanDerWaalsContact O-N 3.12Å; I40-F44 HydrophobicContact CG2-CE1 4.07Å; I40-F44 HydrophobicContact CG2-CZ 4.38Å; I40-M65 HydrophobicContact CG2-CE 4.02Å; I40-I116 HydrophobicContact CD1-CD1 4Å; I40-I116 HydrophobicContact CD1-CG2 3.76Å; I40-F178 HydrophobicContact CD1-CE1 3.85Å; I40-F178 HydrophobicContact CD1-CZ 4.14Å; I40-F178 HydrophobicContact CG1-CE1 3.96Å; I40-F178 HydrophobicContact CG1-CZ 4.37Å |
| 41 | T | 92.7 | Very high | 92.7 | Very high | 0 Ų | 0 | 18.4 Ų | 18.4 | 0% | 0 | 9% | 0.094 | C | C | . | . | G | 310 helix | trans | -68.9 | -14.6 | 179.7 | 74.4 | 0 | 0 | 0 | 0 | 112.5 | P37 K38 S39 F43 F44 V282 S285 | P37-T41 WeakPolarHBondContact O-CG2 3.34Å; K38-T41 WeakPolarHBondContact O-CG2 3.33Å; K38-T41 PolarHBondContact O-OG1 3.34Å; S39-T41 PolarHBondContact O-N 3.43Å; T41-F43 PolarHBondContact O-N 3.43Å; T41-F44 HydrophobicContact CG2-CD2 4.19Å; T41-F44 HydrophobicContact CG2-CE2 3.75Å; T41-F44 HydrophobicContact CG2-CZ 3.96Å; T41-F44 WeakPolarHBondContact O-CB 3.38Å; T41-F44 PolarHBondContact O-N 3.24Å; T41-F44 VanDerWaalsContact O-N 3.15Å; T41-V282 VanDerWaalsContact CB-O 3.29Å; T41-V282 WeakPolarHBondContact CB-O 3.48Å; T41-V282 HydrophobicContact CG2-CB 4.29Å; T41-V282 HydrophobicContact CG2-CG1 3.9Å; T41-V282 HydrophobicContact CG2-CG2 4.34Å; T41-V282 PolarHBondContact OG1-O 3.04Å; T41-S285 PolarHBondContact O-OG 2.8Å |
| 42 | V | 92.8 | Very high | 92.5 | Very high | 1 Ų | 1 | 26.8 Ų | 26.8 | 1% | 0.006 | 13% | 0.133 | C | C | . | . | G | 310 helix | trans | -62.8 | -25.7 | 172.4 | -49.5 | 0 | 0 | 0 | 0 | 112.2 | S39 I40 E46 A162 N165 K289 A299 L302 | S39-V42 WeakPolarHBondContact O-CG1 3.41Å; S39-V42 WeakPolarHBondContact O-CG2 3.45Å; I40-V42 PolarHBondContact O-N 2.95Å; V42-E46 VanDerWaalsContact O-OE2 3.05Å; V42-A162 HydrophobicContact CG1-CB 4.4Å; V42-N165 HydrophobicContact CG2-CB 3.62Å; V42-K289 PolarHBondContact O-NZ 2.94Å; V42-A299 HydrophobicContact CG1-CB 4.24Å; V42-L302 HydrophobicContact CG1-CD1 4.02Å |
| 43 | F | 93.3 | Very high | 92.4 | Very high | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 14% | 0.136 | C | C | . | . | G | 310 helix | trans | -86.4 | -9.1 | 178.5 | -59.7 | -80.3 | 0 | 0 | 0 | 113.2 | I40 T41 K45 E46 I47 N165 F169 W174 F178 L181 | I40-F43 HydrophobicContact CG1-CD2 3.86Å; I40-F43 HydrophobicContact CG1-CE2 4.39Å; I40-F43 WeakPolarHBondContact O-CD2 3.38Å; I40-F43 PolarHBondContact O-N 3.32Å; I40-F43 VanDerWaalsContact O-N 3.12Å; T41-F43 PolarHBondContact O-N 3.43Å; F43-K45 PolarHBondContact O-N 2.93Å; F43-E46 PolarHBondContact O-N 3.09Å; F43-I47 HydrophobicContact CB-CD1 4.04Å; F43-I47 HydrophobicContact CB-CG1 4.47Å; F43-I47 VanDerWaalsContact O-CG1 3.3Å; F43-I47 WeakPolarHBondContact O-CG1 3.19Å; F43-I47 PolarHBondContact O-N 3.26Å; F43-N165 HydrophobicContact CE2-CB 3.77Å; F43-N165 HydrophobicContact CZ-CB 3.79Å; F43-F169 HydrophobicContact CD1-CB 4.21Å; F43-F169 AromaticContact CD1-CD2 3.69Å; F43-F169 HydrophobicContact CD1-CD2 3.69Å; F43-F169 HydrophobicContact CD1-CG 4.24Å; F43-F169 HydrophobicContact CE1-CB 3.72Å; F43-F169 AromaticContact CE1-CD2 3.88Å; F43-F169 HydrophobicContact CE1-CD2 3.88Å; F43-F169 HydrophobicContact CE1-CG 4.21Å; F43-W174 HydrophobicContact CD1-CB 4.48Å; F43-F178 AromaticContact CD2-CE1 3.89Å; F43-F178 HydrophobicContact CD2-CE1 3.89Å; F43-F178 HydrophobicContact CE2-CE1 4.08Å; F43-F178 HydrophobicContact CG-CE1 4.16Å; F43-F178 HydrophobicContact CZ-CE1 4.48Å; F43-L181 HydrophobicContact CE2-CD1 4.04Å; F43-L181 HydrophobicContact CZ-CD1 4.17Å |
| 44 | F | 91.8 | Very high | 92.4 | Very high | 1 Ų | 1 | 29.9 Ų | 29.9 | 0% | 0.004 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -63.7 | -43.2 | -168 | -77.3 | 5.9 | 0 | 0 | 0 | 112.5 | I40 T41 E46 I47 E48 V58 I61 V282 | I40-F44 HydrophobicContact CG2-CE1 4.07Å; I40-F44 HydrophobicContact CG2-CZ 4.38Å; T41-F44 HydrophobicContact CG2-CD2 4.19Å; T41-F44 HydrophobicContact CG2-CE2 3.75Å; T41-F44 HydrophobicContact CG2-CZ 3.96Å; T41-F44 WeakPolarHBondContact O-CB 3.38Å; T41-F44 PolarHBondContact O-N 3.24Å; T41-F44 VanDerWaalsContact O-N 3.15Å; F44-E46 PolarHBondContact O-N 3.25Å; F44-I47 PolarHBondContact O-N 2.91Å; F44-E48 WeakPolarHBondContact O-CG 3.3Å; F44-E48 PolarHBondContact O-N 3.22Å; F44-V58 HydrophobicContact CB-CG1 3.61Å; F44-V58 HydrophobicContact CD1-CG1 3.58Å; F44-V58 HydrophobicContact CD2-CG1 3.97Å; F44-V58 HydrophobicContact CE1-CG1 4.15Å; F44-V58 HydrophobicContact CE2-CG1 4.48Å; F44-V58 HydrophobicContact CG-CG1 3.46Å; F44-V58 VanDerWaalsContact CG-CG1 3.46Å; F44-I61 HydrophobicContact CE1-CB 4.44Å; F44-I61 HydrophobicContact CZ-CB 4.38Å; F44-V282 HydrophobicContact CD2-CG1 4.14Å; F44-V282 HydrophobicContact CE2-CG1 3.67Å |
| 45 | K | 89.5 | Confident | 92.3 | Very high | 80 Ų | 80 | 28.7 Ų | 28.7 | 35% | 0.348 | 15% | 0.15 | S | C | . | . | H | α-helix | trans | -63.4 | -34.9 | -178.9 | -168.9 | 52.8 | 176 | 177.8 | 0 | 112.4 | F43 E48 S49 K289 | F43-K45 PolarHBondContact O-N 2.93Å; K45-E48 WeakPolarHBondContact CD-OE2 3.47Å; K45-E48 IonicContact NZ-OE2 3.03Å; K45-E48 PolarHBondContact NZ-OE2 3.11Å; K45-S49 PolarHBondContact O-N 3.49Å; K45-K289 HydrophobicContact CB-CD 3.84Å; K45-K289 HydrophobicContact CG-CD 4.18Å |
| 46 | E | 89 | Confident | 92.3 | Very high | 29 Ų | 29 | 29.5 Ų | 29.5 | 14% | 0.136 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -76.1 | -37.6 | 177.7 | -66.1 | 85.8 | 174.7 | 0 | 0 | 111.7 | V42 F43 F44 S49 I50 F169 K289 | V42-E46 VanDerWaalsContact O-OE2 3.05Å; F43-E46 PolarHBondContact O-N 3.09Å; F44-E46 PolarHBondContact O-N 3.25Å; E46-S49 PolarHBondContact O-N 3.25Å; E46-I50 WeakPolarHBondContact O-CB 3.31Å; E46-I50 VanDerWaalsContact O-CG1 3.23Å; E46-I50 WeakPolarHBondContact O-CG1 3.33Å; E46-I50 PolarHBondContact O-N 3.08Å; E46-F169 HydrophobicContact CB-CE2 3.97Å; E46-F169 HydrophobicContact CB-CZ 3.76Å; E46-F169 HydrophobicContact CG-CE1 3.79Å; E46-F169 HydrophobicContact CG-CE2 4.1Å; E46-F169 HydrophobicContact CG-CZ 3.48Å; E46-F169 VanDerWaalsContact CG-CZ 3.48Å; E46-K289 IonicContact OE1-NZ 2.77Å; E46-K289 PolarHBondContact OE1-NZ 3.37Å; E46-K289 IonicContact OE2-NZ 3.75Å; E46-K289 PolarHBondContact OE2-NZ 3.12Å |
| 47 | I | 91.3 | Very high | 92.2 | Very high | 2 Ų | 2 | 33.5 Ų | 33.5 | 1% | 0.01 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -62.4 | -42.9 | 172.2 | -69.7 | 171.3 | 0 | 0 | 0 | 110.7 | F43 F44 S49 I50 F51 V58 L112 F178 | F43-I47 HydrophobicContact CB-CD1 4.04Å; F43-I47 HydrophobicContact CB-CG1 4.47Å; F43-I47 VanDerWaalsContact O-CG1 3.3Å; F43-I47 WeakPolarHBondContact O-CG1 3.19Å; F43-I47 PolarHBondContact O-N 3.26Å; F44-I47 PolarHBondContact O-N 2.91Å; I47-S49 VanDerWaalsContact C-N 3.28Å; I47-S49 PolarHBondContact O-N 3.02Å; I47-I50 PolarHBondContact O-N 3.06Å; I47-F51 HydrophobicContact CB-CD2 4.46Å; I47-F51 HydrophobicContact CG2-CD2 3.72Å; I47-F51 HydrophobicContact CG2-CE2 4.24Å; I47-F51 WeakPolarHBondContact O-CD2 3.36Å; I47-F51 PolarHBondContact O-N 3.18Å; I47-V58 HydrophobicContact CB-CG1 4.24Å; I47-V58 HydrophobicContact CB-CG2 4.49Å; I47-V58 HydrophobicContact CG2-CG1 4Å; I47-V58 HydrophobicContact CG2-CG2 3.81Å; I47-L112 HydrophobicContact CG2-CD1 4.48Å; I47-F178 HydrophobicContact CD1-CZ 4.22Å |
| 48 | E | 90.7 | Very high | 92.2 | Very high | 15 Ų | 15 | 33.4 Ų | 33.4 | 7% | 0.07 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -53.9 | -47.1 | 172.8 | -73 | 168.9 | -155.9 | 0 | 0 | 110.7 | F44 K45 H52 A53 V58 | F44-E48 WeakPolarHBondContact O-CG 3.3Å; F44-E48 PolarHBondContact O-N 3.22Å; K45-E48 WeakPolarHBondContact CD-OE2 3.47Å; K45-E48 IonicContact NZ-OE2 3.03Å; K45-E48 PolarHBondContact NZ-OE2 3.11Å; E48-H52 VanDerWaalsContact O-CA 3.25Å; E48-H52 WeakPolarHBondContact O-CA 3.31Å; E48-H52 PolarHBondContact O-N 2.96Å; E48-A53 PolarHBondContact O-N 3.19Å; E48-A53 VanDerWaalsContact O-N 3.08Å; E48-V58 HydrophobicContact CB-CG2 4.42Å; E48-V58 HydrophobicContact CG-CB 4.14Å; E48-V58 HydrophobicContact CG-CG2 3.61Å |
| 49 | S | 89.9 | Confident | 92.3 | Very high | 84 Ų | 84 | 32.9 Ų | 32.9 | 59% | 0.587 | 17% | 0.172 | S | C | * | . | H | α-helix | trans | -69.3 | -37.5 | -179.2 | -172.7 | 0 | 0 | 0 | 0 | 113.7 | K45 E46 I47 | K45-S49 PolarHBondContact O-N 3.49Å; E46-S49 PolarHBondContact O-N 3.25Å; I47-S49 VanDerWaalsContact C-N 3.28Å; I47-S49 PolarHBondContact O-N 3.02Å |
| 50 | I | 91.8 | Very high | 92.5 | Very high | 73 Ų | 73 | 36.6 Ų | 36.6 | 37% | 0.374 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -77.2 | -40.7 | -175.8 | -70.5 | 167.3 | 0 | 0 | 0 | 111.3 | E46 I47 W174 | E46-I50 WeakPolarHBondContact O-CB 3.31Å; E46-I50 VanDerWaalsContact O-CG1 3.23Å; E46-I50 WeakPolarHBondContact O-CG1 3.33Å; E46-I50 PolarHBondContact O-N 3.08Å; I47-I50 PolarHBondContact O-N 3.06Å; I50-W174 HydrophobicContact CD1-CG 4.39Å |
| 51 | F | 92.4 | Very high | 92.6 | Very high | 43 Ų | 43 | 36.6 Ų | 36.6 | 19% | 0.189 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -97 | 2.2 | -177.1 | -67.3 | -74.9 | 0 | 0 | 0 | 113.4 | I47 A53 N107 V109 L112 W174 | I47-F51 HydrophobicContact CB-CD2 4.46Å; I47-F51 HydrophobicContact CG2-CD2 3.72Å; I47-F51 HydrophobicContact CG2-CE2 4.24Å; I47-F51 WeakPolarHBondContact O-CD2 3.36Å; I47-F51 PolarHBondContact O-N 3.18Å; F51-A53 HydrophobicContact CB-CB 4.35Å; F51-A53 PolarHBondContact O-N 3.08Å; F51-N107 VanDerWaalsContact CE1-C 3.5Å; F51-N107 VanDerWaalsContact CE1-O 3.27Å; F51-N107 WeakPolarHBondContact CE1-O 3.42Å; F51-V109 HydrophobicContact CB-CG2 3.56Å; F51-V109 HydrophobicContact CD1-CG2 4.29Å; F51-V109 HydrophobicContact CD2-CG2 4.32Å; F51-V109 HydrophobicContact CG-CG2 3.8Å; F51-L112 HydrophobicContact CE2-CD1 3.98Å; F51-L112 HydrophobicContact CZ-CD1 4.35Å; F51-W174 HydrophobicContact CE2-CH2 4.07Å; F51-W174 HydrophobicContact CE2-CZ2 4.03Å; F51-W174 AromaticContact CZ-CH2 3.69Å; F51-W174 HydrophobicContact CZ-CH2 3.69Å; F51-W174 AromaticContact CZ-CZ2 3.71Å; F51-W174 HydrophobicContact CZ-CZ2 3.71Å |
| 52 | H | 91.8 | Very high | 92.7 | Very high | 177 Ų | 177 | 36.6 Ų | 36.6 | 82% | 0.819 | 19% | 0.186 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 50.1 | 42.2 | -174 | -58.3 | -67.7 | 0 | 0 | 0 | 112.3 | E48 | E48-H52 VanDerWaalsContact O-CA 3.25Å; E48-H52 WeakPolarHBondContact O-CA 3.31Å; E48-H52 PolarHBondContact O-N 2.96Å |
| 53 | A | 92.9 | Very high | 92.8 | Very high | 15 Ų | 15 | 36.6 Ų | 36.6 | 12% | 0.124 | 19% | 0.186 | C | C | . | . | trans | -102.3 | 154.3 | -176.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | E48 F51 E57 V58 V109 | E48-A53 PolarHBondContact O-N 3.19Å; E48-A53 VanDerWaalsContact O-N 3.08Å; F51-A53 HydrophobicContact CB-CB 4.35Å; F51-A53 PolarHBondContact O-N 3.08Å; A53-E57 WeakPolarHBondContact CA-OE2 3.32Å; A53-E57 HydrophobicContact CB-CB 4.25Å; A53-V58 HydrophobicContact CB-CG2 3.99Å; A53-V109 HydrophobicContact CB-CG2 4.09Å | ||
| 54 | T | 93.9 | Very high | 93 | Very high | 61 Ų | 61 | 38.1 Ų | 38.1 | 37% | 0.374 | 19% | 0.193 | S | C | . | . | trans | -76.3 | 161.2 | 176.1 | 58.7 | 0 | 0 | 0 | 0 | 112.2 | S56 E57 V58 | T54-S56 VanDerWaalsContact C-N 3.25Å; T54-S56 PolarHBondContact O-N 3.39Å; T54-E57 PolarHBondContact N-OE2 3.18Å; T54-E57 PolarHBondContact O-N 3.02Å; T54-E57 VanDerWaalsContact OG1-CD 3.26Å; T54-E57 WeakPolarHBondContact OG1-CG 3.35Å; T54-E57 PolarHBondContact OG1-N 2.67Å; T54-E57 PolarHBondContact OG1-OE2 3.36Å; T54-V58 PolarHBondContact O-N 3.44Å; T54-V58 VanDerWaalsContact O-N 3.09Å | ||
| 55 | T | 91.4 | Very high | 93.2 | Very high | 8 Ų | 8 | 38 Ų | 38 | 5% | 0.049 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -58.9 | -41.5 | 176.5 | -46.8 | 0 | 0 | 0 | 0 | 110.8 | V58 S59 F283 D414 Y419 | T55-V58 PolarHBondContact O-N 2.9Å; T55-S59 VanDerWaalsContact O-CB 3.3Å; T55-S59 WeakPolarHBondContact O-CB 3.47Å; T55-S59 PolarHBondContact O-N 2.93Å; T55-S59 PolarHBondContact O-OG 2.78Å; T55-F283 HydrophobicContact CG2-CD1 3.95Å; T55-F283 HydrophobicContact CG2-CE1 3.5Å; T55-F283 HydrophobicContact CG2-CZ 4.08Å; T55-D414 WeakPolarHBondContact CA-OD1 3.43Å; T55-D414 WeakPolarHBondContact CB-OD1 3.35Å; T55-D414 PolarHBondContact N-OD1 3.18Å; T55-D414 PolarHBondContact N-OD2 2.8Å; T55-D414 PolarHBondContact OG1-OD1 3.45Å; T55-Y419 HydrophobicContact CG2-CE1 3.85Å; T55-Y419 WeakPolarHBondContact CG2-OH 3.46Å |
| 56 | S | 93.3 | Very high | 93.5 | Very high | 17 Ų | 17 | 34.4 Ų | 34.4 | 12% | 0.119 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -56.3 | -50.6 | 174.9 | 167.1 | 0 | 0 | 0 | 0 | 111.5 | T54 S59 W60 P407 D414 | T54-S56 VanDerWaalsContact C-N 3.25Å; T54-S56 PolarHBondContact O-N 3.39Å; S56-S59 PolarHBondContact O-N 3.19Å; S56-S59 PolarHBondContact O-OG 3.43Å; S56-W60 PolarHBondContact O-N 2.87Å; S56-P407 PolarHBondContact OG-O 2.83Å; S56-D414 VanDerWaalsContact CB-OD2 3.23Å; S56-D414 WeakPolarHBondContact CB-OD2 3.44Å; S56-D414 PolarHBondContact N-OD2 2.93Å |
| 57 | E | 94.3 | Very high | 93.8 | Very high | 84 Ų | 84 | 33.5 Ų | 33.5 | 39% | 0.393 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -58.3 | -51.2 | 179.2 | -75.5 | 166.9 | 142.3 | 0 | 0 | 111.4 | A53 T54 S59 W60 Y113 | A53-E57 WeakPolarHBondContact CA-OE2 3.32Å; A53-E57 HydrophobicContact CB-CB 4.25Å; T54-E57 PolarHBondContact N-OE2 3.18Å; T54-E57 PolarHBondContact O-N 3.02Å; T54-E57 VanDerWaalsContact OG1-CD 3.26Å; T54-E57 WeakPolarHBondContact OG1-CG 3.35Å; T54-E57 PolarHBondContact OG1-N 2.67Å; T54-E57 PolarHBondContact OG1-OE2 3.36Å; E57-S59 VanDerWaalsContact C-N 3.28Å; E57-S59 PolarHBondContact O-N 3.46Å; E57-W60 WeakPolarHBondContact O-CB 3.33Å; E57-W60 PolarHBondContact O-N 2.98Å; E57-W60 VanDerWaalsContact O-N 3.15Å; E57-Y113 WeakPolarHBondContact CA-OH 3.4Å; E57-Y113 VanDerWaalsContact O-CE1 3.29Å; E57-Y113 WeakPolarHBondContact O-CE1 3.02Å; E57-Y113 PolarHBondContact O-OH 3.36Å |
| 58 | V | 94.3 | Very high | 94 | Very high | 0 Ų | 0 | 34.7 Ų | 34.7 | 0% | 0 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -64.7 | -34.6 | -178.6 | 180 | 0 | 0 | 0 | 0 | 112.2 | F44 I47 E48 A53 T54 T55 W60 I61 | F44-V58 HydrophobicContact CB-CG1 3.61Å; F44-V58 HydrophobicContact CD1-CG1 3.58Å; F44-V58 HydrophobicContact CD2-CG1 3.97Å; F44-V58 HydrophobicContact CE1-CG1 4.15Å; F44-V58 HydrophobicContact CE2-CG1 4.48Å; F44-V58 HydrophobicContact CG-CG1 3.46Å; F44-V58 VanDerWaalsContact CG-CG1 3.46Å; I47-V58 HydrophobicContact CB-CG1 4.24Å; I47-V58 HydrophobicContact CB-CG2 4.49Å; I47-V58 HydrophobicContact CG2-CG1 4Å; I47-V58 HydrophobicContact CG2-CG2 3.81Å; E48-V58 HydrophobicContact CB-CG2 4.42Å; E48-V58 HydrophobicContact CG-CB 4.14Å; E48-V58 HydrophobicContact CG-CG2 3.61Å; A53-V58 HydrophobicContact CB-CG2 3.99Å; T54-V58 PolarHBondContact O-N 3.44Å; T54-V58 VanDerWaalsContact O-N 3.09Å; T55-V58 PolarHBondContact O-N 2.9Å; V58-W60 PolarHBondContact O-N 2.85Å; V58-I61 HydrophobicContact CG1-CD1 4.26Å; V58-I61 WeakPolarHBondContact O-CB 3.46Å; V58-I61 WeakPolarHBondContact O-CG1 3.5Å; V58-I61 PolarHBondContact O-N 3.11Å; V58-I61 VanDerWaalsContact O-N 3.11Å |
| 59 | S | 95.1 | Very high | 94.2 | Very high | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -64.4 | -23.8 | 178.2 | 79 | 0 | 0 | 0 | 0 | 114.2 | T55 S56 E57 I61 S62 S63 P407 | T55-S59 VanDerWaalsContact O-CB 3.3Å; T55-S59 WeakPolarHBondContact O-CB 3.47Å; T55-S59 PolarHBondContact O-N 2.93Å; T55-S59 PolarHBondContact O-OG 2.78Å; S56-S59 PolarHBondContact O-N 3.19Å; S56-S59 PolarHBondContact O-OG 3.43Å; E57-S59 VanDerWaalsContact C-N 3.28Å; E57-S59 PolarHBondContact O-N 3.46Å; S59-I61 PolarHBondContact O-N 2.74Å; S59-S62 PolarHBondContact O-N 3Å; S59-S62 PolarHBondContact O-OG 3.07Å; S59-S63 PolarHBondContact O-N 2.84Å; S59-S63 VanDerWaalsContact O-N 3.16Å; S59-S63 PolarHBondContact O-OG 2.74Å; S59-P407 WeakPolarHBondContact OG-CA 3.44Å |
| 60 | W | 96.5 | Very high | 94.2 | Very high | 78 Ų | 78 | 31.6 Ų | 31.6 | 30% | 0.295 | 16% | 0.157 | S | C | . | . | H | α-helix | trans | -59 | -30.3 | 173.5 | -81.7 | 100.7 | 0 | 0 | 0 | 112 | S56 E57 V58 S62 S63 I64 Y113 L403 L404 P407 | S56-W60 PolarHBondContact O-N 2.87Å; E57-W60 WeakPolarHBondContact O-CB 3.33Å; E57-W60 PolarHBondContact O-N 2.98Å; E57-W60 VanDerWaalsContact O-N 3.15Å; V58-W60 PolarHBondContact O-N 2.85Å; W60-S62 PolarHBondContact O-N 2.9Å; W60-S63 PolarHBondContact O-N 2.87Å; W60-I64 HydrophobicContact CB-CD1 4.15Å; W60-I64 HydrophobicContact CE3-CD1 4.14Å; W60-I64 HydrophobicContact CE3-CG1 3.97Å; W60-I64 VanDerWaalsContact O-CB 3.28Å; W60-I64 WeakPolarHBondContact O-CB 3.45Å; W60-I64 WeakPolarHBondContact O-CD1 3.38Å; W60-I64 WeakPolarHBondContact O-CG1 3.42Å; W60-I64 PolarHBondContact O-N 3.44Å; W60-Y113 HydrophobicContact CB-CD1 4.11Å; W60-Y113 HydrophobicContact CB-CE1 3.57Å; W60-L403 HydrophobicContact CE3-CD1 3.94Å; W60-L403 HydrophobicContact CE3-CG 4.48Å; W60-L403 HydrophobicContact CZ3-CD1 3.63Å; W60-L403 HydrophobicContact CZ3-CD2 4.37Å; W60-L403 HydrophobicContact CZ3-CG 3.72Å; W60-L404 HydrophobicContact CH2-CD2 3.83Å; W60-P407 HydrophobicContact CB-CG 4.48Å; W60-P407 HydrophobicContact CD2-CB 3.97Å; W60-P407 HydrophobicContact CD2-CG 3.53Å; W60-P407 VanDerWaalsContact CE2-CB 3.48Å; W60-P407 HydrophobicContact CE3-CG 4.04Å; W60-P407 HydrophobicContact CG-CB 4.13Å; W60-P407 HydrophobicContact CG-CG 3.72Å; W60-P407 HydrophobicContact CZ2-CB 3.91Å; W60-P407 HydrophobicContact CZ2-CG 4.12Å |
| 61 | I | 95.6 | Very high | 94.2 | Very high | 1 Ų | 1 | 29.5 Ų | 29.5 | 1% | 0.005 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -57.5 | -54.4 | 179.4 | -59.2 | 171.1 | 0 | 0 | 0 | 110.7 | F44 V58 S59 M65 L112 Y113 I116 | F44-I61 HydrophobicContact CE1-CB 4.44Å; F44-I61 HydrophobicContact CZ-CB 4.38Å; V58-I61 HydrophobicContact CG1-CD1 4.26Å; V58-I61 WeakPolarHBondContact O-CB 3.46Å; V58-I61 WeakPolarHBondContact O-CG1 3.5Å; V58-I61 PolarHBondContact O-N 3.11Å; V58-I61 VanDerWaalsContact O-N 3.11Å; S59-I61 PolarHBondContact O-N 2.74Å; I61-M65 WeakPolarHBondContact O-CB 3.35Å; I61-M65 PolarHBondContact O-N 3.09Å; I61-M65 VanDerWaalsContact O-N 3.16Å; I61-L112 HydrophobicContact CD1-CB 4.16Å; I61-L112 HydrophobicContact CD1-CD1 4.31Å; I61-Y113 HydrophobicContact CB-CD1 4.5Å; I61-Y113 HydrophobicContact CG1-CD1 3.62Å; I61-Y113 HydrophobicContact CG1-CE1 3.7Å; I61-I116 HydrophobicContact CG2-CB 3.93Å; I61-I116 HydrophobicContact CG2-CD1 4.34Å; I61-I116 HydrophobicContact CG2-CG2 3.66Å |
| 62 | S | 94.6 | Very high | 94.1 | Very high | 0 Ų | 0 | 27.5 Ų | 27.5 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -69.6 | -35.2 | 179.3 | 60.4 | 0 | 0 | 0 | 0 | 112.8 | S59 W60 M65 L66 | S59-S62 PolarHBondContact O-N 3Å; S59-S62 PolarHBondContact O-OG 3.07Å; W60-S62 PolarHBondContact O-N 2.9Å; S62-M65 PolarHBondContact O-N 2.96Å; S62-L66 PolarHBondContact O-N 3.36Å |
| 63 | S | 95.9 | Very high | 93.9 | Very high | 1 Ų | 1 | 19.5 Ų | 19.5 | 1% | 0.007 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -70.4 | -43.2 | -176.9 | -51.4 | 0 | 0 | 0 | 0 | 111.4 | S59 W60 M65 L66 A67 L403 P406 P407 | S59-S63 PolarHBondContact O-N 2.84Å; S59-S63 VanDerWaalsContact O-N 3.16Å; S59-S63 PolarHBondContact O-OG 2.74Å; W60-S63 PolarHBondContact O-N 2.87Å; S63-M65 VanDerWaalsContact C-N 3.35Å; S63-L66 PolarHBondContact O-N 3.37Å; S63-A67 WeakPolarHBondContact O-CB 3.46Å; S63-A67 PolarHBondContact O-N 3.11Å; S63-L403 WeakPolarHBondContact CB-O 3.3Å; S63-P406 WeakPolarHBondContact OG-CB 3.38Å; S63-P406 VanDerWaalsContact OG-CG 3.31Å; S63-P406 WeakPolarHBondContact OG-CG 3.17Å; S63-P407 WeakPolarHBondContact OG-CD 3.35Å |
| 64 | I | 97.1 | Very high | 93.5 | Very high | 31 Ų | 31 | 20.5 Ų | 20.5 | 16% | 0.159 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -61.6 | -45 | 171.7 | -65.6 | 165.7 | 0 | 0 | 0 | 109.8 | W60 L66 A67 V68 Y113 L403 | W60-I64 HydrophobicContact CB-CD1 4.15Å; W60-I64 HydrophobicContact CE3-CD1 4.14Å; W60-I64 HydrophobicContact CE3-CG1 3.97Å; W60-I64 VanDerWaalsContact O-CB 3.28Å; W60-I64 WeakPolarHBondContact O-CB 3.45Å; W60-I64 WeakPolarHBondContact O-CD1 3.38Å; W60-I64 WeakPolarHBondContact O-CG1 3.42Å; W60-I64 PolarHBondContact O-N 3.44Å; I64-L66 PolarHBondContact O-N 2.91Å; I64-A67 PolarHBondContact O-N 2.96Å; I64-V68 HydrophobicContact CG2-CG2 4.03Å; I64-V68 WeakPolarHBondContact O-CB 3.35Å; I64-V68 VanDerWaalsContact O-CG2 3.24Å; I64-V68 WeakPolarHBondContact O-CG2 3.4Å; I64-V68 PolarHBondContact O-N 3.46Å; I64-Y113 HydrophobicContact CD1-CD1 4.18Å; I64-Y113 HydrophobicContact CD1-CD2 4.49Å; I64-Y113 HydrophobicContact CD1-CG 3.94Å; I64-L403 HydrophobicContact CB-CD1 4.31Å; I64-L403 HydrophobicContact CG1-CD1 3.67Å |
| 65 | M | 96.5 | Very high | 93.2 | Very high | 0 Ų | 0 | 21.7 Ų | 21.7 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -59.7 | -47.4 | 179.7 | -172.4 | 167.7 | 31 | 0 | 0 | 112.4 | F36 P37 I40 I61 S62 S63 M69 I116 G117 L124 | F36-M65 HydrophobicContact CD1-CE 4.25Å; F36-M65 HydrophobicContact CD1-SD 3.97Å; F36-M65 HydrophobicContact CE1-SD 4.44Å; P37-M65 HydrophobicContact CB-CE 3.64Å; P37-M65 HydrophobicContact CB-CG 4.5Å; P37-M65 HydrophobicContact CB-SD 4.38Å; P37-M65 HydrophobicContact CG-CE 3.86Å; P37-M65 HydrophobicContact CG-CG 4.04Å; P37-M65 HydrophobicContact CG-SD 3.95Å; I40-M65 HydrophobicContact CG2-CE 4.02Å; I61-M65 WeakPolarHBondContact O-CB 3.35Å; I61-M65 PolarHBondContact O-N 3.09Å; I61-M65 VanDerWaalsContact O-N 3.16Å; S62-M65 PolarHBondContact O-N 2.96Å; S63-M65 VanDerWaalsContact C-N 3.35Å; M65-M69 VanDerWaalsContact O-CB 3.26Å; M65-M69 WeakPolarHBondContact O-CB 3.35Å; M65-M69 PolarHBondContact O-N 3.06Å; M65-I116 HydrophobicContact CE-CG2 4.02Å; M65-I116 HydrophobicContact SD-CG2 4.24Å; M65-G117 WeakPolarHBondContact CA-O 3.21Å; M65-L124 HydrophobicContact CG-CD1 4.23Å; M65-L124 HydrophobicContact SD-CD1 3.84Å |
| 66 | L | 94.4 | Very high | 93.1 | Very high | 4 Ų | 4 | 21.3 Ų | 21.3 | 2% | 0.021 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -66.3 | -43.8 | 177 | -74.9 | 170.1 | 0 | 0 | 0 | 111.7 | P37 S62 S63 I64 V68 M69 Y70 F278 V402 | P37-L66 HydrophobicContact CB-CD1 4.38Å; P37-L66 HydrophobicContact CB-CD2 3.79Å; P37-L66 HydrophobicContact CB-CG 3.79Å; P37-L66 HydrophobicContact CG-CD2 3.86Å; P37-L66 HydrophobicContact CG-CG 4.26Å; S62-L66 PolarHBondContact O-N 3.36Å; S63-L66 PolarHBondContact O-N 3.37Å; I64-L66 PolarHBondContact O-N 2.91Å; L66-V68 PolarHBondContact O-N 3Å; L66-M69 HydrophobicContact CD2-CE 3.88Å; L66-M69 WeakPolarHBondContact O-CB 3.39Å; L66-M69 PolarHBondContact O-N 3.47Å; L66-Y70 HydrophobicContact CD2-CE1 4.27Å; L66-Y70 WeakPolarHBondContact O-CD1 3.31Å; L66-Y70 PolarHBondContact O-N 3.15Å; L66-F278 HydrophobicContact CD1-CD1 4.29Å; L66-F278 HydrophobicContact CD1-CG 4.44Å; L66-V402 HydrophobicContact CB-CG1 3.55Å; L66-V402 HydrophobicContact CD1-CG1 4.35Å |
| 67 | A | 95.8 | Very high | 92.7 | Very high | 9 Ų | 9 | 22.8 Ų | 22.8 | 7% | 0.074 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -62.6 | -44.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | S63 I64 M69 Y70 G71 C399 L403 | S63-A67 WeakPolarHBondContact O-CB 3.46Å; S63-A67 PolarHBondContact O-N 3.11Å; I64-A67 PolarHBondContact O-N 2.96Å; A67-M69 VanDerWaalsContact C-N 3.33Å; A67-Y70 PolarHBondContact O-N 3.45Å; A67-G71 PolarHBondContact O-N 3.27Å; A67-C399 PolarHBondContact O-SG 3.38Å; A67-C399 VanDerWaalsContact O-SG 3.42Å; A67-L403 HydrophobicContact CB-CB 3.75Å; A67-L403 HydrophobicContact CB-CD1 3.97Å; A67-L403 HydrophobicContact CB-CG 4.34Å |
| 68 | V | 96.4 | Very high | 92.2 | Very high | 28 Ų | 28 | 23 Ų | 23 | 17% | 0.17 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -67.3 | -36.1 | 176 | 177.2 | 0 | 0 | 0 | 0 | 110.8 | I64 L66 G72 F118 L122 | I64-V68 HydrophobicContact CG2-CG2 4.03Å; I64-V68 WeakPolarHBondContact O-CB 3.35Å; I64-V68 VanDerWaalsContact O-CG2 3.24Å; I64-V68 WeakPolarHBondContact O-CG2 3.4Å; I64-V68 PolarHBondContact O-N 3.46Å; L66-V68 PolarHBondContact O-N 3Å; V68-G72 WeakPolarHBondContact O-CA 3.18Å; V68-G72 PolarHBondContact O-N 3.36Å; V68-F118 HydrophobicContact CG1-CD2 4.27Å; V68-F118 HydrophobicContact CG2-CD2 3.9Å; V68-L122 HydrophobicContact CG1-CB 4.01Å |
| 69 | M | 94.6 | Very high | 91.8 | Very high | 1 Ų | 1 | 25.3 Ų | 25.3 | 1% | 0.005 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -61.8 | -45.3 | 175.1 | -175.3 | -179.1 | 72.7 | 0 | 0 | 112.2 | Y34 M65 L66 A67 L124 A125 L128 | Y34-M69 HydrophobicContact CD1-CE 3.81Å; Y34-M69 HydrophobicContact CE1-CE 3.83Å; M65-M69 VanDerWaalsContact O-CB 3.26Å; M65-M69 WeakPolarHBondContact O-CB 3.35Å; M65-M69 PolarHBondContact O-N 3.06Å; L66-M69 HydrophobicContact CD2-CE 3.88Å; L66-M69 WeakPolarHBondContact O-CB 3.39Å; L66-M69 PolarHBondContact O-N 3.47Å; A67-M69 VanDerWaalsContact C-N 3.33Å; M69-L124 HydrophobicContact CG-CB 4.24Å; M69-L124 HydrophobicContact SD-CB 4.06Å; M69-A125 WeakPolarHBondContact O-CB 3.18Å; M69-L128 HydrophobicContact CE-CD2 4.35Å; M69-L128 HydrophobicContact CG-CD2 4.33Å; M69-L128 HydrophobicContact SD-CD2 4.2Å |
| 70 | Y | 90.6 | Very high | 91.3 | Very high | 33 Ų | 33 | 25.7 Ų | 25.7 | 13% | 0.129 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -72.3 | -45.8 | -179.5 | -80.3 | 52.5 | 0 | 0 | 0 | 110.7 | Y34 L66 A67 G72 G73 | Y34-Y70 HydrophobicContact CE1-CE1 4.17Å; L66-Y70 HydrophobicContact CD2-CE1 4.27Å; L66-Y70 WeakPolarHBondContact O-CD1 3.31Å; L66-Y70 PolarHBondContact O-N 3.15Å; A67-Y70 PolarHBondContact O-N 3.45Å; Y70-G72 VanDerWaalsContact C-N 3.27Å; Y70-G72 PolarHBondContact O-N 3.01Å; Y70-G73 PolarHBondContact O-N 3.44Å |
| 71 | G | 90.6 | Very high | 90.6 | Very high | 28 Ų | 28 | 26.2 Ų | 26.2 | 29% | 0.289 | 15% | 0.153 | S | C | . | . | H | α-helix | trans | -71.2 | -22.1 | -179.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | A67 G73 P74 C399 | A67-G71 PolarHBondContact O-N 3.27Å; G71-G73 PolarHBondContact O-N 3.49Å; G71-P74 WeakPolarHBondContact O-CD 3.46Å; G71-C399 WeakPolarHBondContact CA-SG 3.41Å; G71-C399 PolarHBondContact N-SG 3.13Å |
| 72 | G | 90 | Very high | 90 | Very high | 2 Ų | 2 | 33.1 Ų | 33.1 | 2% | 0.021 | 18% | 0.183 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -73.1 | -7.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | V68 Y70 I75 S76 | V68-G72 WeakPolarHBondContact O-CA 3.18Å; V68-G72 PolarHBondContact O-N 3.36Å; Y70-G72 VanDerWaalsContact C-N 3.27Å; Y70-G72 PolarHBondContact O-N 3.01Å; G72-I75 PolarHBondContact O-N 3.33Å; G72-S76 WeakPolarHBondContact O-CB 3.45Å; G72-S76 PolarHBondContact O-N 3.03Å |
| 73 | G | 87.2 | Confident | 89.7 | Confident | 8 Ų | 8 | 39 Ų | 39 | 8% | 0.082 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -55.3 | -57 | -179 | 0 | 0 | 0 | 0 | 0 | 115.4 | Y70 G71 I75 S76 S77 N129 | Y70-G73 PolarHBondContact O-N 3.44Å; G71-G73 PolarHBondContact O-N 3.49Å; G73-I75 VanDerWaalsContact C-N 3.3Å; G73-I75 PolarHBondContact O-N 2.88Å; G73-S76 WeakPolarHBondContact O-CB 3.41Å; G73-S76 PolarHBondContact O-N 2.88Å; G73-S77 PolarHBondContact O-N 3.41Å; G73-N129 WeakPolarHBondContact CA-ND2 3.5Å |
| 74 | P | 84.4 | Confident | 89.3 | Confident | 37 Ų | 37 | 40.4 Ų | 40.4 | 24% | 0.24 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -58.6 | -40.9 | 177.2 | -23.9 | 32.5 | 0 | 0 | 0 | 112.8 | G71 S77 I78 I396 | G71-P74 WeakPolarHBondContact O-CD 3.46Å; P74-S77 WeakPolarHBondContact O-CB 3.42Å; P74-S77 PolarHBondContact O-N 3Å; P74-I78 WeakPolarHBondContact O-CG1 3.38Å; P74-I78 PolarHBondContact O-N 3.21Å; P74-I396 HydrophobicContact CG-CD1 3.62Å; P74-I396 HydrophobicContact CG-CG1 3.83Å |
| 75 | I | 88.7 | Confident | 88.9 | Confident | 86 Ų | 86 | 39.3 Ų | 39.3 | 44% | 0.441 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -60.9 | -51.8 | 177.5 | -59.8 | 175 | 0 | 0 | 0 | 109 | G72 G73 S77 I78 L79 F126 | G72-I75 PolarHBondContact O-N 3.33Å; G73-I75 VanDerWaalsContact C-N 3.3Å; G73-I75 PolarHBondContact O-N 2.88Å; I75-S77 VanDerWaalsContact C-N 3.28Å; I75-S77 PolarHBondContact O-N 3.11Å; I75-I78 PolarHBondContact O-N 3.5Å; I75-L79 HydrophobicContact CG2-CD1 3.43Å; I75-L79 VanDerWaalsContact CG2-CD1 3.43Å; I75-L79 WeakPolarHBondContact O-CD1 3.28Å; I75-L79 PolarHBondContact O-N 3.3Å; I75-F126 HydrophobicContact CG2-CE1 3.93Å; I75-F126 HydrophobicContact CG2-CZ 4.08Å |
| 76 | S | 89.7 | Confident | 88.8 | Confident | 0 Ų | 0 | 45.3 Ų | 45.3 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -55.7 | -42.8 | 176.6 | -170.3 | 0 | 0 | 0 | 0 | 112 | G72 G73 L79 V80 | G72-S76 WeakPolarHBondContact O-CB 3.45Å; G72-S76 PolarHBondContact O-N 3.03Å; G73-S76 WeakPolarHBondContact O-CB 3.41Å; G73-S76 PolarHBondContact O-N 2.88Å; S76-L79 PolarHBondContact O-N 2.85Å; S76-V80 WeakPolarHBondContact O-CB 3.48Å; S76-V80 WeakPolarHBondContact O-CG2 3.42Å; S76-V80 PolarHBondContact O-N 3.32Å |
| 77 | S | 83.9 | Confident | 88.8 | Confident | 47 Ų | 47 | 49.1 Ų | 49.1 | 33% | 0.329 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -61.8 | -45.4 | 179.2 | -176.1 | 0 | 0 | 0 | 0 | 112.4 | G73 P74 I75 L79 V80 N81 | G73-S77 PolarHBondContact O-N 3.41Å; P74-S77 WeakPolarHBondContact O-CB 3.42Å; P74-S77 PolarHBondContact O-N 3Å; I75-S77 VanDerWaalsContact C-N 3.28Å; I75-S77 PolarHBondContact O-N 3.11Å; S77-L79 PolarHBondContact O-N 3.23Å; S77-V80 PolarHBondContact O-N 3.26Å; S77-N81 PolarHBondContact O-N 2.78Å; S77-N81 PolarHBondContact O-ND2 3.23Å |
| 78 | I | 83.8 | Confident | 88.8 | Confident | 89 Ų | 89 | 48.9 Ų | 48.9 | 46% | 0.456 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -61.9 | -45.4 | 176.8 | -66.5 | 166.2 | 0 | 0 | 0 | 110.7 | P74 I75 N81 K82 | P74-I78 WeakPolarHBondContact O-CG1 3.38Å; P74-I78 PolarHBondContact O-N 3.21Å; I75-I78 PolarHBondContact O-N 3.5Å; I78-N81 PolarHBondContact O-N 3.41Å; I78-K82 PolarHBondContact O-N 3.36Å; I78-K82 VanDerWaalsContact O-N 3.15Å |
| 79 | L | 86.1 | Confident | 88.7 | Confident | 49 Ų | 49 | 47.5 Ų | 47.5 | 26% | 0.257 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -63.2 | -41.8 | 177.9 | -85.9 | 115.1 | 0 | 0 | 0 | 112.1 | I75 S76 S77 N81 K82 Y83 V88 F126 | I75-L79 HydrophobicContact CG2-CD1 3.43Å; I75-L79 VanDerWaalsContact CG2-CD1 3.43Å; I75-L79 WeakPolarHBondContact O-CD1 3.28Å; I75-L79 PolarHBondContact O-N 3.3Å; S76-L79 PolarHBondContact O-N 2.85Å; S77-L79 PolarHBondContact O-N 3.23Å; L79-N81 VanDerWaalsContact C-N 3.33Å; L79-N81 PolarHBondContact O-N 3.06Å; L79-K82 PolarHBondContact O-N 3.36Å; L79-Y83 HydrophobicContact CD2-CD2 4.35Å; L79-Y83 PolarHBondContact O-N 3.49Å; L79-V88 HydrophobicContact CB-CG2 3.89Å; L79-F126 HydrophobicContact CD1-CE1 4.26Å; L79-F126 HydrophobicContact CD1-CZ 4.04Å |
| 80 | V | 84.6 | Confident | 88.8 | Confident | 8 Ų | 8 | 50.3 Ų | 50.3 | 5% | 0.048 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -61.4 | -42.3 | 176.6 | 167.4 | 0 | 0 | 0 | 0 | 111.3 | S76 S77 K82 G84 S85 V88 P130 | S76-V80 WeakPolarHBondContact O-CB 3.48Å; S76-V80 WeakPolarHBondContact O-CG2 3.42Å; S76-V80 PolarHBondContact O-N 3.32Å; S77-V80 PolarHBondContact O-N 3.26Å; V80-K82 VanDerWaalsContact C-N 3.27Å; V80-K82 PolarHBondContact O-N 2.87Å; V80-G84 WeakPolarHBondContact O-CA 3.49Å; V80-G84 PolarHBondContact O-N 3.3Å; V80-S85 VanDerWaalsContact CG1-OG 3.29Å; V80-S85 WeakPolarHBondContact CG1-OG 3.23Å; V80-V88 HydrophobicContact CG2-CB 4.12Å; V80-V88 HydrophobicContact CG2-CG1 4.14Å; V80-V88 HydrophobicContact CG2-CG2 4.06Å; V80-P130 HydrophobicContact CG2-CB 3.67Å; V80-P130 HydrophobicContact CG2-CG 3.48Å; V80-P130 VanDerWaalsContact CG2-CG 3.48Å |
| 81 | N | 81.3 | Confident | 89.1 | Confident | 89 Ų | 89 | 52.9 Ų | 52.9 | 48% | 0.476 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -66.1 | -31 | 178.9 | -72.5 | -30.9 | 0 | 0 | 0 | 112.5 | S77 I78 L79 | S77-N81 PolarHBondContact O-N 2.78Å; S77-N81 PolarHBondContact O-ND2 3.23Å; I78-N81 PolarHBondContact O-N 3.41Å; L79-N81 VanDerWaalsContact C-N 3.33Å; L79-N81 PolarHBondContact O-N 3.06Å |
| 82 | K | 84.2 | Confident | 89.4 | Confident | 146 Ų | 146 | 51.5 Ų | 51.5 | 64% | 0.635 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -88.7 | -42.2 | -177.9 | -170.9 | 175.6 | 176.8 | -163.8 | 0 | 113.8 | I78 L79 V80 | I78-K82 PolarHBondContact O-N 3.36Å; I78-K82 VanDerWaalsContact O-N 3.15Å; L79-K82 PolarHBondContact O-N 3.36Å; V80-K82 VanDerWaalsContact C-N 3.27Å; V80-K82 PolarHBondContact O-N 2.87Å |
| 83 | Y | 87.8 | Confident | 89.7 | Confident | 124 Ų | 124 | 51.4 Ų | 51.4 | 49% | 0.486 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -114.1 | -11.8 | -171 | -61.9 | -74.8 | 0 | 0 | 0 | 113.8 | L79 | L79-Y83 HydrophobicContact CD2-CD2 4.35Å; L79-Y83 PolarHBondContact O-N 3.49Å |
| 84 | G | 87.7 | Confident | 90.2 | Very high | 30 Ų | 30 | 53.6 Ų | 53.6 | 31% | 0.309 | 28% | 0.275 | S | S | . | . | trans | 89 | 151.3 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | V80 R86 V88 | V80-G84 WeakPolarHBondContact O-CA 3.49Å; V80-G84 PolarHBondContact O-N 3.3Å; G84-R86 PolarHBondContact O-N 3.12Å; G84-V88 WeakPolarHBondContact O-CG2 3.37Å; G84-V88 PolarHBondContact O-N 2.87Å | ||
| 85 | S | 88.9 | Confident | 90.8 | Very high | 8 Ų | 8 | 54.5 Ų | 54.5 | 6% | 0.056 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -60.6 | -41.1 | -173.2 | -52.6 | 0 | 0 | 0 | 0 | 114.3 | V80 I87 V88 M89 M134 | V80-S85 VanDerWaalsContact CG1-OG 3.29Å; V80-S85 WeakPolarHBondContact CG1-OG 3.23Å; S85-I87 PolarHBondContact O-N 3.27Å; S85-V88 PolarHBondContact O-N 3.1Å; S85-M89 WeakPolarHBondContact O-CG 3.49Å; S85-M89 PolarHBondContact O-N 3.38Å; S85-M89 VanDerWaalsContact O-N 3.08Å; S85-M134 PolarHBondContact OG-SD 3.07Å; S85-M134 VanDerWaalsContact OG-SD 3.38Å |
| 86 | R | 93.9 | Very high | 91.1 | Very high | 126 Ų | 126 | 50.4 Ų | 50.4 | 48% | 0.475 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -58.4 | -47 | -176.7 | -168.1 | 177.1 | 78.1 | 174.3 | 4.4 | 112.6 | G84 I90 G192 | G84-R86 PolarHBondContact O-N 3.12Å; R86-I90 HydrophobicContact CG-CD1 4.15Å; R86-I90 WeakPolarHBondContact O-CG1 3.26Å; R86-I90 PolarHBondContact O-N 2.94Å; R86-G192 WeakPolarHBondContact CG-O 3.16Å |
| 87 | I | 94.3 | Very high | 91.4 | Very high | 84 Ų | 84 | 50.4 Ų | 50.4 | 43% | 0.431 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -68.6 | -42.6 | -176.7 | -60.6 | -179.4 | 0 | 0 | 0 | 110 | S85 M89 I90 I91 | S85-I87 PolarHBondContact O-N 3.27Å; I87-M89 VanDerWaalsContact C-N 3.34Å; I87-M89 PolarHBondContact O-N 3.33Å; I87-I90 PolarHBondContact O-N 3.46Å; I87-I91 HydrophobicContact CG2-CD1 3.78Å; I87-I91 HydrophobicContact CG2-CG1 4.39Å; I87-I91 WeakPolarHBondContact O-CG1 3.27Å; I87-I91 PolarHBondContact O-N 2.89Å |
| 88 | V | 95.4 | Very high | 92.1 | Very high | 3 Ų | 3 | 51.8 Ų | 51.8 | 2% | 0.018 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -61.5 | -42.7 | -179.8 | 177.8 | 0 | 0 | 0 | 0 | 111.3 | L79 V80 G84 S85 I91 G92 F126 P130 | L79-V88 HydrophobicContact CB-CG2 3.89Å; V80-V88 HydrophobicContact CG2-CB 4.12Å; V80-V88 HydrophobicContact CG2-CG1 4.14Å; V80-V88 HydrophobicContact CG2-CG2 4.06Å; G84-V88 WeakPolarHBondContact O-CG2 3.37Å; G84-V88 PolarHBondContact O-N 2.87Å; S85-V88 PolarHBondContact O-N 3.1Å; V88-I91 PolarHBondContact O-N 2.86Å; V88-G92 PolarHBondContact O-N 3.16Å; V88-F126 HydrophobicContact CG1-CB 3.89Å; V88-F126 HydrophobicContact CG1-CD1 4.43Å; V88-F126 HydrophobicContact CG1-CG 4.06Å; V88-P130 HydrophobicContact CB-CG 4.3Å; V88-P130 HydrophobicContact CG1-CG 3.88Å |
| 89 | M | 95.8 | Very high | 92.7 | Very high | 0 Ų | 0 | 47.7 Ų | 47.7 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -67 | -41.1 | 177.7 | -68.8 | -175.4 | 63.9 | 0 | 0 | 113.1 | S29 S85 I87 I91 G92 G93 F126 N127 P130 A131 M195 | S29-M89 WeakPolarHBondContact OG-CE 3.49Å; S85-M89 WeakPolarHBondContact O-CG 3.49Å; S85-M89 PolarHBondContact O-N 3.38Å; S85-M89 VanDerWaalsContact O-N 3.08Å; I87-M89 VanDerWaalsContact C-N 3.34Å; I87-M89 PolarHBondContact O-N 3.33Å; M89-I91 VanDerWaalsContact C-N 3.34Å; M89-I91 PolarHBondContact O-N 2.81Å; M89-G92 PolarHBondContact O-N 3.19Å; M89-G93 PolarHBondContact O-N 3.15Å; M89-F126 WeakPolarHBondContact CA-O 3.48Å; M89-F126 WeakPolarHBondContact CG-O 3.44Å; M89-N127 PolarHBondContact O-OD1 3.03Å; M89-P130 HydrophobicContact CG-CB 3.65Å; M89-P130 HydrophobicContact CG-CG 3.83Å; M89-P130 HydrophobicContact SD-CB 3.91Å; M89-A131 HydrophobicContact CE-CB 4.16Å; M89-A131 HydrophobicContact SD-CB 4.39Å; M89-M195 HydrophobicContact CE-CE 4.1Å; M89-M195 HydrophobicContact CE-CG 4.27Å; M89-M195 HydrophobicContact SD-CE 4.28Å; M89-M195 HydrophobicContact SD-CG 3.58Å; M89-M195 VanDerWaalsContact SD-CG 3.58Å; M89-M195 HydrophobicContact SD-SD 4.32Å |
| 90 | I | 96.6 | Very high | 93.1 | Very high | 59 Ų | 59 | 45.4 Ų | 45.4 | 30% | 0.303 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -61.3 | -44.7 | 175.6 | -68 | 167.7 | 0 | 0 | 0 | 110.5 | R86 I87 G92 G93 C94 C189 | R86-I90 HydrophobicContact CG-CD1 4.15Å; R86-I90 WeakPolarHBondContact O-CG1 3.26Å; R86-I90 PolarHBondContact O-N 2.94Å; I87-I90 PolarHBondContact O-N 3.46Å; I90-G92 VanDerWaalsContact C-N 3.32Å; I90-G92 PolarHBondContact O-N 3.49Å; I90-G93 PolarHBondContact O-N 3.35Å; I90-C94 PolarHBondContact O-N 2.65Å; I90-C94 PolarHBondContact O-SG 3.44Å; I90-C189 HydrophobicContact CG2-CB 4.42Å; I90-C189 PolarHBondContact O-SG 3.27Å |
| 91 | I | 96.6 | Very high | 93.7 | Very high | 87 Ų | 87 | 47.5 Ų | 47.5 | 45% | 0.446 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -62.2 | -42.4 | 175.5 | -67.3 | 170.7 | 0 | 0 | 0 | 110.6 | I87 V88 M89 C94 L95 | I87-I91 HydrophobicContact CG2-CD1 3.78Å; I87-I91 HydrophobicContact CG2-CG1 4.39Å; I87-I91 WeakPolarHBondContact O-CG1 3.27Å; I87-I91 PolarHBondContact O-N 2.89Å; V88-I91 PolarHBondContact O-N 2.86Å; M89-I91 VanDerWaalsContact C-N 3.34Å; M89-I91 PolarHBondContact O-N 2.81Å; I91-C94 PolarHBondContact O-N 3.48Å; I91-L95 VanDerWaalsContact O-CB 3.23Å; I91-L95 WeakPolarHBondContact O-CB 3.27Å; I91-L95 PolarHBondContact O-N 3.49Å |
| 92 | G | 96.3 | Very high | 94.5 | Very high | 0 Ų | 0 | 45.3 Ų | 45.3 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -62 | -41.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | V88 M89 I90 L95 S96 G123 | V88-G92 PolarHBondContact O-N 3.16Å; M89-G92 PolarHBondContact O-N 3.19Å; I90-G92 VanDerWaalsContact C-N 3.32Å; I90-G92 PolarHBondContact O-N 3.49Å; G92-L95 PolarHBondContact O-N 2.86Å; G92-S96 WeakPolarHBondContact O-CB 3.44Å; G92-S96 PolarHBondContact O-N 3.42Å; G92-S96 PolarHBondContact O-OG 3.03Å; G92-G123 CarbonylContact C-O 3.6Å; G92-G123 WeakPolarHBondContact CA-O 3.43Å; G92-G123 CarbonylContact O-C 3.54Å; G92-G123 VanDerWaalsContact O-CA 3.24Å; G92-G123 WeakPolarHBondContact O-CA 3.5Å |
| 93 | G | 96.3 | Very high | 95 | Very high | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -64 | -46.9 | 175 | 0 | 0 | 0 | 0 | 0 | 112 | M89 I90 L95 S96 G97 N127 C189 | M89-G93 PolarHBondContact O-N 3.15Å; I90-G93 PolarHBondContact O-N 3.35Å; G93-L95 VanDerWaalsContact C-N 3.34Å; G93-L95 PolarHBondContact O-N 3.18Å; G93-S96 PolarHBondContact O-N 2.84Å; G93-S96 PolarHBondContact O-OG 3.13Å; G93-S96 VanDerWaalsContact O-OG 3.13Å; G93-G97 PolarHBondContact O-N 3.33Å; G93-N127 PolarHBondContact N-ND2 3.22Å; G93-N127 VanDerWaalsContact N-ND2 3.11Å; G93-C189 VanDerWaalsContact CA-SG 3.58Å |
| 94 | C | 97.3 | Very high | 95.4 | Very high | 54 Ų | 54 | 32.7 Ų | 32.7 | 37% | 0.365 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -60 | -44.1 | 174.6 | -70.7 | 0 | 0 | 0 | 0 | 111.8 | I90 I91 C98 C189 | I90-C94 PolarHBondContact O-N 2.65Å; I90-C94 PolarHBondContact O-SG 3.44Å; I91-C94 PolarHBondContact O-N 3.48Å; C94-C98 VanDerWaalsContact O-CB 3.26Å; C94-C98 WeakPolarHBondContact O-CB 3.29Å; C94-C98 PolarHBondContact O-N 3.35Å; C94-C98 PolarHBondContact O-SG 3.24Å; C94-C189 PolarHBondContact N-SG 3.45Å |
| 95 | L | 96.9 | Very high | 95.8 | Very high | 55 Ų | 55 | 38.2 Ų | 38.2 | 29% | 0.288 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -63.5 | -47.4 | -178.6 | -170.9 | 66.5 | 0 | 0 | 0 | 111.6 | I91 G92 G93 G99 V119 L122 | I91-L95 VanDerWaalsContact O-CB 3.23Å; I91-L95 WeakPolarHBondContact O-CB 3.27Å; I91-L95 PolarHBondContact O-N 3.49Å; G92-L95 PolarHBondContact O-N 2.86Å; G93-L95 VanDerWaalsContact C-N 3.34Å; G93-L95 PolarHBondContact O-N 3.18Å; L95-G99 PolarHBondContact O-N 3.43Å; L95-V119 HydrophobicContact CD1-CG1 3.73Å; L95-V119 HydrophobicContact CG-CG1 3.84Å; L95-V119 WeakPolarHBondContact O-CG1 3.36Å; L95-L122 HydrophobicContact CD2-CB 4.09Å; L95-L122 HydrophobicContact CD2-CD2 3.98Å; L95-L122 HydrophobicContact CD2-CG 4.01Å |
| 96 | S | 96.3 | Very high | 96.1 | Very high | 0 Ų | 0 | 38.2 Ų | 38.2 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -68.6 | -40.2 | 178.9 | 55.3 | 0 | 0 | 0 | 0 | 112.8 | G92 G93 G99 L100 | G92-S96 WeakPolarHBondContact O-CB 3.44Å; G92-S96 PolarHBondContact O-N 3.42Å; G92-S96 PolarHBondContact O-OG 3.03Å; G93-S96 PolarHBondContact O-N 2.84Å; G93-S96 PolarHBondContact O-OG 3.13Å; G93-S96 VanDerWaalsContact O-OG 3.13Å; S96-G99 PolarHBondContact O-N 3.33Å; S96-L100 PolarHBondContact O-N 3.49Å; S96-L100 VanDerWaalsContact O-N 3.17Å |
| 97 | G | 96.6 | Very high | 96 | Very high | 0 Ų | 0 | 37.5 Ų | 37.5 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -61.4 | -50.1 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | G93 G99 L100 I101 G182 | G93-G97 PolarHBondContact O-N 3.33Å; G97-G99 VanDerWaalsContact C-N 3.31Å; G97-G99 PolarHBondContact O-N 3.12Å; G97-L100 PolarHBondContact O-N 2.97Å; G97-I101 VanDerWaalsContact O-CG1 3.27Å; G97-I101 WeakPolarHBondContact O-CG1 3.25Å; G97-I101 PolarHBondContact O-N 3.44Å; G97-G182 WeakPolarHBondContact CA-O 3.46Å |
| 98 | C | 96.7 | Very high | 96 | Very high | 77 Ų | 77 | 36.2 Ų | 36.2 | 52% | 0.52 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -62.2 | -37.6 | 176.5 | -70.7 | 0 | 0 | 0 | 0 | 112.4 | C94 L100 I101 A102 | C94-C98 VanDerWaalsContact O-CB 3.26Å; C94-C98 WeakPolarHBondContact O-CB 3.29Å; C94-C98 PolarHBondContact O-N 3.35Å; C94-C98 PolarHBondContact O-SG 3.24Å; C98-L100 VanDerWaalsContact C-N 3.34Å; C98-L100 PolarHBondContact O-N 3.1Å; C98-I101 PolarHBondContact O-N 3.15Å; C98-A102 VanDerWaalsContact O-CB 3.3Å; C98-A102 WeakPolarHBondContact O-CB 3.49Å; C98-A102 PolarHBondContact O-N 2.89Å |
| 99 | G | 96.7 | Very high | 95.9 | Very high | 3 Ų | 3 | 37.1 Ų | 37.1 | 3% | 0.031 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -58.6 | -44.4 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | L95 S96 G97 A103 C115 | L95-G99 PolarHBondContact O-N 3.43Å; S96-G99 PolarHBondContact O-N 3.33Å; G97-G99 VanDerWaalsContact C-N 3.31Å; G97-G99 PolarHBondContact O-N 3.12Å; G99-A103 WeakPolarHBondContact O-CB 3.42Å; G99-A103 PolarHBondContact O-N 3.19Å; G99-C115 WeakPolarHBondContact O-CB 3.4Å |
| 100 | L | 96 | Very high | 95.8 | Very high | 1 Ų | 1 | 44.5 Ų | 44.5 | 1% | 0.005 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -71.4 | -40.4 | 176.8 | -95.8 | 60.6 | 0 | 0 | 0 | 113.6 | F36 S96 G97 C98 A102 A103 S104 L181 L185 | F36-L100 HydrophobicContact CE1-CD1 3.99Å; F36-L100 HydrophobicContact CE1-CD2 3.85Å; F36-L100 HydrophobicContact CE1-CG 4.31Å; F36-L100 HydrophobicContact CE2-CD2 3.82Å; F36-L100 HydrophobicContact CZ-CD1 4.23Å; F36-L100 HydrophobicContact CZ-CD2 3.22Å; F36-L100 HydrophobicContact CZ-CG 4.05Å; S96-L100 PolarHBondContact O-N 3.49Å; S96-L100 VanDerWaalsContact O-N 3.17Å; G97-L100 PolarHBondContact O-N 2.97Å; C98-L100 VanDerWaalsContact C-N 3.34Å; C98-L100 PolarHBondContact O-N 3.1Å; L100-A102 VanDerWaalsContact C-N 3.3Å; L100-A102 PolarHBondContact O-N 3.09Å; L100-A103 WeakPolarHBondContact O-CB 3.27Å; L100-A103 PolarHBondContact O-N 2.98Å; L100-A103 VanDerWaalsContact O-N 3.15Å; L100-S104 PolarHBondContact O-N 3.17Å; L100-S104 VanDerWaalsContact O-N 3.16Å; L100-L181 HydrophobicContact CD2-CB 3.78Å; L100-L185 HydrophobicContact CD1-CD1 3.83Å; L100-L185 HydrophobicContact CD2-CD1 3.36Å; L100-L185 HydrophobicContact CD2-CG 4.05Å; L100-L185 HydrophobicContact CG-CD1 4.17Å |
| 101 | I | 97 | Very high | 95.8 | Very high | 52 Ų | 52 | 45.4 Ų | 45.4 | 27% | 0.267 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -60.8 | -45.4 | 175.7 | -66.5 | 166.9 | 0 | 0 | 0 | 109.3 | G97 C98 A103 S104 F105 L179 L186 | G97-I101 VanDerWaalsContact O-CG1 3.27Å; G97-I101 WeakPolarHBondContact O-CG1 3.25Å; G97-I101 PolarHBondContact O-N 3.44Å; C98-I101 PolarHBondContact O-N 3.15Å; I101-A103 VanDerWaalsContact C-N 3.32Å; I101-A103 PolarHBondContact O-N 2.9Å; I101-S104 WeakPolarHBondContact O-CB 3.47Å; I101-S104 PolarHBondContact O-N 3.02Å; I101-S104 PolarHBondContact O-OG 3.45Å; I101-F105 HydrophobicContact CG2-CE2 4.3Å; I101-F105 VanDerWaalsContact O-CD2 3.25Å; I101-F105 WeakPolarHBondContact O-CD2 3.25Å; I101-L179 HydrophobicContact CB-CD1 4.38Å; I101-L179 HydrophobicContact CG1-CD1 4.16Å; I101-L179 HydrophobicContact CG2-CD1 3.82Å; I101-L186 HydrophobicContact CD1-CD1 4.42Å |
| 102 | A | 96.6 | Very high | 95.7 | Very high | 42 Ų | 42 | 41.3 Ų | 41.3 | 35% | 0.347 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -60.3 | -41.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | C98 L100 S104 F105 C106 | C98-A102 VanDerWaalsContact O-CB 3.3Å; C98-A102 WeakPolarHBondContact O-CB 3.49Å; C98-A102 PolarHBondContact O-N 2.89Å; L100-A102 VanDerWaalsContact C-N 3.3Å; L100-A102 PolarHBondContact O-N 3.09Å; A102-S104 PolarHBondContact O-N 3.32Å; A102-S104 VanDerWaalsContact O-N 3.16Å; A102-F105 PolarHBondContact O-N 3.33Å; A102-C106 PolarHBondContact O-SG 2.88Å |
| 103 | A | 96.1 | Very high | 95.7 | Very high | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -58.5 | -28 | 177.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | G99 L100 I101 F105 C106 L112 C115 I116 F178 | G99-A103 WeakPolarHBondContact O-CB 3.42Å; G99-A103 PolarHBondContact O-N 3.19Å; L100-A103 WeakPolarHBondContact O-CB 3.27Å; L100-A103 PolarHBondContact O-N 2.98Å; L100-A103 VanDerWaalsContact O-N 3.15Å; I101-A103 VanDerWaalsContact C-N 3.32Å; I101-A103 PolarHBondContact O-N 2.9Å; A103-F105 PolarHBondContact O-N 2.71Å; A103-C106 PolarHBondContact O-N 3.36Å; A103-L112 HydrophobicContact CB-CD2 3.98Å; A103-C115 HydrophobicContact CB-CB 3.97Å; A103-I116 HydrophobicContact CB-CD1 3.86Å; A103-I116 HydrophobicContact CB-CG1 3.5Å; A103-F178 HydrophobicContact CB-CD2 4.21Å |
| 104 | S | 96.2 | Very high | 95.8 | Very high | 6 Ų | 6 | 49.3 Ų | 49.3 | 4% | 0.042 | 26% | 0.259 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -65.5 | -21.9 | 176.6 | 75 | 0 | 0 | 0 | 0 | 113.7 | L100 I101 A102 R175 | L100-S104 PolarHBondContact O-N 3.17Å; L100-S104 VanDerWaalsContact O-N 3.16Å; I101-S104 WeakPolarHBondContact O-CB 3.47Å; I101-S104 PolarHBondContact O-N 3.02Å; I101-S104 PolarHBondContact O-OG 3.45Å; A102-S104 PolarHBondContact O-N 3.32Å; A102-S104 VanDerWaalsContact O-N 3.16Å; S104-R175 VanDerWaalsContact CB-O 3.28Å; S104-R175 WeakPolarHBondContact CB-O 3.03Å; S104-R175 VanDerWaalsContact O-CD 3.26Å; S104-R175 WeakPolarHBondContact O-CD 3.35Å; S104-R175 VanDerWaalsContact O-CG 3.25Å; S104-R175 WeakPolarHBondContact O-CG 3.49Å; S104-R175 PolarHBondContact O-NE 2.94Å; S104-R175 VanDerWaalsContact O-NE 3.13Å |
| 105 | F | 95.6 | Very high | 95.8 | Very high | 145 Ų | 145 | 47.6 Ų | 47.6 | 64% | 0.636 | 25% | 0.247 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -100.4 | -4.8 | 179.5 | -59.4 | -76.1 | 0 | 0 | 0 | 113.5 | I101 A102 A103 | I101-F105 HydrophobicContact CG2-CE2 4.3Å; I101-F105 VanDerWaalsContact O-CD2 3.25Å; I101-F105 WeakPolarHBondContact O-CD2 3.25Å; A102-F105 PolarHBondContact O-N 3.33Å; A103-F105 PolarHBondContact O-N 2.71Å |
| 106 | C | 94.4 | Very high | 95.7 | Very high | 9 Ų | 9 | 45 Ų | 45 | 6% | 0.061 | 23% | 0.234 | C | C | . | . | trans | -67.1 | 148.2 | -179 | -67.1 | 0 | 0 | 0 | 0 | 112.1 | A102 A103 E111 L112 W174 R175 | A102-C106 PolarHBondContact O-SG 2.88Å; A103-C106 PolarHBondContact O-N 3.36Å; C106-E111 WeakPolarHBondContact CA-OE2 3.38Å; C106-E111 HydrophobicContact CB-CB 3.82Å; C106-E111 WeakPolarHBondContact CB-OE2 3.37Å; C106-L112 HydrophobicContact CB-CD2 3.81Å; C106-L112 HydrophobicContact CB-CG 4.28Å; C106-W174 WeakPolarHBondContact O-CH2 3.22Å; C106-R175 PolarHBondContact O-NH2 3.25Å | ||
| 107 | N | 93.3 | Very high | 95.7 | Very high | 110 Ų | 110 | 45 Ų | 45 | 59% | 0.588 | 23% | 0.234 | S | C | * | . | trans | -122.9 | 0.5 | -180 | -63.8 | -56.8 | 0 | 0 | 0 | 113 | F51 E111 R175 | F51-N107 VanDerWaalsContact CE1-C 3.5Å; F51-N107 VanDerWaalsContact CE1-O 3.27Å; F51-N107 WeakPolarHBondContact CE1-O 3.42Å; N107-E111 PolarHBondContact N-OE2 2.81Å; N107-R175 PolarHBondContact OD1-NH2 3.02Å | ||
| 108 | T | 93.3 | Very high | 95.7 | Very high | 58 Ų | 58 | 49.6 Ų | 49.6 | 36% | 0.356 | 25% | 0.254 | S | S | . | . | S | Bend | trans | -135 | 153.4 | 175.7 | 67.3 | 0 | 0 | 0 | 0 | 111.6 | Q110 E111 L112 | T108-Q110 PolarHBondContact O-N 3.19Å; T108-E111 PolarHBondContact N-OE2 3.5Å; T108-E111 PolarHBondContact O-N 3.23Å; T108-E111 WeakPolarHBondContact OG1-CG 3.41Å; T108-E111 PolarHBondContact OG1-N 3.38Å; T108-E111 PolarHBondContact OG1-OE1 2.91Å; T108-L112 PolarHBondContact O-N 3.39Å |
| 109 | V | 92.6 | Very high | 95.8 | Very high | 22 Ų | 22 | 47.1 Ų | 47.1 | 13% | 0.133 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -64.9 | -31.9 | 178.2 | -171.8 | 0 | 0 | 0 | 0 | 111.4 | F51 A53 E111 L112 Y113 | F51-V109 HydrophobicContact CB-CG2 3.56Å; F51-V109 HydrophobicContact CD1-CG2 4.29Å; F51-V109 HydrophobicContact CD2-CG2 4.32Å; F51-V109 HydrophobicContact CG-CG2 3.8Å; A53-V109 HydrophobicContact CB-CG2 4.09Å; V109-E111 PolarHBondContact O-N 3.34Å; V109-L112 WeakPolarHBondContact O-CB 3.4Å; V109-L112 PolarHBondContact O-N 3.47Å; V109-L112 VanDerWaalsContact O-N 3.14Å; V109-Y113 HydrophobicContact CG1-CD1 4.33Å; V109-Y113 HydrophobicContact CG1-CE1 3.53Å; V109-Y113 HydrophobicContact CG1-CE2 4.37Å; V109-Y113 WeakPolarHBondContact CG1-OH 3.22Å; V109-Y113 WeakPolarHBondContact O-CD1 3.3Å; V109-Y113 PolarHBondContact O-N 3.31Å |
| 110 | Q | 94.2 | Very high | 95.8 | Very high | 154 Ų | 154 | 47 Ų | 47 | 72% | 0.72 | 24% | 0.236 | S | C | * | . | H | α-helix | trans | -65.1 | -39.5 | 177.7 | -64 | 178.7 | -5.5 | 0 | 0 | 112.3 | T108 L112 Y113 F114 | T108-Q110 PolarHBondContact O-N 3.19Å; Q110-L112 VanDerWaalsContact C-N 3.3Å; Q110-L112 PolarHBondContact O-N 3.47Å; Q110-Y113 WeakPolarHBondContact O-CB 3.41Å; Q110-Y113 PolarHBondContact O-N 3.18Å; Q110-F114 PolarHBondContact O-N 3.24Å |
| 111 | E | 96.1 | Very high | 95.8 | Very high | 79 Ų | 79 | 47 Ų | 47 | 37% | 0.369 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -63 | -38.6 | 172.4 | -70.8 | 162.4 | -163.7 | 0 | 0 | 111.2 | C106 N107 T108 V109 Y113 F114 C115 | C106-E111 WeakPolarHBondContact CA-OE2 3.38Å; C106-E111 HydrophobicContact CB-CB 3.82Å; C106-E111 WeakPolarHBondContact CB-OE2 3.37Å; N107-E111 PolarHBondContact N-OE2 2.81Å; T108-E111 PolarHBondContact N-OE2 3.5Å; T108-E111 PolarHBondContact O-N 3.23Å; T108-E111 WeakPolarHBondContact OG1-CG 3.41Å; T108-E111 PolarHBondContact OG1-N 3.38Å; T108-E111 PolarHBondContact OG1-OE1 2.91Å; V109-E111 PolarHBondContact O-N 3.34Å; E111-Y113 VanDerWaalsContact C-N 3.35Å; E111-Y113 PolarHBondContact O-N 2.89Å; E111-F114 PolarHBondContact O-N 2.95Å; E111-C115 WeakPolarHBondContact O-CB 3.35Å; E111-C115 PolarHBondContact O-N 3.32Å |
| 112 | L | 95.6 | Very high | 95.8 | Very high | 0 Ų | 0 | 46.2 Ų | 46.2 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -64.1 | -37 | 175.1 | -64 | 177.7 | 0 | 0 | 0 | 112.4 | I47 F51 I61 A103 C106 T108 V109 Q110 F114 I116 G117 W174 F178 | I47-L112 HydrophobicContact CG2-CD1 4.48Å; F51-L112 HydrophobicContact CE2-CD1 3.98Å; F51-L112 HydrophobicContact CZ-CD1 4.35Å; I61-L112 HydrophobicContact CD1-CB 4.16Å; I61-L112 HydrophobicContact CD1-CD1 4.31Å; A103-L112 HydrophobicContact CB-CD2 3.98Å; C106-L112 HydrophobicContact CB-CD2 3.81Å; C106-L112 HydrophobicContact CB-CG 4.28Å; T108-L112 PolarHBondContact O-N 3.39Å; V109-L112 WeakPolarHBondContact O-CB 3.4Å; V109-L112 PolarHBondContact O-N 3.47Å; V109-L112 VanDerWaalsContact O-N 3.14Å; Q110-L112 VanDerWaalsContact C-N 3.3Å; Q110-L112 PolarHBondContact O-N 3.47Å; L112-F114 VanDerWaalsContact C-N 3.27Å; L112-F114 PolarHBondContact O-N 3.35Å; L112-I116 HydrophobicContact CB-CD1 4.46Å; L112-I116 HydrophobicContact CD2-CD1 3.93Å; L112-I116 WeakPolarHBondContact O-CB 3.43Å; L112-I116 PolarHBondContact O-N 2.92Å; L112-G117 PolarHBondContact O-N 3Å; L112-W174 HydrophobicContact CD2-CZ3 4.3Å; L112-F178 HydrophobicContact CD2-CE2 4.4Å |
| 113 | Y | 96.7 | Very high | 95.8 | Very high | 47 Ų | 47 | 44.2 Ų | 44.2 | 18% | 0.184 | 22% | 0.215 | C | C | . | . | I | π-helix | trans | -58.4 | -41 | 172.7 | -60.8 | -24.9 | 0 | 0 | 0 | 111.9 | E57 W60 I61 I64 V109 Q110 E111 G117 F118 | E57-Y113 WeakPolarHBondContact CA-OH 3.4Å; E57-Y113 VanDerWaalsContact O-CE1 3.29Å; E57-Y113 WeakPolarHBondContact O-CE1 3.02Å; E57-Y113 PolarHBondContact O-OH 3.36Å; W60-Y113 HydrophobicContact CB-CD1 4.11Å; W60-Y113 HydrophobicContact CB-CE1 3.57Å; I61-Y113 HydrophobicContact CB-CD1 4.5Å; I61-Y113 HydrophobicContact CG1-CD1 3.62Å; I61-Y113 HydrophobicContact CG1-CE1 3.7Å; I64-Y113 HydrophobicContact CD1-CD1 4.18Å; I64-Y113 HydrophobicContact CD1-CD2 4.49Å; I64-Y113 HydrophobicContact CD1-CG 3.94Å; V109-Y113 HydrophobicContact CG1-CD1 4.33Å; V109-Y113 HydrophobicContact CG1-CE1 3.53Å; V109-Y113 HydrophobicContact CG1-CE2 4.37Å; V109-Y113 WeakPolarHBondContact CG1-OH 3.22Å; V109-Y113 WeakPolarHBondContact O-CD1 3.3Å; V109-Y113 PolarHBondContact O-N 3.31Å; Q110-Y113 WeakPolarHBondContact O-CB 3.41Å; Q110-Y113 PolarHBondContact O-N 3.18Å; E111-Y113 VanDerWaalsContact C-N 3.35Å; E111-Y113 PolarHBondContact O-N 2.89Å; Y113-G117 CarbonylContact O-C 3.53Å; Y113-G117 WeakPolarHBondContact O-CA 3.35Å; Y113-G117 PolarHBondContact O-N 3.39Å; Y113-G117 VanDerWaalsContact O-N 3.12Å; Y113-F118 PolarHBondContact O-N 3.25Å |
| 114 | F | 97.4 | Very high | 95.8 | Very high | 122 Ų | 122 | 44.2 Ų | 44.2 | 54% | 0.535 | 22% | 0.215 | S | C | . | . | I | π-helix | trans | -73.6 | -52.4 | 179.8 | -177.7 | -104.4 | 0 | 0 | 0 | 111.9 | Q110 E111 L112 F118 V119 | Q110-F114 PolarHBondContact O-N 3.24Å; E111-F114 PolarHBondContact O-N 2.95Å; L112-F114 VanDerWaalsContact C-N 3.27Å; L112-F114 PolarHBondContact O-N 3.35Å; F114-F118 HydrophobicContact CD2-CB 4.37Å; F114-F118 HydrophobicContact CD2-CD1 4.27Å; F114-F118 AromaticContact CE2-CD1 3.89Å; F114-F118 HydrophobicContact CE2-CD1 3.89Å; F114-F118 HydrophobicContact CE2-CE1 4.47Å; F114-F118 WeakPolarHBondContact O-CB 3.25Å; F114-F118 PolarHBondContact O-N 3.48Å; F114-V119 HydrophobicContact CD1-CG2 4.27Å; F114-V119 HydrophobicContact CE1-CG2 3.88Å; F114-V119 HydrophobicContact CE2-CG2 4.48Å; F114-V119 HydrophobicContact CZ-CG2 3.99Å; F114-V119 WeakPolarHBondContact O-CG2 3.41Å; F114-V119 PolarHBondContact O-N 3.49Å |
| 115 | C | 97.3 | Very high | 95.7 | Very high | 17 Ų | 17 | 44 Ų | 44 | 12% | 0.115 | 21% | 0.213 | C | C | . | . | I | π-helix | trans | -69.6 | -50 | -174.3 | -72.6 | 0 | 0 | 0 | 0 | 113 | G99 A103 E111 V119 G120 | G99-C115 WeakPolarHBondContact O-CB 3.4Å; A103-C115 HydrophobicContact CB-CB 3.97Å; E111-C115 WeakPolarHBondContact O-CB 3.35Å; E111-C115 PolarHBondContact O-N 3.32Å; C115-V119 WeakPolarHBondContact O-CB 3.24Å; C115-G120 PolarHBondContact O-N 2.91Å; C115-G120 VanDerWaalsContact O-N 3.14Å |
| 116 | I | 95.9 | Very high | 95.7 | Very high | 1 Ų | 1 | 37.9 Ų | 37.9 | 1% | 0.005 | 19% | 0.187 | C | C | . | . | I | π-helix | trans | -84.7 | -48.8 | -178.6 | -58.5 | 176.7 | 0 | 0 | 0 | 110 | I40 I61 M65 A103 L112 G120 F178 | I40-I116 HydrophobicContact CD1-CD1 4Å; I40-I116 HydrophobicContact CD1-CG2 3.76Å; I61-I116 HydrophobicContact CG2-CB 3.93Å; I61-I116 HydrophobicContact CG2-CD1 4.34Å; I61-I116 HydrophobicContact CG2-CG2 3.66Å; M65-I116 HydrophobicContact CE-CG2 4.02Å; M65-I116 HydrophobicContact SD-CG2 4.24Å; A103-I116 HydrophobicContact CB-CD1 3.86Å; A103-I116 HydrophobicContact CB-CG1 3.5Å; L112-I116 HydrophobicContact CB-CD1 4.46Å; L112-I116 HydrophobicContact CD2-CD1 3.93Å; L112-I116 WeakPolarHBondContact O-CB 3.43Å; L112-I116 PolarHBondContact O-N 2.92Å; I116-G120 VanDerWaalsContact O-CA 3.31Å; I116-G120 WeakPolarHBondContact O-CA 3.16Å; I116-G120 PolarHBondContact O-N 3.44Å; I116-F178 HydrophobicContact CD1-CD2 4.28Å; I116-F178 HydrophobicContact CD1-CE2 3.72Å; I116-F178 HydrophobicContact CD1-CZ 3.95Å |
| 117 | G | 95.9 | Very high | 95.8 | Very high | 0 Ų | 0 | 37.5 Ų | 37.5 | 0% | 0 | 18% | 0.184 | C | C | . | . | I | π-helix | trans | -66.7 | -68.6 | -176.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | M65 L112 Y113 G121 | M65-G117 WeakPolarHBondContact CA-O 3.21Å; L112-G117 PolarHBondContact O-N 3Å; Y113-G117 CarbonylContact O-C 3.53Å; Y113-G117 WeakPolarHBondContact O-CA 3.35Å; Y113-G117 PolarHBondContact O-N 3.39Å; Y113-G117 VanDerWaalsContact O-N 3.12Å; G117-G121 WeakPolarHBondContact O-CA 3.19Å; G117-G121 PolarHBondContact O-N 3.25Å |
| 118 | F | 97.1 | Very high | 95.7 | Very high | 97 Ų | 97 | 32.7 Ų | 32.7 | 43% | 0.425 | 16% | 0.158 | S | C | . | . | I | π-helix | trans | -74.9 | -56.4 | -172.3 | -176.7 | -99 | 0 | 0 | 0 | 113.3 | V68 Y113 F114 L122 | V68-F118 HydrophobicContact CG1-CD2 4.27Å; V68-F118 HydrophobicContact CG2-CD2 3.9Å; Y113-F118 PolarHBondContact O-N 3.25Å; F114-F118 HydrophobicContact CD2-CB 4.37Å; F114-F118 HydrophobicContact CD2-CD1 4.27Å; F114-F118 AromaticContact CE2-CD1 3.89Å; F114-F118 HydrophobicContact CE2-CD1 3.89Å; F114-F118 HydrophobicContact CE2-CE1 4.47Å; F114-F118 WeakPolarHBondContact O-CB 3.25Å; F114-F118 PolarHBondContact O-N 3.48Å; F118-L122 WeakPolarHBondContact O-CB 3.48Å; F118-L122 PolarHBondContact O-N 3.24Å |
| 119 | V | 97.6 | Very high | 95.5 | Very high | 25 Ų | 25 | 31.8 Ų | 31.8 | 15% | 0.152 | 15% | 0.151 | C | C | . | . | I | π-helix | trans | -67 | -47.4 | -176.6 | 176 | 0 | 0 | 0 | 0 | 110.6 | L95 F114 C115 G123 | L95-V119 HydrophobicContact CD1-CG1 3.73Å; L95-V119 HydrophobicContact CG-CG1 3.84Å; L95-V119 WeakPolarHBondContact O-CG1 3.36Å; F114-V119 HydrophobicContact CD1-CG2 4.27Å; F114-V119 HydrophobicContact CE1-CG2 3.88Å; F114-V119 HydrophobicContact CE2-CG2 4.48Å; F114-V119 HydrophobicContact CZ-CG2 3.99Å; F114-V119 WeakPolarHBondContact O-CG2 3.41Å; F114-V119 PolarHBondContact O-N 3.49Å; C115-V119 WeakPolarHBondContact O-CB 3.24Å; V119-G123 PolarHBondContact O-N 2.86Å |
| 120 | G | 96.5 | Very high | 95.4 | Very high | 1 Ų | 1 | 30.7 Ų | 30.7 | 1% | 0.01 | 15% | 0.145 | C | C | . | . | I | π-helix | trans | -58.3 | -52.3 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | C115 I116 L122 G123 L124 | C115-G120 PolarHBondContact O-N 2.91Å; C115-G120 VanDerWaalsContact O-N 3.14Å; I116-G120 VanDerWaalsContact O-CA 3.31Å; I116-G120 WeakPolarHBondContact O-CA 3.16Å; I116-G120 PolarHBondContact O-N 3.44Å; G120-L122 VanDerWaalsContact C-N 3.35Å; G120-L122 PolarHBondContact O-N 3.37Å; G120-G123 PolarHBondContact O-N 3.26Å; G120-G123 VanDerWaalsContact O-N 3.13Å; G120-L124 WeakPolarHBondContact O-CG 2.98Å; G120-L124 PolarHBondContact O-N 2.9Å |
| 121 | G | 96.6 | Very high | 95.3 | Very high | 0 Ų | 0 | 23.4 Ų | 23.4 | 0% | 0 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -57.4 | -42.6 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | G117 L124 A125 | G117-G121 WeakPolarHBondContact O-CA 3.19Å; G117-G121 PolarHBondContact O-N 3.25Å; G121-L124 PolarHBondContact O-N 3.02Å; G121-A125 PolarHBondContact O-N 3.39Å |
| 122 | L | 96.7 | Very high | 94.8 | Very high | 36 Ų | 36 | 22.2 Ų | 22.2 | 19% | 0.188 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -66.2 | -40.6 | 177.1 | -172.6 | 63.6 | 0 | 0 | 0 | 111.5 | V68 L95 F118 G120 L124 A125 F126 | V68-L122 HydrophobicContact CG1-CB 4.01Å; L95-L122 HydrophobicContact CD2-CB 4.09Å; L95-L122 HydrophobicContact CD2-CD2 3.98Å; L95-L122 HydrophobicContact CD2-CG 4.01Å; F118-L122 WeakPolarHBondContact O-CB 3.48Å; F118-L122 PolarHBondContact O-N 3.24Å; G120-L122 VanDerWaalsContact C-N 3.35Å; G120-L122 PolarHBondContact O-N 3.37Å; L122-L124 VanDerWaalsContact C-N 3.35Å; L122-L124 PolarHBondContact O-N 2.82Å; L122-A125 WeakPolarHBondContact O-CB 3.39Å; L122-A125 PolarHBondContact O-N 3.01Å; L122-F126 HydrophobicContact CD1-CD1 4.44Å; L122-F126 HydrophobicContact CD1-CE1 3.71Å; L122-F126 HydrophobicContact CD1-CE2 4.36Å; L122-F126 HydrophobicContact CD1-CZ 3.66Å; L122-F126 HydrophobicContact CD2-CE2 4.42Å; L122-F126 HydrophobicContact CD2-CZ 4.29Å; L122-F126 HydrophobicContact CG-CE1 4.26Å; L122-F126 HydrophobicContact CG-CE2 4.06Å; L122-F126 HydrophobicContact CG-CZ 3.87Å; L122-F126 WeakPolarHBondContact O-CG 3.38Å; L122-F126 PolarHBondContact O-N 3.38Å; L122-F126 VanDerWaalsContact O-N 3.08Å |
| 123 | G | 96.8 | Very high | 94.4 | Very high | 0 Ų | 0 | 24.8 Ų | 24.8 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -62.2 | -40.5 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | G92 V119 G120 F126 N127 | G92-G123 CarbonylContact C-O 3.6Å; G92-G123 WeakPolarHBondContact CA-O 3.43Å; G92-G123 CarbonylContact O-C 3.54Å; G92-G123 VanDerWaalsContact O-CA 3.24Å; G92-G123 WeakPolarHBondContact O-CA 3.5Å; V119-G123 PolarHBondContact O-N 2.86Å; G120-G123 PolarHBondContact O-N 3.26Å; G120-G123 VanDerWaalsContact O-N 3.13Å; G123-F126 PolarHBondContact O-N 3.38Å; G123-N127 PolarHBondContact O-N 3.25Å; G123-N127 PolarHBondContact O-ND2 3.37Å |
| 124 | L | 96.2 | Very high | 93.9 | Very high | 0 Ų | 0 | 22.7 Ų | 22.7 | 0% | 0 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -69.7 | -33.8 | 175.6 | -62.9 | 176.6 | 0 | 0 | 0 | 112.3 | S33 F36 P37 M65 M69 G120 G121 L122 F126 N127 L128 L185 | S33-L124 PolarHBondContact OG-O 3.3Å; F36-L124 HydrophobicContact CB-CD1 4.46Å; P37-L124 HydrophobicContact CG-CD1 4.31Å; M65-L124 HydrophobicContact CG-CD1 4.23Å; M65-L124 HydrophobicContact SD-CD1 3.84Å; M69-L124 HydrophobicContact CG-CB 4.24Å; M69-L124 HydrophobicContact SD-CB 4.06Å; G120-L124 WeakPolarHBondContact O-CG 2.98Å; G120-L124 PolarHBondContact O-N 2.9Å; G121-L124 PolarHBondContact O-N 3.02Å; L122-L124 VanDerWaalsContact C-N 3.35Å; L122-L124 PolarHBondContact O-N 2.82Å; L124-F126 VanDerWaalsContact C-N 3.34Å; L124-N127 PolarHBondContact O-N 3.36Å; L124-L128 WeakPolarHBondContact O-CB 3.23Å; L124-L128 PolarHBondContact O-N 3.27Å; L124-L185 HydrophobicContact CD2-CD2 4.19Å |
| 125 | A | 95.1 | Very high | 93.4 | Very high | 0 Ų | 0 | 16.9 Ų | 16.9 | 0% | 0 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -61.7 | -42.6 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | M69 G121 L122 N127 L128 N129 | M69-A125 WeakPolarHBondContact O-CB 3.18Å; G121-A125 PolarHBondContact O-N 3.39Å; L122-A125 WeakPolarHBondContact O-CB 3.39Å; L122-A125 PolarHBondContact O-N 3.01Å; A125-N127 PolarHBondContact O-N 2.92Å; A125-L128 PolarHBondContact O-N 3.42Å; A125-N129 PolarHBondContact O-N 3.01Å; A125-N129 PolarHBondContact O-ND2 3.45Å |
| 126 | F | 95.4 | Very high | 92.6 | Very high | 18 Ų | 18 | 17.1 Ų | 17.1 | 8% | 0.079 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -72.1 | -12.9 | 178.1 | -69.3 | -1.8 | 0 | 0 | 0 | 113.1 | I75 L79 V88 M89 L122 G123 L124 P130 | I75-F126 HydrophobicContact CG2-CE1 3.93Å; I75-F126 HydrophobicContact CG2-CZ 4.08Å; L79-F126 HydrophobicContact CD1-CE1 4.26Å; L79-F126 HydrophobicContact CD1-CZ 4.04Å; V88-F126 HydrophobicContact CG1-CB 3.89Å; V88-F126 HydrophobicContact CG1-CD1 4.43Å; V88-F126 HydrophobicContact CG1-CG 4.06Å; M89-F126 WeakPolarHBondContact CA-O 3.48Å; M89-F126 WeakPolarHBondContact CG-O 3.44Å; L122-F126 HydrophobicContact CD1-CD1 4.44Å; L122-F126 HydrophobicContact CD1-CE1 3.71Å; L122-F126 HydrophobicContact CD1-CE2 4.36Å; L122-F126 HydrophobicContact CD1-CZ 3.66Å; L122-F126 HydrophobicContact CD2-CE2 4.42Å; L122-F126 HydrophobicContact CD2-CZ 4.29Å; L122-F126 HydrophobicContact CG-CE1 4.26Å; L122-F126 HydrophobicContact CG-CE2 4.06Å; L122-F126 HydrophobicContact CG-CZ 3.87Å; L122-F126 WeakPolarHBondContact O-CG 3.38Å; L122-F126 PolarHBondContact O-N 3.38Å; L122-F126 VanDerWaalsContact O-N 3.08Å; G123-F126 PolarHBondContact O-N 3.38Å; L124-F126 VanDerWaalsContact C-N 3.34Å; F126-P130 VanDerWaalsContact O-CD 3.27Å; F126-P130 WeakPolarHBondContact O-CD 3.29Å; F126-P130 WeakPolarHBondContact O-CG 3.49Å |
| 127 | N | 94.9 | Very high | 92 | Very high | 0 Ų | 0 | 21.1 Ų | 21.1 | 0% | 0 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -90.6 | -44.3 | 169.5 | -83.2 | -69.6 | 0 | 0 | 0 | 112.5 | M89 G93 G123 L124 A125 A131 C188 | M89-N127 PolarHBondContact O-OD1 3.03Å; G93-N127 PolarHBondContact N-ND2 3.22Å; G93-N127 VanDerWaalsContact N-ND2 3.11Å; G123-N127 PolarHBondContact O-N 3.25Å; G123-N127 PolarHBondContact O-ND2 3.37Å; L124-N127 PolarHBondContact O-N 3.36Å; A125-N127 PolarHBondContact O-N 2.92Å; N127-A131 WeakPolarHBondContact O-CB 3.17Å; N127-A131 PolarHBondContact O-N 3.25Å; N127-C188 WeakPolarHBondContact OD1-CB 3.37Å |
| 128 | L | 92 | Very high | 91.5 | Very high | 9 Ų | 9 | 21.3 Ų | 21.3 | 5% | 0.047 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -65.7 | -55.4 | -173.5 | 176.4 | 58.1 | 0 | 0 | 0 | 113 | I30 Y34 M69 L124 A125 A131 L132 | I30-L128 HydrophobicContact CB-CD1 4.5Å; I30-L128 HydrophobicContact CG1-CD1 3.9Å; I30-L128 HydrophobicContact CG2-CD1 4.43Å; Y34-L128 HydrophobicContact CD2-CD1 4.3Å; Y34-L128 HydrophobicContact CE1-CD2 4.41Å; Y34-L128 HydrophobicContact CE2-CD1 3.65Å; Y34-L128 HydrophobicContact CE2-CD2 4.08Å; M69-L128 HydrophobicContact CE-CD2 4.35Å; M69-L128 HydrophobicContact CG-CD2 4.33Å; M69-L128 HydrophobicContact SD-CD2 4.2Å; L124-L128 WeakPolarHBondContact O-CB 3.23Å; L124-L128 PolarHBondContact O-N 3.27Å; A125-L128 PolarHBondContact O-N 3.42Å; L128-A131 PolarHBondContact O-N 3.05Å; L128-L132 HydrophobicContact CD1-CD1 4.2Å; L128-L132 PolarHBondContact O-N 3.28Å |
| 129 | N | 88.6 | Confident | 90.8 | Very high | 39 Ų | 39 | 16.7 Ų | 16.7 | 21% | 0.209 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -67.4 | -42.9 | -171.2 | -63.9 | -71.7 | 0 | 0 | 0 | 113.6 | G73 A125 A131 L132 T133 | G73-N129 WeakPolarHBondContact CA-ND2 3.5Å; A125-N129 PolarHBondContact O-N 3.01Å; A125-N129 PolarHBondContact O-ND2 3.45Å; N129-A131 VanDerWaalsContact C-N 3.31Å; N129-A131 PolarHBondContact O-N 3.37Å; N129-L132 PolarHBondContact O-N 3.43Å; N129-T133 PolarHBondContact O-N 3.45Å; N129-T133 PolarHBondContact O-OG1 3.29Å |
| 130 | P | 90.4 | Very high | 89.9 | Confident | 0 Ų | 0 | 19 Ų | 19 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -68.7 | -31.4 | 178.8 | -15.5 | 30.4 | 0 | 0 | 0 | 112.1 | V80 V88 M89 F126 T133 M134 | V80-P130 HydrophobicContact CG2-CB 3.67Å; V80-P130 HydrophobicContact CG2-CG 3.48Å; V80-P130 VanDerWaalsContact CG2-CG 3.48Å; V88-P130 HydrophobicContact CB-CG 4.3Å; V88-P130 HydrophobicContact CG1-CG 3.88Å; M89-P130 HydrophobicContact CG-CB 3.65Å; M89-P130 HydrophobicContact CG-CG 3.83Å; M89-P130 HydrophobicContact SD-CB 3.91Å; F126-P130 VanDerWaalsContact O-CD 3.27Å; F126-P130 WeakPolarHBondContact O-CD 3.29Å; F126-P130 WeakPolarHBondContact O-CG 3.49Å; P130-T133 WeakPolarHBondContact O-CB 3.44Å; P130-T133 PolarHBondContact O-N 2.84Å; P130-M134 WeakPolarHBondContact O-CB 3.35Å; P130-M134 VanDerWaalsContact O-CG 3.23Å; P130-M134 WeakPolarHBondContact O-CG 3.46Å; P130-M134 PolarHBondContact O-N 2.88Å |
| 131 | A | 91.8 | Very high | 88.9 | Confident | 0 Ų | 0 | 26.2 Ų | 26.2 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -59.7 | -49.2 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | A26 I30 M89 N127 L128 N129 T133 M134 I135 M195 | A26-A131 HydrophobicContact CB-CB 3.94Å; I30-A131 HydrophobicContact CG1-CB 4.43Å; M89-A131 HydrophobicContact CE-CB 4.16Å; M89-A131 HydrophobicContact SD-CB 4.39Å; N127-A131 WeakPolarHBondContact O-CB 3.17Å; N127-A131 PolarHBondContact O-N 3.25Å; L128-A131 PolarHBondContact O-N 3.05Å; N129-A131 VanDerWaalsContact C-N 3.31Å; N129-A131 PolarHBondContact O-N 3.37Å; A131-T133 VanDerWaalsContact C-N 3.32Å; A131-T133 PolarHBondContact O-N 3.26Å; A131-M134 PolarHBondContact O-N 3.48Å; A131-I135 WeakPolarHBondContact O-CG1 3.42Å; A131-I135 PolarHBondContact O-N 3.38Å; A131-M195 HydrophobicContact CB-CE 4.48Å |
| 132 | L | 87.1 | Confident | 88.1 | Confident | 55 Ų | 55 | 32.8 Ų | 32.8 | 29% | 0.288 | 15% | 0.154 | S | C | . | . | H | α-helix | trans | -61.3 | -40 | 175.5 | -68.4 | 173.5 | 0 | 0 | 0 | 112.4 | I30 L128 N129 M134 G136 | I30-L132 HydrophobicContact CD1-CD2 3.84Å; I30-L132 HydrophobicContact CD1-CG 4.38Å; L128-L132 HydrophobicContact CD1-CD1 4.2Å; L128-L132 PolarHBondContact O-N 3.28Å; N129-L132 PolarHBondContact O-N 3.43Å; L132-M134 VanDerWaalsContact C-N 3.35Å; L132-M134 PolarHBondContact O-N 3.38Å; L132-G136 PolarHBondContact O-N 3.48Å |
| 133 | T | 85.8 | Confident | 87.2 | Confident | 54 Ų | 54 | 36.5 Ų | 36.5 | 33% | 0.331 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -63.5 | -41.8 | 177.1 | -56.6 | 0 | 0 | 0 | 0 | 111.4 | N129 P130 A131 G136 K137 | N129-T133 PolarHBondContact O-N 3.45Å; N129-T133 PolarHBondContact O-OG1 3.29Å; P130-T133 WeakPolarHBondContact O-CB 3.44Å; P130-T133 PolarHBondContact O-N 2.84Å; A131-T133 VanDerWaalsContact C-N 3.32Å; A131-T133 PolarHBondContact O-N 3.26Å; T133-G136 PolarHBondContact O-N 3.38Å; T133-K137 WeakPolarHBondContact O-CG 3.43Å; T133-K137 PolarHBondContact O-N 3.35Å |
| 134 | M | 87 | Confident | 86.2 | Confident | 3 Ų | 3 | 41 Ų | 41 | 2% | 0.015 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -69.5 | -40.5 | -179 | -73.2 | -59 | -69.8 | 0 | 0 | 112.2 | V22 S85 P130 A131 L132 G136 K137 Y138 M195 R196 | V22-M134 HydrophobicContact CG1-CB 4.13Å; S85-M134 PolarHBondContact OG-SD 3.07Å; S85-M134 VanDerWaalsContact OG-SD 3.38Å; P130-M134 WeakPolarHBondContact O-CB 3.35Å; P130-M134 VanDerWaalsContact O-CG 3.23Å; P130-M134 WeakPolarHBondContact O-CG 3.46Å; P130-M134 PolarHBondContact O-N 2.88Å; A131-M134 PolarHBondContact O-N 3.48Å; L132-M134 VanDerWaalsContact C-N 3.35Å; L132-M134 PolarHBondContact O-N 3.38Å; M134-G136 VanDerWaalsContact C-N 3.27Å; M134-G136 PolarHBondContact O-N 3.08Å; M134-K137 PolarHBondContact O-N 3.41Å; M134-K137 VanDerWaalsContact O-N 3.08Å; M134-K137 HydrophobicContact SD-CD 4.33Å; M134-Y138 HydrophobicContact CE-CD2 4.2Å; M134-Y138 HydrophobicContact CE-CE2 3.58Å; M134-Y138 WeakPolarHBondContact O-CD2 3.41Å; M134-Y138 PolarHBondContact O-N 3.45Å; M134-M195 HydrophobicContact CB-SD 3.66Å; M134-M195 HydrophobicContact CE-CB 4.19Å; M134-M195 HydrophobicContact CG-CB 4.22Å; M134-M195 HydrophobicContact CG-CG 4.45Å; M134-M195 HydrophobicContact CG-SD 3.89Å; M134-R196 WeakPolarHBondContact CE-O 3.34Å |
| 135 | I | 85.8 | Confident | 85.6 | Confident | 0 Ų | 0 | 45.7 Ų | 45.7 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -56.2 | -46.1 | 172.2 | -65.9 | 165.5 | 0 | 0 | 0 | 110.3 | A26 A131 K137 Y138 F139 A146 N147 A150 | A26-I135 HydrophobicContact CB-CD1 3.55Å; A26-I135 HydrophobicContact CB-CG1 3.98Å; A131-I135 WeakPolarHBondContact O-CG1 3.42Å; A131-I135 PolarHBondContact O-N 3.38Å; I135-K137 PolarHBondContact O-N 3.07Å; I135-Y138 PolarHBondContact O-N 2.93Å; I135-F139 HydrophobicContact CG2-CD2 4.35Å; I135-F139 PolarHBondContact O-N 2.83Å; I135-A146 HydrophobicContact CG2-CB 3.65Å; I135-N147 VanDerWaalsContact CG2-OD1 3.28Å; I135-N147 WeakPolarHBondContact CG2-OD1 3.41Å; I135-A150 HydrophobicContact CD1-CB 3.53Å |
| 136 | G | 81.1 | Confident | 85.1 | Confident | 21 Ų | 21 | 45.7 Ų | 45.7 | 22% | 0.216 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -64.2 | -22.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 115 | L132 T133 M134 | L132-G136 PolarHBondContact O-N 3.48Å; T133-G136 PolarHBondContact O-N 3.38Å; M134-G136 VanDerWaalsContact C-N 3.27Å; M134-G136 PolarHBondContact O-N 3.08Å |
| 137 | K | 84.1 | Confident | 84.7 | Confident | 86 Ų | 86 | 47 Ų | 47 | 37% | 0.374 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -86.2 | -27.5 | 174.6 | -72.1 | -179.4 | -180 | 179.3 | 0 | 113.3 | Y11 T133 M134 I135 | Y11-K137 VanDerWaalsContact CE1-O 3.3Å; Y11-K137 WeakPolarHBondContact CE1-O 3.13Å; Y11-K137 PolarHBondContact OH-O 3.2Å; T133-K137 WeakPolarHBondContact O-CG 3.43Å; T133-K137 PolarHBondContact O-N 3.35Å; M134-K137 PolarHBondContact O-N 3.41Å; M134-K137 VanDerWaalsContact O-N 3.08Å; M134-K137 HydrophobicContact SD-CD 4.33Å; I135-K137 PolarHBondContact O-N 3.07Å |
| 138 | Y | 86.1 | Confident | 84.1 | Confident | 3 Ų | 3 | 49.1 Ų | 49.1 | 1% | 0.012 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -87.8 | -33.3 | -179.3 | -90.6 | -100.6 | 0 | 0 | 0 | 112.9 | P14 D15 W18 V22 M134 I135 R196 I198 | P14-Y138 WeakPolarHBondContact CD-O 3.44Å; P14-Y138 HydrophobicContact CG-CD1 3.91Å; D15-Y138 PolarHBondContact N-O 2.86Å; W18-Y138 HydrophobicContact CB-CE1 4.24Å; V22-Y138 HydrophobicContact CG1-CD2 4.29Å; V22-Y138 HydrophobicContact CG2-CD1 4.46Å; V22-Y138 HydrophobicContact CG2-CD2 4.23Å; V22-Y138 HydrophobicContact CG2-CE1 4.04Å; V22-Y138 HydrophobicContact CG2-CE2 3.86Å; M134-Y138 HydrophobicContact CE-CD2 4.2Å; M134-Y138 HydrophobicContact CE-CE2 3.58Å; M134-Y138 WeakPolarHBondContact O-CD2 3.41Å; M134-Y138 PolarHBondContact O-N 3.45Å; I135-Y138 PolarHBondContact O-N 2.93Å; Y138-R196 WeakPolarHBondContact CE2-O 3.38Å; Y138-R196 WeakPolarHBondContact OH-CB 3.32Å; Y138-R196 PolarHBondContact OH-O 3.37Å; Y138-I198 HydrophobicContact CD1-CD1 3.66Å; Y138-I198 HydrophobicContact CD2-CD1 4.02Å; Y138-I198 HydrophobicContact CE1-CD1 3.15Å; Y138-I198 HydrophobicContact CE1-CG1 4.11Å; Y138-I198 HydrophobicContact CE2-CD1 3.48Å; Y138-I198 VanDerWaalsContact CE2-CD1 3.48Å; Y138-I198 HydrophobicContact CE2-CG1 3.69Å; Y138-I198 HydrophobicContact CG-CD1 4.11Å; Y138-I198 VanDerWaalsContact CZ-CG1 3.48Å; Y138-I198 VanDerWaalsContact OH-CD1 3.31Å; Y138-I198 WeakPolarHBondContact OH-CD1 3.35Å; Y138-I198 WeakPolarHBondContact OH-CG1 3.43Å |
| 139 | F | 81.8 | Confident | 84 | Confident | 0 Ų | 0 | 52.3 Ų | 52.3 | 0% | 0 | 27% | 0.265 | C | S | . | . | trans | -122.2 | 135.1 | -175.5 | -65 | -80.7 | 0 | 0 | 0 | 111.8 | D15 G19 W20 V23 I135 R142 R143 A146 | D15-F139 VanDerWaalsContact OD1-CA 3.27Å; D15-F139 WeakPolarHBondContact OD1-CA 3.31Å; G19-F139 WeakPolarHBondContact O-CE2 3.13Å; W20-F139 HydrophobicContact CD2-CZ 4.09Å; W20-F139 HydrophobicContact CE3-CZ 4.29Å; W20-F139 HydrophobicContact CZ2-CE1 4.29Å; V23-F139 HydrophobicContact CG2-CD2 4.41Å; V23-F139 HydrophobicContact CG2-CE2 3.65Å; V23-F139 HydrophobicContact CG2-CZ 4.28Å; I135-F139 HydrophobicContact CG2-CD2 4.35Å; I135-F139 PolarHBondContact O-N 2.83Å; F139-R142 HydrophobicContact CD1-CB 3.93Å; F139-R142 HydrophobicContact CE1-CB 4.47Å; F139-R143 HydrophobicContact CB-CB 4.1Å; F139-A146 HydrophobicContact CB-CB 4.39Å; F139-A146 HydrophobicContact CD2-CB 3.61Å; F139-A146 HydrophobicContact CE2-CB 3.95Å; F139-A146 HydrophobicContact CG-CB 3.95Å | ||
| 140 | Y | 78.1 | Confident | 84.1 | Confident | 74 Ų | 74 | 50.5 Ų | 50.5 | 29% | 0.29 | 26% | 0.256 | S | S | . | . | S | Bend | trans | -120.3 | -58.2 | 170.9 | -175.8 | -99.2 | 0 | 0 | 0 | 110 | A4 G6 D15 | A4-Y140 HydrophobicContact CB-CE1 4.39Å; A4-Y140 WeakPolarHBondContact CB-OH 3.46Å; A4-Y140 WeakPolarHBondContact O-CE1 3.44Å; A4-Y140 PolarHBondContact O-OH 3.22Å; G6-Y140 PolarHBondContact O-OH 3.15Å; D15-Y140 PolarHBondContact OD1-N 3.39Å |
| 141 | K | 75.1 | Confident | 84 | Confident | 152 Ų | 152 | 52.4 Ų | 52.4 | 66% | 0.661 | 27% | 0.265 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.4 | -41.6 | 177.8 | -68.3 | -176.1 | -179.1 | -180 | 0 | 112.3 | P3 D15 | P3-K141 HydrophobicContact CB-CG 4.28Å; D15-K141 PolarHBondContact OD1-N 3.1Å; D15-K141 VanDerWaalsContact OD1-N 3.09Å; D15-K141 WeakPolarHBondContact OD2-CB 3.33Å; D15-K141 PolarHBondContact OD2-N 3.2Å |
| 142 | R | 79.7 | Confident | 83.7 | Confident | 138 Ų | 138 | 53.7 Ų | 53.7 | 52% | 0.521 | 28% | 0.275 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99.5 | 16 | -177.2 | -60.5 | -178.9 | 179 | -171.2 | 0.3 | 113.3 | D15 F139 L145 A146 | D15-R142 PolarHBondContact OD1-N 3.45Å; F139-R142 HydrophobicContact CD1-CB 3.93Å; F139-R142 HydrophobicContact CE1-CB 4.47Å; R142-L145 PolarHBondContact O-N 3.17Å; R142-A146 PolarHBondContact O-N 3.02Å |
| 143 | R | 77.8 | Confident | 83.9 | Confident | 114 Ų | 114 | 51 Ų | 51 | 43% | 0.43 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -58.6 | -42.3 | -176.8 | -170.4 | 178.7 | 177.6 | -173 | 0.2 | 114 | F139 L145 A146 N147 | F139-R143 HydrophobicContact CB-CB 4.1Å; R143-L145 VanDerWaalsContact C-N 3.33Å; R143-L145 PolarHBondContact O-N 3.04Å; R143-A146 PolarHBondContact O-N 3.27Å; R143-N147 WeakPolarHBondContact O-CB 3.46Å; R143-N147 PolarHBondContact O-N 3.33Å |
| 144 | P | 77.1 | Confident | 84.2 | Confident | 95 Ų | 95 | 48.6 Ų | 48.6 | 62% | 0.617 | 25% | 0.247 | S | C | * | . | H | α-helix | trans | -62.1 | -40.1 | 177.7 | -23.7 | 35.4 | 0 | 0 | 0 | 112.5 | G148 | P144-G148 PolarHBondContact O-N 2.91Å |
| 145 | L | 82.6 | Confident | 84.5 | Confident | 98 Ų | 98 | 48.5 Ų | 48.5 | 51% | 0.513 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -65.2 | -45.8 | 176.7 | -179.8 | 63.7 | 0 | 0 | 0 | 111.4 | W20 R142 R143 G148 L149 | W20-L145 HydrophobicContact CH2-CD2 3.96Å; W20-L145 HydrophobicContact CH2-CG 4.45Å; R142-L145 PolarHBondContact O-N 3.17Å; R143-L145 VanDerWaalsContact C-N 3.33Å; R143-L145 PolarHBondContact O-N 3.04Å; L145-G148 PolarHBondContact O-N 3.27Å; L145-L149 HydrophobicContact CD1-CD1 4.35Å; L145-L149 HydrophobicContact CG-CD1 4.23Å; L145-L149 WeakPolarHBondContact O-CG 3.48Å; L145-L149 PolarHBondContact O-N 3.4Å |
| 146 | A | 85.5 | Confident | 84.9 | Confident | 0 Ų | 0 | 50.6 Ų | 50.6 | 0% | 0 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -62.8 | -44 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | V23 I135 F139 R142 R143 A150 | V23-A146 HydrophobicContact CG2-CB 3.74Å; I135-A146 HydrophobicContact CG2-CB 3.65Å; F139-A146 HydrophobicContact CB-CB 4.39Å; F139-A146 HydrophobicContact CD2-CB 3.61Å; F139-A146 HydrophobicContact CE2-CB 3.95Å; F139-A146 HydrophobicContact CG-CB 3.95Å; R142-A146 PolarHBondContact O-N 3.02Å; R143-A146 PolarHBondContact O-N 3.27Å; A146-A150 WeakPolarHBondContact O-CB 3.42Å; A146-A150 PolarHBondContact O-N 3.44Å |
| 147 | N | 85.7 | Confident | 85.6 | Confident | 47 Ų | 47 | 51 Ų | 51 | 25% | 0.251 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -63.7 | -44.2 | 173.8 | -82.7 | -15.2 | 0 | 0 | 0 | 111.6 | I135 R143 L149 A150 M151 | I135-N147 VanDerWaalsContact CG2-OD1 3.28Å; I135-N147 WeakPolarHBondContact CG2-OD1 3.41Å; R143-N147 WeakPolarHBondContact O-CB 3.46Å; R143-N147 PolarHBondContact O-N 3.33Å; N147-L149 PolarHBondContact O-N 3.3Å; N147-A150 PolarHBondContact O-N 3.3Å; N147-M151 VanDerWaalsContact O-CB 3.31Å; N147-M151 WeakPolarHBondContact O-CB 3.36Å; N147-M151 WeakPolarHBondContact O-CG 3.45Å; N147-M151 PolarHBondContact O-N 3.44Å |
| 148 | G | 83.4 | Confident | 86.1 | Confident | 43 Ų | 43 | 47.1 Ų | 47.1 | 44% | 0.443 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -58.8 | -47.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | P144 L145 M151 A152 | P144-G148 PolarHBondContact O-N 2.91Å; L145-G148 PolarHBondContact O-N 3.27Å; G148-M151 PolarHBondContact O-N 3.44Å; G148-A152 PolarHBondContact O-N 2.91Å |
| 149 | L | 89.6 | Confident | 86.4 | Confident | 77 Ų | 77 | 48.3 Ų | 48.3 | 40% | 0.403 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -60 | -50.5 | 175.1 | -74.3 | 167.1 | 0 | 0 | 0 | 111.4 | W20 V23 F27 L145 N147 M151 A152 | W20-L149 HydrophobicContact CZ3-CD1 3.76Å; V23-L149 HydrophobicContact CG1-CB 3.93Å; V23-L149 HydrophobicContact CG1-CD1 4.49Å; F27-L149 WeakPolarHBondContact CD2-O 3.4Å; L145-L149 HydrophobicContact CD1-CD1 4.35Å; L145-L149 HydrophobicContact CG-CD1 4.23Å; L145-L149 WeakPolarHBondContact O-CG 3.48Å; L145-L149 PolarHBondContact O-N 3.4Å; N147-L149 PolarHBondContact O-N 3.3Å; L149-M151 VanDerWaalsContact C-N 3.32Å; L149-M151 PolarHBondContact O-N 3.32Å; L149-A152 WeakPolarHBondContact O-CB 3.44Å; L149-A152 PolarHBondContact O-N 2.94Å |
| 150 | A | 90.6 | Very high | 87 | Confident | 0 Ų | 0 | 52 Ų | 52 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -63.2 | -37.5 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | A26 I30 I135 A146 N147 G153 | A26-A150 HydrophobicContact CB-CB 3.92Å; I30-A150 HydrophobicContact CD1-CB 3.8Å; I135-A150 HydrophobicContact CD1-CB 3.53Å; A146-A150 WeakPolarHBondContact O-CB 3.42Å; A146-A150 PolarHBondContact O-N 3.44Å; N147-A150 PolarHBondContact O-N 3.3Å; A150-G153 PolarHBondContact O-N 2.91Å |
| 151 | M | 87.9 | Confident | 87.8 | Confident | 41 Ų | 41 | 48.9 Ų | 48.9 | 20% | 0.202 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -71.2 | -28.4 | 176.6 | -70 | -65.7 | -67.3 | 0 | 0 | 113.3 | I30 Y34 N147 G148 L149 G153 S154 | I30-M151 HydrophobicContact CD1-SD 4.3Å; I30-M151 HydrophobicContact CG2-SD 3.86Å; Y34-M151 HydrophobicContact CE2-CE 4.21Å; Y34-M151 HydrophobicContact CE2-SD 4.44Å; N147-M151 VanDerWaalsContact O-CB 3.31Å; N147-M151 WeakPolarHBondContact O-CB 3.36Å; N147-M151 WeakPolarHBondContact O-CG 3.45Å; N147-M151 PolarHBondContact O-N 3.44Å; G148-M151 PolarHBondContact O-N 3.44Å; L149-M151 VanDerWaalsContact C-N 3.32Å; L149-M151 PolarHBondContact O-N 3.32Å; M151-G153 PolarHBondContact O-N 2.89Å; M151-S154 PolarHBondContact O-N 3.37Å |
| 152 | A | 87.1 | Confident | 88.6 | Confident | 26 Ų | 26 | 41.6 Ų | 41.6 | 22% | 0.215 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -64.8 | -16 | 172.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | G148 L149 S154 P155 V156 | G148-A152 PolarHBondContact O-N 2.91Å; L149-A152 WeakPolarHBondContact O-CB 3.44Å; L149-A152 PolarHBondContact O-N 2.94Å; A152-S154 VanDerWaalsContact C-N 3.26Å; A152-S154 PolarHBondContact O-N 3.5Å; A152-P155 WeakPolarHBondContact O-CD 3.21Å; A152-P155 VanDerWaalsContact O-CG 3.3Å; A152-P155 WeakPolarHBondContact O-CG 3.44Å; A152-V156 WeakPolarHBondContact O-CG2 3.42Å; A152-V156 PolarHBondContact O-N 2.98Å |
| 153 | G | 90.6 | Very high | 89.2 | Confident | 0 Ų | 0 | 36.9 Ų | 36.9 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -59.5 | -34.1 | 172.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | F27 A150 M151 V156 F157 | F27-G153 VanDerWaalsContact CE2-N 3.28Å; F27-G153 VanDerWaalsContact CZ-CA 3.43Å; A150-G153 PolarHBondContact O-N 2.91Å; M151-G153 PolarHBondContact O-N 2.89Å; G153-V156 PolarHBondContact O-N 2.64Å; G153-F157 WeakPolarHBondContact O-CB 3.19Å; G153-F157 VanDerWaalsContact O-CD2 3.24Å; G153-F157 WeakPolarHBondContact O-CD2 3.27Å; G153-F157 PolarHBondContact O-N 3.24Å |
| 154 | S | 92.3 | Very high | 89.9 | Confident | 3 Ų | 3 | 34.6 Ų | 34.6 | 2% | 0.021 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -59.2 | -54.8 | -179.6 | 175.5 | 0 | 0 | 0 | 0 | 113.7 | Y34 M151 A152 V156 F157 L158 | Y34-S154 WeakPolarHBondContact CB-OG 3.46Å; M151-S154 PolarHBondContact O-N 3.37Å; A152-S154 VanDerWaalsContact C-N 3.26Å; A152-S154 PolarHBondContact O-N 3.5Å; S154-V156 PolarHBondContact O-N 3.04Å; S154-F157 PolarHBondContact O-N 3.43Å; S154-L158 WeakPolarHBondContact O-CB 3.5Å; S154-L158 PolarHBondContact O-N 3.29Å |
| 155 | P | 92.6 | Very high | 90.7 | Very high | 1 Ų | 1 | 30 Ų | 30 | 1% | 0.006 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -65.7 | -35.6 | 177.5 | 20.4 | -30.8 | 0 | 0 | 0 | 113.3 | A152 L158 C159 A306 M310 | A152-P155 WeakPolarHBondContact O-CD 3.21Å; A152-P155 VanDerWaalsContact O-CG 3.3Å; A152-P155 WeakPolarHBondContact O-CG 3.44Å; P155-L158 PolarHBondContact O-N 2.9Å; P155-C159 PolarHBondContact O-N 3.28Å; P155-A306 HydrophobicContact CB-CB 4.35Å; P155-A306 WeakPolarHBondContact CB-O 3.41Å; P155-A306 WeakPolarHBondContact O-CB 3.45Å; P155-M310 HydrophobicContact CB-CB 3.93Å; P155-M310 HydrophobicContact CB-CE 4.47Å; P155-M310 HydrophobicContact CB-CG 4.38Å; P155-M310 HydrophobicContact CG-CB 3.94Å; P155-M310 HydrophobicContact CG-CG 4.02Å |
| 156 | V | 94 | Very high | 91.1 | Very high | 43 Ų | 43 | 26.5 Ų | 26.5 | 26% | 0.261 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -63.3 | -43.8 | 177.3 | 173.8 | 0 | 0 | 0 | 0 | 111.6 | F27 A152 G153 S154 L158 C159 T160 M310 | F27-V156 HydrophobicContact CE1-CG1 4.44Å; F27-V156 HydrophobicContact CZ-CB 4Å; F27-V156 HydrophobicContact CZ-CG1 4.12Å; F27-V156 HydrophobicContact CZ-CG2 4.07Å; A152-V156 WeakPolarHBondContact O-CG2 3.42Å; A152-V156 PolarHBondContact O-N 2.98Å; G153-V156 PolarHBondContact O-N 2.64Å; S154-V156 PolarHBondContact O-N 3.04Å; V156-L158 VanDerWaalsContact C-N 3.34Å; V156-C159 PolarHBondContact O-SG 3.44Å; V156-T160 WeakPolarHBondContact O-CG2 3.49Å; V156-T160 PolarHBondContact O-N 3.46Å; V156-T160 PolarHBondContact O-OG1 3.45Å; V156-M310 HydrophobicContact CB-CE 4.39Å; V156-M310 HydrophobicContact CG2-CE 3.53Å; V156-M310 HydrophobicContact CG2-CG 4.42Å; V156-M310 HydrophobicContact CG2-SD 3.59Å; V156-M310 VanDerWaalsContact CG2-SD 3.59Å |
| 157 | F | 95.9 | Very high | 91.4 | Very high | 31 Ų | 31 | 30.2 Ų | 30.2 | 14% | 0.136 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -68.6 | -35.5 | 176.2 | -86.3 | -111.8 | 0 | 0 | 0 | 111.3 | F27 I28 F32 A35 G153 S154 T160 L161 | F27-F157 AromaticContact CD1-CE2 3.86Å; F27-F157 HydrophobicContact CD1-CE2 3.86Å; F27-F157 HydrophobicContact CE1-CD2 4.14Å; F27-F157 AromaticContact CE1-CE2 3.66Å; F27-F157 HydrophobicContact CE1-CE2 3.66Å; I28-F157 HydrophobicContact CB-CZ 4.31Å; I28-F157 HydrophobicContact CG1-CZ 4.21Å; I28-F157 HydrophobicContact CG2-CZ 4.18Å; F32-F157 AromaticContact CD1-CD1 3.97Å; F32-F157 HydrophobicContact CD1-CD1 3.97Å; F32-F157 HydrophobicContact CD1-CE1 4.14Å; F32-F157 HydrophobicContact CD2-CD1 4.2Å; F32-F157 AromaticContact CD2-CE1 3.66Å; F32-F157 HydrophobicContact CD2-CE1 3.66Å; F32-F157 HydrophobicContact CD2-CZ 4.49Å; F32-F157 AromaticContact CE1-CD1 3.99Å; F32-F157 HydrophobicContact CE1-CD1 3.99Å; F32-F157 AromaticContact CE1-CE1 3.93Å; F32-F157 HydrophobicContact CE1-CE1 3.93Å; F32-F157 HydrophobicContact CE2-CD1 4.25Å; F32-F157 AromaticContact CE2-CE1 3.45Å; F32-F157 HydrophobicContact CE2-CE1 3.45Å; F32-F157 VanDerWaalsContact CE2-CE1 3.45Å; F32-F157 HydrophobicContact CE2-CZ 4.3Å; F32-F157 HydrophobicContact CG-CD1 4.08Å; F32-F157 HydrophobicContact CG-CE1 4.02Å; F32-F157 HydrophobicContact CZ-CD1 4.14Å; F32-F157 AromaticContact CZ-CE1 3.59Å; F32-F157 HydrophobicContact CZ-CE1 3.59Å; A35-F157 HydrophobicContact CB-CB 3.65Å; G153-F157 WeakPolarHBondContact O-CB 3.19Å; G153-F157 VanDerWaalsContact O-CD2 3.24Å; G153-F157 WeakPolarHBondContact O-CD2 3.27Å; G153-F157 PolarHBondContact O-N 3.24Å; S154-F157 PolarHBondContact O-N 3.43Å; F157-T160 WeakPolarHBondContact CA-OG1 3.03Å; F157-T160 PolarHBondContact O-N 3.1Å; F157-T160 PolarHBondContact O-OG1 2.84Å; F157-T160 VanDerWaalsContact O-OG1 3.1Å; F157-L161 HydrophobicContact CB-CD1 4.24Å; F157-L161 HydrophobicContact CD1-CD1 4.24Å; F157-L161 WeakPolarHBondContact O-CB 3.19Å; F157-L161 WeakPolarHBondContact O-CG 3.15Å; F157-L161 PolarHBondContact O-N 3.22Å |
| 158 | L | 94.1 | Very high | 91.8 | Very high | 3 Ų | 3 | 29.8 Ų | 29.8 | 2% | 0.016 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -67.9 | -43.4 | 178.6 | -176.8 | 56.9 | 0 | 0 | 0 | 112.5 | A35 K38 S154 P155 V156 T160 A162 A306 | A35-L158 HydrophobicContact CB-CB 3.93Å; K38-L158 HydrophobicContact CB-CD1 3.7Å; K38-L158 HydrophobicContact CB-CD2 4.21Å; K38-L158 HydrophobicContact CD-CD2 3.85Å; S154-L158 WeakPolarHBondContact O-CB 3.5Å; S154-L158 PolarHBondContact O-N 3.29Å; P155-L158 PolarHBondContact O-N 2.9Å; V156-L158 VanDerWaalsContact C-N 3.34Å; L158-T160 PolarHBondContact O-N 3.14Å; L158-A162 WeakPolarHBondContact O-CB 3.46Å; L158-A162 PolarHBondContact O-N 3.13Å; L158-A162 VanDerWaalsContact O-N 3.11Å; L158-A306 HydrophobicContact CB-CB 3.9Å; L158-A306 HydrophobicContact CD2-CB 3.95Å; L158-A306 HydrophobicContact CG-CB 3.9Å |
| 159 | C | 93.6 | Very high | 92.1 | Very high | 29 Ų | 29 | 29.9 Ų | 29.9 | 20% | 0.196 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -68.2 | -24.9 | 179.5 | 71.4 | 0 | 0 | 0 | 0 | 113.4 | P155 V156 P163 S303 A306 | P155-C159 PolarHBondContact O-N 3.28Å; V156-C159 PolarHBondContact O-SG 3.44Å; C159-P163 WeakPolarHBondContact O-CD 3.47Å; C159-S303 PolarHBondContact O-OG 3.07Å; C159-A306 HydrophobicContact CB-CB 3.94Å |
| 160 | T | 94.1 | Very high | 92.2 | Very high | 76 Ų | 76 | 29.2 Ų | 29.2 | 47% | 0.466 | 18% | 0.179 | S | C | . | . | H | α-helix | trans | -89.6 | -44.2 | 177 | 49.4 | 0 | 0 | 0 | 0 | 112.1 | V156 F157 L158 P163 L164 | V156-T160 WeakPolarHBondContact O-CG2 3.49Å; V156-T160 PolarHBondContact O-N 3.46Å; V156-T160 PolarHBondContact O-OG1 3.45Å; F157-T160 WeakPolarHBondContact CA-OG1 3.03Å; F157-T160 PolarHBondContact O-N 3.1Å; F157-T160 PolarHBondContact O-OG1 2.84Å; F157-T160 VanDerWaalsContact O-OG1 3.1Å; L158-T160 PolarHBondContact O-N 3.14Å; T160-P163 WeakPolarHBondContact O-CD 3.42Å; T160-L164 WeakPolarHBondContact O-CB 3.45Å; T160-L164 PolarHBondContact O-N 2.89Å |
| 161 | L | 94.1 | Very high | 92.4 | Very high | 9 Ų | 9 | 34.7 Ų | 34.7 | 5% | 0.047 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -69.5 | -35.9 | -178 | -73.7 | 169.8 | 0 | 0 | 0 | 112.8 | F32 A35 F157 L164 N165 L181 | F32-L161 HydrophobicContact CD1-CD1 4.21Å; F32-L161 HydrophobicContact CE1-CD1 4.24Å; A35-L161 HydrophobicContact CB-CD1 4.31Å; F157-L161 HydrophobicContact CB-CD1 4.24Å; F157-L161 HydrophobicContact CD1-CD1 4.24Å; F157-L161 WeakPolarHBondContact O-CB 3.19Å; F157-L161 WeakPolarHBondContact O-CG 3.15Å; F157-L161 PolarHBondContact O-N 3.22Å; L161-L164 PolarHBondContact O-N 3.47Å; L161-N165 WeakPolarHBondContact O-CB 3.28Å; L161-N165 PolarHBondContact O-N 3.1Å; L161-N165 PolarHBondContact O-ND2 3.18Å; L161-N165 PolarHBondContact O-OD1 3.22Å; L161-L181 HydrophobicContact CD2-CD2 4.3Å |
| 162 | A | 91.9 | Very high | 92.6 | Very high | 0 Ų | 0 | 38.2 Ų | 38.2 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -62.7 | -50.2 | -176.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | V42 L158 Q166 L302 | V42-A162 HydrophobicContact CG1-CB 4.4Å; L158-A162 WeakPolarHBondContact O-CB 3.46Å; L158-A162 PolarHBondContact O-N 3.13Å; L158-A162 VanDerWaalsContact O-N 3.11Å; A162-Q166 PolarHBondContact O-N 3Å; A162-L302 HydrophobicContact CB-CB 4.01Å; A162-L302 HydrophobicContact CB-CD1 4.29Å |
| 163 | P | 92 | Very high | 92.9 | Very high | 39 Ų | 39 | 38.3 Ų | 38.3 | 25% | 0.253 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -68.2 | -39.9 | 175.3 | -19.9 | 34.3 | 0 | 0 | 0 | 112.3 | C159 T160 N165 Q166 V167 S303 | C159-P163 WeakPolarHBondContact O-CD 3.47Å; T160-P163 WeakPolarHBondContact O-CD 3.42Å; P163-N165 VanDerWaalsContact C-N 3.34Å; P163-N165 PolarHBondContact O-N 3.41Å; P163-Q166 WeakPolarHBondContact O-CB 3.46Å; P163-Q166 PolarHBondContact O-N 2.99Å; P163-V167 PolarHBondContact O-N 3.21Å; P163-S303 VanDerWaalsContact CD-OG 3.26Å; P163-S303 WeakPolarHBondContact CD-OG 3.45Å; P163-S303 WeakPolarHBondContact CG-OG 3.24Å |
| 164 | L | 94 | Very high | 92.9 | Very high | 65 Ų | 65 | 39.2 Ų | 39.2 | 34% | 0.34 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -63.5 | -39.4 | -179.6 | 179.1 | 152.4 | 0 | 0 | 0 | 111.9 | T160 L161 Q166 V167 F168 | T160-L164 WeakPolarHBondContact O-CB 3.45Å; T160-L164 PolarHBondContact O-N 2.89Å; L161-L164 PolarHBondContact O-N 3.47Å; L164-Q166 VanDerWaalsContact C-N 3.27Å; L164-Q166 PolarHBondContact O-N 2.77Å; L164-V167 PolarHBondContact O-N 3.36Å; L164-F168 HydrophobicContact CD1-CZ 4.29Å; L164-F168 HydrophobicContact CD2-CD1 4.29Å; L164-F168 HydrophobicContact CD2-CD2 3.6Å; L164-F168 HydrophobicContact CD2-CE1 3.88Å; L164-F168 HydrophobicContact CD2-CE2 3.12Å; L164-F168 HydrophobicContact CD2-CG 4.17Å; L164-F168 HydrophobicContact CD2-CZ 3.28Å; L164-F168 HydrophobicContact CG-CD1 4.48Å; L164-F168 HydrophobicContact CG-CE1 4Å; L164-F168 HydrophobicContact CG-CE2 4.13Å; L164-F168 HydrophobicContact CG-CZ 3.81Å; L164-F168 WeakPolarHBondContact O-CG 3.47Å; L164-F168 PolarHBondContact O-N 3.34Å |
| 165 | N | 93.4 | Very high | 93 | Very high | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -60.9 | -37.6 | 172.7 | -75.9 | -5.8 | 0 | 0 | 0 | 111.6 | S39 V42 F43 L161 P163 F168 F169 L181 | S39-N165 WeakPolarHBondContact CB-ND2 3.43Å; S39-N165 PolarHBondContact O-ND2 2.87Å; S39-N165 PolarHBondContact OG-ND2 3.07Å; V42-N165 HydrophobicContact CG2-CB 3.62Å; F43-N165 HydrophobicContact CE2-CB 3.77Å; F43-N165 HydrophobicContact CZ-CB 3.79Å; L161-N165 WeakPolarHBondContact O-CB 3.28Å; L161-N165 PolarHBondContact O-N 3.1Å; L161-N165 PolarHBondContact O-ND2 3.18Å; L161-N165 PolarHBondContact O-OD1 3.22Å; P163-N165 VanDerWaalsContact C-N 3.34Å; P163-N165 PolarHBondContact O-N 3.41Å; N165-F168 PolarHBondContact O-N 2.97Å; N165-F169 WeakPolarHBondContact O-CB 3.2Å; N165-F169 PolarHBondContact O-N 2.92Å; N165-L181 WeakPolarHBondContact OD1-CD2 3.12Å |
| 166 | Q | 90.1 | Very high | 93.1 | Very high | 24 Ų | 24 | 44.6 Ų | 44.6 | 11% | 0.112 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -70.2 | -36.5 | 177.5 | -173.5 | 53.6 | 29.7 | 0 | 0 | 112.4 | A162 P163 L164 F169 G170 A299 | A162-Q166 PolarHBondContact O-N 3Å; P163-Q166 WeakPolarHBondContact O-CB 3.46Å; P163-Q166 PolarHBondContact O-N 2.99Å; L164-Q166 VanDerWaalsContact C-N 3.27Å; L164-Q166 PolarHBondContact O-N 2.77Å; Q166-F169 PolarHBondContact O-N 3.03Å; Q166-G170 PolarHBondContact O-N 2.98Å; Q166-A299 HydrophobicContact CB-CB 4.08Å |
| 167 | V | 92.6 | Very high | 93.2 | Very high | 78 Ų | 78 | 42.6 Ų | 42.6 | 47% | 0.473 | 24% | 0.242 | S | C | . | . | H | α-helix | trans | -65.7 | -45.2 | 172.8 | 173.2 | 0 | 0 | 0 | 0 | 110.7 | P163 L164 F169 G170 I171 | P163-V167 PolarHBondContact O-N 3.21Å; L164-V167 PolarHBondContact O-N 3.36Å; V167-F169 VanDerWaalsContact C-N 3.27Å; V167-F169 PolarHBondContact O-N 2.9Å; V167-G170 PolarHBondContact O-N 3.47Å; V167-G170 VanDerWaalsContact O-N 3.15Å; V167-I171 HydrophobicContact CG1-CD1 3.7Å; V167-I171 HydrophobicContact CG1-CG1 4.48Å; V167-I171 WeakPolarHBondContact O-CG1 3.18Å; V167-I171 PolarHBondContact O-N 2.79Å; V167-I171 VanDerWaalsContact O-N 3.08Å |
| 168 | F | 94.1 | Very high | 93.2 | Very high | 37 Ų | 37 | 41.1 Ų | 41.1 | 16% | 0.162 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -59.2 | -41.6 | 176.1 | -72.1 | -3.8 | 0 | 0 | 0 | 111.7 | L164 N165 G170 I171 F172 S177 I180 L184 | L164-F168 HydrophobicContact CD1-CZ 4.29Å; L164-F168 HydrophobicContact CD2-CD1 4.29Å; L164-F168 HydrophobicContact CD2-CD2 3.6Å; L164-F168 HydrophobicContact CD2-CE1 3.88Å; L164-F168 HydrophobicContact CD2-CE2 3.12Å; L164-F168 HydrophobicContact CD2-CG 4.17Å; L164-F168 HydrophobicContact CD2-CZ 3.28Å; L164-F168 HydrophobicContact CG-CD1 4.48Å; L164-F168 HydrophobicContact CG-CE1 4Å; L164-F168 HydrophobicContact CG-CE2 4.13Å; L164-F168 HydrophobicContact CG-CZ 3.81Å; L164-F168 WeakPolarHBondContact O-CG 3.47Å; L164-F168 PolarHBondContact O-N 3.34Å; N165-F168 PolarHBondContact O-N 2.97Å; F168-G170 PolarHBondContact O-N 3.24Å; F168-I171 PolarHBondContact O-N 3.03Å; F168-F172 WeakPolarHBondContact O-CB 3.45Å; F168-F172 PolarHBondContact O-N 3.22Å; F168-S177 WeakPolarHBondContact CB-OG 3.5Å; F168-S177 PolarHBondContact O-OG 3.46Å; F168-I180 HydrophobicContact CD2-CB 4.47Å; F168-I180 HydrophobicContact CD2-CG2 4.12Å; F168-I180 HydrophobicContact CE2-CB 4.25Å; F168-I180 HydrophobicContact CE2-CG2 3.44Å; F168-I180 VanDerWaalsContact CE2-CG2 3.44Å; F168-I180 HydrophobicContact CZ-CG2 3.81Å; F168-L184 HydrophobicContact CE2-CD1 4.25Å |
| 169 | F | 90.4 | Very high | 93.4 | Very high | 45 Ų | 45 | 45 Ų | 45 | 20% | 0.197 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -59.8 | -47.3 | 175.3 | -177.6 | -99.6 | 0 | 0 | 0 | 111.7 | F43 E46 N165 Q166 V167 I171 G173 W174 S177 | F43-F169 HydrophobicContact CD1-CB 4.21Å; F43-F169 AromaticContact CD1-CD2 3.69Å; F43-F169 HydrophobicContact CD1-CD2 3.69Å; F43-F169 HydrophobicContact CD1-CG 4.24Å; F43-F169 HydrophobicContact CE1-CB 3.72Å; F43-F169 AromaticContact CE1-CD2 3.88Å; F43-F169 HydrophobicContact CE1-CD2 3.88Å; F43-F169 HydrophobicContact CE1-CG 4.21Å; E46-F169 HydrophobicContact CB-CE2 3.97Å; E46-F169 HydrophobicContact CB-CZ 3.76Å; E46-F169 HydrophobicContact CG-CE1 3.79Å; E46-F169 HydrophobicContact CG-CE2 4.1Å; E46-F169 HydrophobicContact CG-CZ 3.48Å; E46-F169 VanDerWaalsContact CG-CZ 3.48Å; N165-F169 WeakPolarHBondContact O-CB 3.2Å; N165-F169 PolarHBondContact O-N 2.92Å; Q166-F169 PolarHBondContact O-N 3.03Å; V167-F169 VanDerWaalsContact C-N 3.27Å; V167-F169 PolarHBondContact O-N 2.9Å; F169-I171 VanDerWaalsContact C-N 3.34Å; F169-I171 PolarHBondContact O-N 3.1Å; F169-G173 WeakPolarHBondContact O-CA 3.15Å; F169-G173 PolarHBondContact O-N 2.79Å; F169-W174 HydrophobicContact CD2-CB 4.05Å; F169-W174 HydrophobicContact CE2-CB 3.93Å; F169-S177 WeakPolarHBondContact CA-OG 3.32Å; F169-S177 PolarHBondContact N-OG 3.04Å; F169-S177 VanDerWaalsContact N-OG 3.12Å |
| 170 | G | 90.1 | Very high | 93.5 | Very high | 63 Ų | 63 | 46.4 Ų | 46.4 | 65% | 0.649 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -63.7 | -35.7 | -178 | 0 | 0 | 0 | 0 | 0 | 114 | Q166 V167 F168 | Q166-G170 PolarHBondContact O-N 2.98Å; V167-G170 PolarHBondContact O-N 3.47Å; V167-G170 VanDerWaalsContact O-N 3.15Å; F168-G170 PolarHBondContact O-N 3.24Å |
| 171 | I | 94.8 | Very high | 93.6 | Very high | 116 Ų | 116 | 42.9 Ų | 42.9 | 60% | 0.595 | 24% | 0.239 | S | C | * | . | H | α-helix | trans | -90.1 | -43.9 | -175.6 | -59 | 171.1 | 0 | 0 | 0 | 111.9 | V167 F168 F169 | V167-I171 HydrophobicContact CG1-CD1 3.7Å; V167-I171 HydrophobicContact CG1-CG1 4.48Å; V167-I171 WeakPolarHBondContact O-CG1 3.18Å; V167-I171 PolarHBondContact O-N 2.79Å; V167-I171 VanDerWaalsContact O-N 3.08Å; F168-I171 PolarHBondContact O-N 3.03Å; F169-I171 VanDerWaalsContact C-N 3.34Å; F169-I171 PolarHBondContact O-N 3.1Å |
| 172 | F | 93.6 | Very high | 93.6 | Very high | 115 Ų | 115 | 42.4 Ų | 42.4 | 50% | 0.504 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -113.9 | -3.7 | -168.7 | -55.5 | -68.9 | 0 | 0 | 0 | 113.9 | F168 I180 | F168-F172 WeakPolarHBondContact O-CB 3.45Å; F168-F172 PolarHBondContact O-N 3.22Å; F172-I180 HydrophobicContact CD2-CD1 3.65Å; F172-I180 HydrophobicContact CE2-CD1 3.86Å; F172-I180 HydrophobicContact CG-CD1 4.16Å |
| 173 | G | 92.9 | Very high | 93.8 | Very high | 28 Ų | 28 | 44 Ų | 44 | 29% | 0.289 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | 69.1 | 179.5 | -170.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | F169 R175 S177 | F169-G173 WeakPolarHBondContact O-CA 3.15Å; F169-G173 PolarHBondContact O-N 2.79Å; G173-R175 PolarHBondContact O-N 3.36Å; G173-S177 WeakPolarHBondContact O-CB 3.4Å; G173-S177 PolarHBondContact O-N 3.49Å; G173-S177 PolarHBondContact O-OG 3.21Å |
| 174 | W | 91.4 | Very high | 93.8 | Very high | 18 Ų | 18 | 44.5 Ų | 44.5 | 7% | 0.068 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -67 | -37 | -176.6 | 70.9 | -84.5 | 0 | 0 | 0 | 113.4 | F43 I50 F51 C106 L112 F169 S177 F178 | F43-W174 HydrophobicContact CD1-CB 4.48Å; I50-W174 HydrophobicContact CD1-CG 4.39Å; F51-W174 HydrophobicContact CE2-CH2 4.07Å; F51-W174 HydrophobicContact CE2-CZ2 4.03Å; F51-W174 AromaticContact CZ-CH2 3.69Å; F51-W174 HydrophobicContact CZ-CH2 3.69Å; F51-W174 AromaticContact CZ-CZ2 3.71Å; F51-W174 HydrophobicContact CZ-CZ2 3.71Å; C106-W174 WeakPolarHBondContact O-CH2 3.22Å; L112-W174 HydrophobicContact CD2-CZ3 4.3Å; F169-W174 HydrophobicContact CD2-CB 4.05Å; F169-W174 HydrophobicContact CE2-CB 3.93Å; W174-S177 WeakPolarHBondContact O-CB 3.31Å; W174-S177 PolarHBondContact O-N 3.47Å; W174-F178 AromaticContact CE3-CD2 3.64Å; W174-F178 HydrophobicContact CE3-CD2 3.64Å; W174-F178 AromaticContact CE3-CE2 3.47Å; W174-F178 HydrophobicContact CE3-CE2 3.47Å; W174-F178 VanDerWaalsContact CE3-CE2 3.47Å; W174-F178 HydrophobicContact CE3-CZ 4.34Å; W174-F178 AromaticContact CZ3-CD2 3.88Å; W174-F178 HydrophobicContact CZ3-CD2 3.88Å; W174-F178 AromaticContact CZ3-CE2 3.77Å; W174-F178 HydrophobicContact CZ3-CE2 3.77Å; W174-F178 WeakPolarHBondContact O-CG 3.49Å; W174-F178 PolarHBondContact O-N 3.27Å |
| 175 | R | 94 | Very high | 93.8 | Very high | 98 Ų | 98 | 41.5 Ų | 41.5 | 37% | 0.37 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -65.6 | -50.7 | 179.4 | -66 | -170.4 | 149.4 | 105.2 | -0.2 | 112 | S104 C106 N107 G173 S177 F178 L179 | S104-R175 VanDerWaalsContact CB-O 3.28Å; S104-R175 WeakPolarHBondContact CB-O 3.03Å; S104-R175 VanDerWaalsContact O-CD 3.26Å; S104-R175 WeakPolarHBondContact O-CD 3.35Å; S104-R175 VanDerWaalsContact O-CG 3.25Å; S104-R175 WeakPolarHBondContact O-CG 3.49Å; S104-R175 PolarHBondContact O-NE 2.94Å; S104-R175 VanDerWaalsContact O-NE 3.13Å; C106-R175 PolarHBondContact O-NH2 3.25Å; N107-R175 PolarHBondContact OD1-NH2 3.02Å; G173-R175 PolarHBondContact O-N 3.36Å; R175-S177 VanDerWaalsContact C-N 3.28Å; R175-S177 PolarHBondContact O-N 3.22Å; R175-F178 PolarHBondContact O-N 2.71Å; R175-L179 PolarHBondContact O-N 3.3Å; R175-L179 VanDerWaalsContact O-N 3.1Å |
| 176 | G | 95.1 | Very high | 93.9 | Very high | 20 Ų | 20 | 44.3 Ų | 44.3 | 21% | 0.206 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -61.5 | -38.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112 | L179 I180 | G176-L179 PolarHBondContact O-N 2.82Å; G176-I180 WeakPolarHBondContact O-CG1 3.28Å; G176-I180 PolarHBondContact O-N 2.93Å |
| 177 | S | 95.8 | Very high | 94.1 | Very high | 0 Ų | 0 | 47.1 Ų | 47.1 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -59.2 | -48.2 | 174.6 | -60.3 | 0 | 0 | 0 | 0 | 112.4 | F168 F169 G173 W174 R175 L179 I180 L181 | F168-S177 WeakPolarHBondContact CB-OG 3.5Å; F168-S177 PolarHBondContact O-OG 3.46Å; F169-S177 WeakPolarHBondContact CA-OG 3.32Å; F169-S177 PolarHBondContact N-OG 3.04Å; F169-S177 VanDerWaalsContact N-OG 3.12Å; G173-S177 WeakPolarHBondContact O-CB 3.4Å; G173-S177 PolarHBondContact O-N 3.49Å; G173-S177 PolarHBondContact O-OG 3.21Å; W174-S177 WeakPolarHBondContact O-CB 3.31Å; W174-S177 PolarHBondContact O-N 3.47Å; R175-S177 VanDerWaalsContact C-N 3.28Å; R175-S177 PolarHBondContact O-N 3.22Å; S177-L179 VanDerWaalsContact C-N 3.32Å; S177-L179 PolarHBondContact O-N 3.08Å; S177-I180 PolarHBondContact O-N 3.18Å; S177-L181 WeakPolarHBondContact O-CB 3.41Å; S177-L181 VanDerWaalsContact O-CG 3.24Å; S177-L181 WeakPolarHBondContact O-CG 3.4Å; S177-L181 PolarHBondContact O-N 3.02Å |
| 178 | F | 96 | Very high | 94.1 | Very high | 0 Ų | 0 | 43.4 Ų | 43.4 | 0% | 0 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -65.2 | -34.7 | 178.8 | -70.5 | -10.4 | 0 | 0 | 0 | 112.9 | I40 F43 I47 A103 L112 I116 W174 R175 L181 G182 | I40-F178 HydrophobicContact CD1-CE1 3.85Å; I40-F178 HydrophobicContact CD1-CZ 4.14Å; I40-F178 HydrophobicContact CG1-CE1 3.96Å; I40-F178 HydrophobicContact CG1-CZ 4.37Å; F43-F178 AromaticContact CD2-CE1 3.89Å; F43-F178 HydrophobicContact CD2-CE1 3.89Å; F43-F178 HydrophobicContact CE2-CE1 4.08Å; F43-F178 HydrophobicContact CG-CE1 4.16Å; F43-F178 HydrophobicContact CZ-CE1 4.48Å; I47-F178 HydrophobicContact CD1-CZ 4.22Å; A103-F178 HydrophobicContact CB-CD2 4.21Å; L112-F178 HydrophobicContact CD2-CE2 4.4Å; I116-F178 HydrophobicContact CD1-CD2 4.28Å; I116-F178 HydrophobicContact CD1-CE2 3.72Å; I116-F178 HydrophobicContact CD1-CZ 3.95Å; W174-F178 AromaticContact CE3-CD2 3.64Å; W174-F178 HydrophobicContact CE3-CD2 3.64Å; W174-F178 AromaticContact CE3-CE2 3.47Å; W174-F178 HydrophobicContact CE3-CE2 3.47Å; W174-F178 VanDerWaalsContact CE3-CE2 3.47Å; W174-F178 HydrophobicContact CE3-CZ 4.34Å; W174-F178 AromaticContact CZ3-CD2 3.88Å; W174-F178 HydrophobicContact CZ3-CD2 3.88Å; W174-F178 AromaticContact CZ3-CE2 3.77Å; W174-F178 HydrophobicContact CZ3-CE2 3.77Å; W174-F178 WeakPolarHBondContact O-CG 3.49Å; W174-F178 PolarHBondContact O-N 3.27Å; R175-F178 PolarHBondContact O-N 2.71Å; F178-L181 HydrophobicContact CD1-CD1 4.36Å; F178-G182 PolarHBondContact O-N 2.92Å |
| 179 | L | 96.6 | Very high | 94.1 | Very high | 84 Ų | 84 | 42.7 Ų | 42.7 | 44% | 0.44 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -62.6 | -47.8 | 174.3 | -171 | 68 | 0 | 0 | 0 | 111.6 | I101 R175 G176 S177 G182 G183 | I101-L179 HydrophobicContact CB-CD1 4.38Å; I101-L179 HydrophobicContact CG1-CD1 4.16Å; I101-L179 HydrophobicContact CG2-CD1 3.82Å; R175-L179 PolarHBondContact O-N 3.3Å; R175-L179 VanDerWaalsContact O-N 3.1Å; G176-L179 PolarHBondContact O-N 2.82Å; S177-L179 VanDerWaalsContact C-N 3.32Å; S177-L179 PolarHBondContact O-N 3.08Å; L179-G182 PolarHBondContact O-N 2.89Å; L179-G183 PolarHBondContact O-N 3.43Å |
| 180 | I | 96.8 | Very high | 94.3 | Very high | 60 Ų | 60 | 45 Ų | 45 | 31% | 0.308 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -65.6 | -44 | 178.5 | -63.6 | 165.9 | 0 | 0 | 0 | 110.8 | F168 F172 G176 S177 G182 G183 L184 | F168-I180 HydrophobicContact CD2-CB 4.47Å; F168-I180 HydrophobicContact CD2-CG2 4.12Å; F168-I180 HydrophobicContact CE2-CB 4.25Å; F168-I180 HydrophobicContact CE2-CG2 3.44Å; F168-I180 VanDerWaalsContact CE2-CG2 3.44Å; F168-I180 HydrophobicContact CZ-CG2 3.81Å; F172-I180 HydrophobicContact CD2-CD1 3.65Å; F172-I180 HydrophobicContact CE2-CD1 3.86Å; F172-I180 HydrophobicContact CG-CD1 4.16Å; G176-I180 WeakPolarHBondContact O-CG1 3.28Å; G176-I180 PolarHBondContact O-N 2.93Å; S177-I180 PolarHBondContact O-N 3.18Å; I180-G182 VanDerWaalsContact C-N 3.28Å; I180-G182 PolarHBondContact O-N 3.33Å; I180-G183 WeakPolarHBondContact O-CA 3.43Å; I180-G183 PolarHBondContact O-N 3.05Å; I180-L184 PolarHBondContact O-N 3.45Å |
| 181 | L | 95.3 | Very high | 94.5 | Very high | 1 Ų | 1 | 42 Ų | 42 | 1% | 0.005 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -63.9 | -33.4 | 177.2 | -71.5 | 168 | 0 | 0 | 0 | 112.1 | F36 F43 L100 L161 N165 S177 F178 G183 L184 L185 | F36-L181 HydrophobicContact CE2-CB 4.07Å; F36-L181 HydrophobicContact CE2-CD1 4.27Å; F36-L181 HydrophobicContact CE2-CD2 4.1Å; F36-L181 HydrophobicContact CE2-CG 4.38Å; F36-L181 HydrophobicContact CZ-CB 4.35Å; F36-L181 HydrophobicContact CZ-CD1 4.4Å; F43-L181 HydrophobicContact CE2-CD1 4.04Å; F43-L181 HydrophobicContact CZ-CD1 4.17Å; L100-L181 HydrophobicContact CD2-CB 3.78Å; L161-L181 HydrophobicContact CD2-CD2 4.3Å; N165-L181 WeakPolarHBondContact OD1-CD2 3.12Å; S177-L181 WeakPolarHBondContact O-CB 3.41Å; S177-L181 VanDerWaalsContact O-CG 3.24Å; S177-L181 WeakPolarHBondContact O-CG 3.4Å; S177-L181 PolarHBondContact O-N 3.02Å; F178-L181 HydrophobicContact CD1-CD1 4.36Å; L181-G183 VanDerWaalsContact C-N 3.34Å; L181-L184 HydrophobicContact CD2-CD1 4.04Å; L181-L184 PolarHBondContact O-N 2.95Å; L181-L185 PolarHBondContact O-N 2.93Å |
| 182 | G | 95.3 | Very high | 94.3 | Very high | 0 Ų | 0 | 36.5 Ų | 36.5 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -59.3 | -44.3 | 169.8 | 0 | 0 | 0 | 0 | 0 | 112 | G97 F178 L179 I180 L184 L185 L186 | G97-G182 WeakPolarHBondContact CA-O 3.46Å; F178-G182 PolarHBondContact O-N 2.92Å; L179-G182 PolarHBondContact O-N 2.89Å; I180-G182 VanDerWaalsContact C-N 3.28Å; I180-G182 PolarHBondContact O-N 3.33Å; G182-L184 PolarHBondContact O-N 3.27Å; G182-L185 PolarHBondContact O-N 3.31Å; G182-L186 WeakPolarHBondContact O-CG 3.12Å; G182-L186 PolarHBondContact O-N 3.01Å |
| 183 | G | 94.6 | Very high | 94.4 | Very high | 33 Ų | 33 | 33.6 Ų | 33.6 | 34% | 0.34 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -60.4 | -40.9 | 172 | 0 | 0 | 0 | 0 | 0 | 113.3 | L179 I180 L181 L186 | L179-G183 PolarHBondContact O-N 3.43Å; I180-G183 WeakPolarHBondContact O-CA 3.43Å; I180-G183 PolarHBondContact O-N 3.05Å; L181-G183 VanDerWaalsContact C-N 3.34Å; G183-L186 WeakPolarHBondContact O-CB 3.48Å; G183-L186 PolarHBondContact O-N 3.3Å |
| 184 | L | 93.7 | Very high | 94.4 | Very high | 50 Ų | 50 | 34.8 Ų | 34.8 | 26% | 0.262 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -64.9 | -39.8 | 174.9 | -70.2 | 174.6 | 0 | 0 | 0 | 112.2 | F32 F168 I180 L181 G182 L186 N187 | F32-L184 HydrophobicContact CE1-CB 4.31Å; F32-L184 HydrophobicContact CZ-CB 4.19Å; F168-L184 HydrophobicContact CE2-CD1 4.25Å; I180-L184 PolarHBondContact O-N 3.45Å; L181-L184 HydrophobicContact CD2-CD1 4.04Å; L181-L184 PolarHBondContact O-N 2.95Å; G182-L184 PolarHBondContact O-N 3.27Å; L184-L186 VanDerWaalsContact C-N 3.31Å; L184-L186 PolarHBondContact O-N 2.89Å; L184-N187 VanDerWaalsContact O-CB 3.28Å; L184-N187 WeakPolarHBondContact O-CB 3.27Å; L184-N187 PolarHBondContact O-N 3.17Å; L184-N187 VanDerWaalsContact O-N 3.11Å |
| 185 | L | 94.1 | Very high | 94.3 | Very high | 1 Ų | 1 | 34 Ų | 34 | 1% | 0.005 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -68.4 | -27.2 | 175.2 | -73.5 | -173.5 | 0 | 0 | 0 | 113.1 | F32 F36 L100 L124 L181 G182 N187 C188 | F32-L185 HydrophobicContact CB-CD2 3.94Å; F32-L185 HydrophobicContact CD1-CD2 3.63Å; F32-L185 HydrophobicContact CE1-CD2 4.27Å; F32-L185 HydrophobicContact CG-CD2 3.87Å; F36-L185 HydrophobicContact CD1-CD1 4.38Å; F36-L185 HydrophobicContact CD2-CD1 4.36Å; F36-L185 HydrophobicContact CD2-CD2 4.11Å; F36-L185 HydrophobicContact CD2-CG 4.38Å; F36-L185 HydrophobicContact CE1-CD1 4.29Å; F36-L185 HydrophobicContact CE2-CD1 4.27Å; F36-L185 HydrophobicContact CE2-CG 4.4Å; F36-L185 HydrophobicContact CG-CD1 4.45Å; F36-L185 HydrophobicContact CG-CD2 4.36Å; F36-L185 HydrophobicContact CZ-CD1 4.29Å; L100-L185 HydrophobicContact CD1-CD1 3.83Å; L100-L185 HydrophobicContact CD2-CD1 3.36Å; L100-L185 HydrophobicContact CD2-CG 4.05Å; L100-L185 HydrophobicContact CG-CD1 4.17Å; L124-L185 HydrophobicContact CD2-CD2 4.19Å; L181-L185 PolarHBondContact O-N 2.93Å; G182-L185 PolarHBondContact O-N 3.31Å; L185-N187 PolarHBondContact O-N 3.17Å; L185-C188 WeakPolarHBondContact O-CB 3.47Å; L185-C188 PolarHBondContact O-N 2.57Å; L185-C188 PolarHBondContact O-SG 2.61Å; L185-C188 VanDerWaalsContact O-SG 3.42Å |
| 186 | L | 95.1 | Very high | 94 | Very high | 60 Ų | 60 | 37.2 Ų | 37.2 | 31% | 0.314 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -63.5 | -22.9 | 170.8 | -70.4 | 173.9 | 0 | 0 | 0 | 112.5 | I101 G182 G183 L184 C188 C189 | I101-L186 HydrophobicContact CD1-CD1 4.42Å; G182-L186 WeakPolarHBondContact O-CG 3.12Å; G182-L186 PolarHBondContact O-N 3.01Å; G183-L186 WeakPolarHBondContact O-CB 3.48Å; G183-L186 PolarHBondContact O-N 3.3Å; L184-L186 VanDerWaalsContact C-N 3.31Å; L184-L186 PolarHBondContact O-N 2.89Å; L186-C188 PolarHBondContact O-N 2.96Å; L186-C189 WeakPolarHBondContact O-CB 3.36Å; L186-C189 PolarHBondContact O-N 3.11Å; L186-C189 PolarHBondContact O-SG 3.28Å; L186-C189 VanDerWaalsContact O-SG 3.37Å |
| 187 | N | 93.8 | Very high | 93.4 | Very high | 83 Ų | 83 | 40.8 Ų | 40.8 | 44% | 0.444 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -65.3 | -16.7 | 171.6 | -71.1 | -38.1 | 0 | 0 | 0 | 112.9 | L184 L185 C189 V190 A191 | L184-N187 VanDerWaalsContact O-CB 3.28Å; L184-N187 WeakPolarHBondContact O-CB 3.27Å; L184-N187 PolarHBondContact O-N 3.17Å; L184-N187 VanDerWaalsContact O-N 3.11Å; L185-N187 PolarHBondContact O-N 3.17Å; N187-C189 PolarHBondContact O-N 3.04Å; N187-V190 WeakPolarHBondContact O-CB 3.3Å; N187-V190 PolarHBondContact O-N 3.35Å; N187-A191 PolarHBondContact O-N 3.42Å |
| 188 | C | 92.7 | Very high | 92.6 | Very high | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -59.6 | -27.4 | 167.6 | -67.4 | 0 | 0 | 0 | 0 | 112 | F32 N127 L185 L186 A191 G192 | F32-C188 VanDerWaalsContact CD2-SG 3.52Å; N127-C188 WeakPolarHBondContact OD1-CB 3.37Å; L185-C188 WeakPolarHBondContact O-CB 3.47Å; L185-C188 PolarHBondContact O-N 2.57Å; L185-C188 PolarHBondContact O-SG 2.61Å; L185-C188 VanDerWaalsContact O-SG 3.42Å; L186-C188 PolarHBondContact O-N 2.96Å; C188-A191 PolarHBondContact O-N 2.99Å; C188-G192 PolarHBondContact O-N 3.23Å |
| 189 | C | 94.3 | Very high | 91.3 | Very high | 22 Ų | 22 | 45.8 Ų | 45.8 | 15% | 0.149 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -64.5 | -41.4 | 172.7 | -59.1 | 0 | 0 | 0 | 0 | 111.7 | I90 G93 C94 L186 N187 G192 A193 | I90-C189 HydrophobicContact CG2-CB 4.42Å; I90-C189 PolarHBondContact O-SG 3.27Å; G93-C189 VanDerWaalsContact CA-SG 3.58Å; C94-C189 PolarHBondContact N-SG 3.45Å; L186-C189 WeakPolarHBondContact O-CB 3.36Å; L186-C189 PolarHBondContact O-N 3.11Å; L186-C189 PolarHBondContact O-SG 3.28Å; L186-C189 VanDerWaalsContact O-SG 3.37Å; N187-C189 PolarHBondContact O-N 3.04Å; C189-G192 PolarHBondContact O-N 2.91Å; C189-A193 PolarHBondContact O-N 3.27Å |
| 190 | V | 94.5 | Very high | 89.2 | Confident | 92 Ų | 92 | 47.3 Ų | 47.3 | 56% | 0.558 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -66.3 | -43.9 | 176.7 | -176.7 | 0 | 0 | 0 | 0 | 109.9 | N187 G192 A193 L194 | N187-V190 WeakPolarHBondContact O-CB 3.3Å; N187-V190 PolarHBondContact O-N 3.35Å; V190-G192 VanDerWaalsContact C-N 3.27Å; V190-G192 PolarHBondContact O-N 3.11Å; V190-A193 WeakPolarHBondContact O-CB 3.49Å; V190-A193 PolarHBondContact O-N 3.44Å; V190-A193 VanDerWaalsContact O-N 3.07Å; V190-L194 PolarHBondContact O-N 2.95Å |
| 191 | A | 93.4 | Very high | 86.9 | Confident | 2 Ų | 2 | 53.5 Ų | 53.5 | 2% | 0.017 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -58.3 | -40.7 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | I28 N187 C188 A193 L194 | I28-A191 HydrophobicContact CB-CB 4.03Å; I28-A191 HydrophobicContact CG2-CB 3.97Å; N187-A191 PolarHBondContact O-N 3.42Å; C188-A191 PolarHBondContact O-N 2.99Å; A191-A193 VanDerWaalsContact C-N 3.35Å; A191-A193 PolarHBondContact O-N 3.2Å; A191-L194 WeakPolarHBondContact O-CB 3.15Å; A191-L194 PolarHBondContact O-N 3.36Å |
| 192 | G | 92.4 | Very high | 84.7 | Confident | 0 Ų | 0 | 58.6 Ų | 58.6 | 0% | 0 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -64 | -34.2 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | R86 C188 C189 V190 L194 M195 | R86-G192 WeakPolarHBondContact CG-O 3.16Å; C188-G192 PolarHBondContact O-N 3.23Å; C189-G192 PolarHBondContact O-N 2.91Å; V190-G192 VanDerWaalsContact C-N 3.27Å; V190-G192 PolarHBondContact O-N 3.11Å; G192-L194 PolarHBondContact O-N 3.36Å; G192-M195 VanDerWaalsContact O-CB 3.23Å; G192-M195 WeakPolarHBondContact O-CB 3.49Å; G192-M195 WeakPolarHBondContact O-CG 3.48Å; G192-M195 PolarHBondContact O-N 3.2Å; G192-M195 VanDerWaalsContact O-N 3.1Å |
| 193 | A | 93.8 | Very high | 81.9 | Confident | 54 Ų | 54 | 64.4 Ų | 64.4 | 45% | 0.446 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -64 | -28.5 | 179 | 0 | 0 | 0 | 0 | 0 | 113 | C189 V190 A191 M195 | C189-A193 PolarHBondContact O-N 3.27Å; V190-A193 WeakPolarHBondContact O-CB 3.49Å; V190-A193 PolarHBondContact O-N 3.44Å; V190-A193 VanDerWaalsContact O-N 3.07Å; A191-A193 VanDerWaalsContact C-N 3.35Å; A191-A193 PolarHBondContact O-N 3.2Å; A193-M195 PolarHBondContact O-N 3.21Å |
| 194 | L | 93.7 | Very high | 79.2 | Confident | 53 Ų | 53 | 71.2 Ų | 71.2 | 28% | 0.277 | 39% | 0.393 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.7 | -18.4 | 175.9 | -61.3 | 174.9 | 0 | 0 | 0 | 113.1 | W18 V190 A191 G192 R196 | W18-L194 PolarHBondContact NE1-O 3.27Å; V190-L194 PolarHBondContact O-N 2.95Å; A191-L194 WeakPolarHBondContact O-CB 3.15Å; A191-L194 PolarHBondContact O-N 3.36Å; G192-L194 PolarHBondContact O-N 3.36Å; L194-R196 VanDerWaalsContact C-N 3.27Å; L194-R196 PolarHBondContact O-N 2.89Å |
| 195 | M | 89.9 | Confident | 76.5 | Confident | 0 Ų | 0 | 72.8 Ų | 72.8 | 0% | 0 | 41% | 0.413 | C | S | . | . | trans | -77.4 | 69.7 | -176 | -58 | -69.1 | 166 | 0 | 0 | 112.1 | V22 A26 M89 A131 M134 G192 A193 P197 | V22-M195 HydrophobicContact CB-SD 4.41Å; V22-M195 HydrophobicContact CG1-CE 4.3Å; V22-M195 HydrophobicContact CG1-SD 3.7Å; V22-M195 HydrophobicContact CG2-SD 4.36Å; V22-M195 WeakPolarHBondContact O-CE 3.4Å; A26-M195 HydrophobicContact CB-CE 4.11Å; A26-M195 VanDerWaalsContact N-CE 3.35Å; M89-M195 HydrophobicContact CE-CE 4.1Å; M89-M195 HydrophobicContact CE-CG 4.27Å; M89-M195 HydrophobicContact SD-CE 4.28Å; M89-M195 HydrophobicContact SD-CG 3.58Å; M89-M195 VanDerWaalsContact SD-CG 3.58Å; M89-M195 HydrophobicContact SD-SD 4.32Å; A131-M195 HydrophobicContact CB-CE 4.48Å; M134-M195 HydrophobicContact CB-SD 3.66Å; M134-M195 HydrophobicContact CE-CB 4.19Å; M134-M195 HydrophobicContact CG-CB 4.22Å; M134-M195 HydrophobicContact CG-CG 4.45Å; M134-M195 HydrophobicContact CG-SD 3.89Å; G192-M195 VanDerWaalsContact O-CB 3.23Å; G192-M195 WeakPolarHBondContact O-CB 3.49Å; G192-M195 WeakPolarHBondContact O-CG 3.48Å; G192-M195 PolarHBondContact O-N 3.2Å; G192-M195 VanDerWaalsContact O-N 3.1Å; A193-M195 PolarHBondContact O-N 3.21Å; M195-P197 WeakPolarHBondContact O-CD 3.11Å | ||
| 196 | R | 88.2 | Confident | 73.7 | Confident | 167 Ų | 167 | 75.1 Ų | 75.1 | 63% | 0.63 | 44% | 0.438 | S | S | * | . | trans | -67.6 | 122.3 | 179.1 | -175 | 177.6 | -174.6 | 179.4 | 2.1 | 110.1 | M134 Y138 L194 I198 | M134-R196 WeakPolarHBondContact CE-O 3.34Å; Y138-R196 WeakPolarHBondContact CE2-O 3.38Å; Y138-R196 WeakPolarHBondContact OH-CB 3.32Å; Y138-R196 PolarHBondContact OH-O 3.37Å; L194-R196 VanDerWaalsContact C-N 3.27Å; L194-R196 PolarHBondContact O-N 2.89Å; R196-I198 PolarHBondContact O-N 3.24Å | ||
| 197 | P | 82.4 | Confident | 71 | Confident | 94 Ų | 94 | 80.1 Ų | 80.1 | 61% | 0.61 | 46% | 0.457 | S | S | * | . | trans | -66.6 | 133 | 178.4 | 27.1 | -33.1 | 0 | 0 | 0 | 110.1 | M195 | M195-P197 WeakPolarHBondContact O-CD 3.11Š| ||
| 198 | I | 79 | Confident | 68.2 | Low | 66 Ų | 66 | 82.6 Ų | 82.6 | 34% | 0.338 | 47% | 0.47 | S | S | . | . | trans | -121.1 | 146.6 | 171.1 | -38.9 | 178.7 | 0 | 0 | 0 | 108.6 | Y11 P14 Y138 R196 | Y11-I198 HydrophobicContact CE2-CB 4.17Å; Y11-I198 HydrophobicContact CE2-CG2 3.48Å; Y11-I198 VanDerWaalsContact CE2-CG2 3.48Å; Y11-I198 WeakPolarHBondContact OH-CB 3.43Å; Y11-I198 WeakPolarHBondContact OH-CG2 3.27Å; P14-I198 HydrophobicContact CG-CD1 3.97Å; Y138-I198 HydrophobicContact CD1-CD1 3.66Å; Y138-I198 HydrophobicContact CD2-CD1 4.02Å; Y138-I198 HydrophobicContact CE1-CD1 3.15Å; Y138-I198 HydrophobicContact CE1-CG1 4.11Å; Y138-I198 HydrophobicContact CE2-CD1 3.48Å; Y138-I198 VanDerWaalsContact CE2-CD1 3.48Å; Y138-I198 HydrophobicContact CE2-CG1 3.69Å; Y138-I198 HydrophobicContact CG-CD1 4.11Å; Y138-I198 VanDerWaalsContact CZ-CG1 3.48Å; Y138-I198 VanDerWaalsContact OH-CD1 3.31Å; Y138-I198 WeakPolarHBondContact OH-CD1 3.35Å; Y138-I198 WeakPolarHBondContact OH-CG1 3.43Å; R196-I198 PolarHBondContact O-N 3.24Å | ||
| 199 | G | 67.1 | Low | 65.6 | Low | 40 Ų | 40 | 91.3 Ų | 91.3 | 41% | 0.412 | 51% | 0.508 | S | S | . | . | S | Bend | trans | 112.9 | 166.9 | -177.3 | 0 | 0 | 0 | 0 | 0 | 112 | K201 | G199-K201 PolarHBondContact O-N 2.93Š|
| 200 | P | 54.1 | Low | 62.9 | Low | 115 Ų | 115 | 93.1 Ų | 93.1 | 75% | 0.747 | 52% | 0.521 | S | S | * | . | S | Bend | trans | -55.5 | 133 | 174 | -19.1 | 29.8 | 0 | 0 | 0 | 109.8 | ||
| 201 | K | 48.7 | Very low | 60.1 | Low | 190 Ų | 190 | 96.6 Ų | 96.6 | 83% | 0.826 | 53% | 0.529 | S | S | * | . | trans | -53 | 132.1 | 171.7 | -71.8 | 178.1 | -178.6 | 173.2 | 0 | 107.7 | G199 T203 | G199-K201 PolarHBondContact O-N 2.93Å; K201-T203 PolarHBondContact O-N 3.04Å | ||
| 202 | P | 48.5 | Very low | 57.4 | Low | 108 Ų | 108 | 99.7 Ų | 99.7 | 70% | 0.701 | 55% | 0.554 | S | S | * | * | trans | -52.9 | 114 | 177.2 | 18.5 | -28.9 | 0 | 0 | 0 | 108.3 | K204 | P202-K204 PolarHBondContact O-N 2.75Å; P202-K204 VanDerWaalsContact O-N 3.12Å | ||
| 203 | T | 35.8 | Very low | 54.7 | Low | 122 Ų | 122 | 103.2 Ų | 103.2 | 75% | 0.748 | 58% | 0.578 | S | S | * | * | trans | -62.6 | 117.5 | -163.6 | -24.4 | 0 | 0 | 0 | 0 | 109.2 | K201 A205 | K201-T203 PolarHBondContact O-N 3.04Å; T203-A205 HydrophobicContact CG2-CB 3.75Å; T203-A205 PolarHBondContact O-N 3.37Å | ||
| 204 | K | 38.8 | Very low | 52.1 | Low | 177 Ų | 177 | 106.8 Ų | 106.8 | 77% | 0.77 | 59% | 0.59 | S | S | * | * | trans | -70.4 | 39.6 | 164.1 | -70 | -176.6 | 178.8 | 176.2 | 0 | 111.2 | P202 G206 K207 | P202-K204 PolarHBondContact O-N 2.75Å; P202-K204 VanDerWaalsContact O-N 3.12Å; K204-G206 PolarHBondContact O-N 3.24Å; K204-K207 PolarHBondContact O-N 3.26Å | ||
| 205 | A | 35.9 | Very low | 49.4 | Very low | 82 Ų | 82 | 112.7 Ų | 112.7 | 68% | 0.678 | 62% | 0.616 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -68.4 | 15.7 | -173.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | T203 | T203-A205 HydrophobicContact CG2-CB 3.75Å; T203-A205 PolarHBondContact O-N 3.37Å |
| 206 | G | 36.4 | Very low | 46.8 | Very low | 51 Ų | 51 | 121.5 Ų | 121.5 | 53% | 0.526 | 65% | 0.654 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -116.9 | -8.3 | 177.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | K204 | K204-G206 PolarHBondContact O-N 3.24Š|
| 207 | K | 38.3 | Very low | 44.3 | Very low | 164 Ų | 164 | 117.8 Ų | 117.8 | 71% | 0.713 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -102.9 | -28.7 | -173.8 | -80.6 | -171.8 | 172.8 | -174.5 | 0 | 114.9 | K204 | K204-K207 PolarHBondContact O-N 3.26Š|
| 208 | D | 35.2 | Very low | 41.9 | Very low | 136 Ų | 136 | 116.6 Ų | 116.6 | 73% | 0.727 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -81.2 | -24.4 | -177.1 | -71.3 | -29.7 | 0 | 0 | 0 | 114 | S210 | D208-S210 VanDerWaalsContact C-N 3.31Å; D208-S210 PolarHBondContact O-N 3.26Å |
| 209 | K | 38 | Very low | 39.7 | Very low | 182 Ų | 182 | 122.6 Ų | 122.6 | 79% | 0.791 | 69% | 0.688 | S | S | * | * | H | α-helix | trans | -73 | -22 | 172.9 | -72.6 | -168.6 | 176.9 | -174.4 | 0 | 113.5 | S213 | K209-S213 PolarHBondContact O-N 2.93Å; K209-S213 PolarHBondContact O-OG 3.38Å |
| 210 | S | 36.9 | Very low | 37.9 | Very low | 60 Ų | 60 | 127.1 Ų | 127.1 | 42% | 0.42 | 71% | 0.713 | S | S | . | * | H | α-helix | trans | -79 | -37 | -177.9 | -179.6 | 0 | 0 | 0 | 0 | 112.4 | D208 S213 L214 | D208-S210 VanDerWaalsContact C-N 3.31Å; D208-S210 PolarHBondContact O-N 3.26Å; S210-S213 WeakPolarHBondContact CA-OG 3.41Å; S210-S213 PolarHBondContact O-N 2.87Å; S210-S213 PolarHBondContact O-OG 3.46Å; S210-L214 WeakPolarHBondContact O-CB 3.27Å; S210-L214 WeakPolarHBondContact O-CD1 3.33Å; S210-L214 PolarHBondContact O-N 3.2Å; S210-L214 VanDerWaalsContact O-N 3.16Å |
| 211 | K | 35.6 | Very low | 36.5 | Very low | 166 Ų | 166 | 125.1 Ų | 125.1 | 72% | 0.722 | 71% | 0.713 | S | S | * | * | H | α-helix | trans | -70.8 | -35.2 | 177.2 | -78.6 | -171.1 | 173 | -172.2 | 0 | 113.1 | ||
| 212 | A | 36.1 | Very low | 35.4 | Very low | 66 Ų | 66 | 122.5 Ų | 122.5 | 55% | 0.545 | 71% | 0.713 | S | S | . | * | H | α-helix | trans | -72.5 | -26.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||
| 213 | S | 36.9 | Very low | 34.4 | Very low | 74 Ų | 74 | 126.7 Ų | 126.7 | 52% | 0.517 | 72% | 0.72 | S | S | . | * | H | α-helix | trans | -86.6 | -28 | 178.7 | 41.4 | 0 | 0 | 0 | 0 | 113.2 | K209 S210 | K209-S213 PolarHBondContact O-N 2.93Å; K209-S213 PolarHBondContact O-OG 3.38Å; S210-S213 WeakPolarHBondContact CA-OG 3.41Å; S210-S213 PolarHBondContact O-N 2.87Å; S210-S213 PolarHBondContact O-OG 3.46Å |
| 214 | L | 39.3 | Very low | 33.9 | Very low | 130 Ų | 130 | 131.1 Ų | 131.1 | 68% | 0.681 | 73% | 0.729 | S | S | * | * | H | α-helix | trans | -75.4 | -21 | 175.4 | -91.2 | 147.2 | 0 | 0 | 0 | 114 | S210 | S210-L214 WeakPolarHBondContact O-CB 3.27Å; S210-L214 WeakPolarHBondContact O-CD1 3.33Å; S210-L214 PolarHBondContact O-N 3.2Å; S210-L214 VanDerWaalsContact O-N 3.16Å |
| 215 | Q | 36.5 | Very low | 33.1 | Very low | 176 Ų | 176 | 126.5 Ų | 126.5 | 82% | 0.822 | 73% | 0.731 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -85.9 | -17.8 | -179.1 | -138.5 | 172.9 | 14.6 | 0 | 0 | 113.5 | ||
| 216 | K | 35.8 | Very low | 32.7 | Very low | 186 Ų | 186 | 130.1 Ų | 130.1 | 81% | 0.809 | 74% | 0.738 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94 | -11.5 | 178.7 | -79.3 | -171.8 | 174.7 | -174.7 | 0 | 114.5 | ||
| 217 | A | 34.6 | Very low | 32.2 | Very low | 88 Ų | 88 | 135.4 Ų | 135.4 | 73% | 0.727 | 75% | 0.749 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.7 | 4.4 | -177.7 | 0 | 0 | 0 | 0 | 0 | 114.6 | ||
| 218 | G | 32.8 | Very low | 31.6 | Very low | 70 Ų | 70 | 134.1 Ų | 134.1 | 72% | 0.722 | 75% | 0.75 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -99.8 | 6.8 | -175.2 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||
| 219 | K | 32.9 | Very low | 31.2 | Very low | 192 Ų | 192 | 132.2 Ų | 132.2 | 84% | 0.835 | 75% | 0.753 | S | S | * | * | S | Bend | trans | -141.2 | 132.8 | 179.7 | -73.1 | -176 | 175.2 | -178.8 | 0 | 111 | ||
| 220 | S | 27.9 | Very low | 30.7 | Very low | 134 Ų | 134 | 131 Ų | 131 | 94% | 0.937 | 76% | 0.756 | S | S | * | * | trans | 73.4 | 126 | -168.2 | -66.7 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 221 | G | 25.7 | Very low | 30.3 | Very low | 73 Ų | 73 | 134 Ų | 134 | 75% | 0.753 | 77% | 0.771 | S | S | * | * | cis | 146.6 | 106.4 | 11.3 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 222 | V | 26.4 | Very low | 30.1 | Very low | 136 Ų | 136 | 132.3 Ų | 132.3 | 82% | 0.824 | 77% | 0.77 | S | S | * | * | trans | 0.5 | 118.1 | 152.7 | -177.3 | 0 | 0 | 0 | 0 | 118.3 | ||||
| 223 | K | 25.6 | Very low | 29.9 | Very low | 196 Ų | 196 | 137.5 Ų | 137.5 | 85% | 0.852 | 79% | 0.788 | S | S | * | * | 167.9 | 139.7 | 119.3 | -96.6 | 176 | -177.4 | 177.4 | 0 | 115 | |||||
| 224 | K | 25.5 | Very low | 29.9 | Very low | 214 Ų | 214 | 141.6 Ų | 141.6 | 93% | 0.93 | 80% | 0.802 | S | S | * | * | trans | -11.3 | 150.4 | 158.5 | -74.2 | 174.7 | 169.8 | -179.3 | 0 | 120.2 | ||||
| 225 | G | 23.5 | Very low | 29.4 | Very low | 80 Ų | 80 | 138.5 Ų | 138.5 | 83% | 0.825 | 80% | 0.801 | S | S | * | * | trans | 142.1 | 127.2 | 132.9 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 226 | L | 26.8 | Very low | 29.1 | Very low | 158 Ų | 158 | 141.2 Ų | 141.2 | 83% | 0.827 | 80% | 0.804 | S | S | * | * | trans | -70.5 | 137.5 | 179.7 | -162.5 | 80.1 | 0 | 0 | 0 | 112.8 | ||||
| 227 | H | 25 | Very low | 28.8 | Very low | 162 Ų | 162 | 140.5 Ų | 140.5 | 75% | 0.75 | 80% | 0.803 | S | S | * | * | 172.6 | 147.1 | 128 | -105.6 | -76.7 | 0 | 0 | 0 | 114.1 | |||||
| 228 | D | 26.1 | Very low | 28.8 | Very low | 137 Ų | 137 | 142.1 Ų | 142.1 | 73% | 0.733 | 81% | 0.806 | S | S | * | * | trans | -16.4 | 150.7 | 168.9 | -56.2 | -46.9 | 0 | 0 | 0 | 122.2 | ||||
| 229 | A | 26.6 | Very low | 28.8 | Very low | 96 Ų | 96 | 148.1 Ų | 148.1 | 79% | 0.793 | 81% | 0.812 | S | S | * | * | 137.1 | 131.5 | 123.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | |||||
| 230 | N | 28 | Very low | 29.3 | Very low | 158 Ų | 158 | 150.4 Ų | 150.4 | 85% | 0.845 | 82% | 0.816 | S | S | * | * | trans | -47.8 | 148.6 | 177.4 | -63.7 | -52.9 | 0 | 0 | 0 | 113.9 | ||||
| 231 | T | 27.8 | Very low | 29.9 | Very low | 121 Ų | 121 | 151.7 Ų | 151.7 | 74% | 0.742 | 81% | 0.807 | S | S | * | * | 161.4 | 124 | 107 | -57 | 0 | 0 | 0 | 0 | 109.9 | |||||
| 232 | D | 32.1 | Very low | 30.8 | Very low | 132 Ų | 132 | 158.2 Ų | 158.2 | 71% | 0.706 | 82% | 0.815 | S | S | * | * | trans | 26.2 | 124 | 154.8 | -58.7 | -38.5 | 0 | 0 | 0 | 121.4 | ||||
| 233 | L | 32.7 | Very low | 31.8 | Very low | 175 Ų | 175 | 159.4 Ų | 159.4 | 92% | 0.916 | 81% | 0.805 | S | S | * | * | -165.2 | 105.6 | 122.8 | -98.1 | 161.8 | 0 | 0 | 0 | 108.8 | G235 | L233-G235 VanDerWaalsContact C-N 3.34Å; L233-G235 PolarHBondContact O-N 2.88Å | |||
| 234 | I | 36.2 | Very low | 33 | Very low | 160 Ų | 160 | 153.2 Ų | 153.2 | 82% | 0.821 | 79% | 0.786 | S | S | * | * | trans | -68.8 | 87.9 | 178.2 | -62.7 | 171.3 | 0 | 0 | 0 | 109.1 | ||||
| 235 | G | 29.1 | Very low | 34.5 | Very low | 64 Ų | 64 | 148.2 Ų | 148.2 | 66% | 0.66 | 77% | 0.773 | S | S | * | * | trans | -104 | 72.6 | 165.1 | 0 | 0 | 0 | 0 | 0 | 110.2 | L233 H237 | L233-G235 VanDerWaalsContact C-N 3.34Å; L233-G235 PolarHBondContact O-N 2.88Å; G235-H237 PolarHBondContact O-N 3.02Å | ||
| 236 | R | 29.5 | Very low | 35.7 | Very low | 233 Ų | 233 | 151 Ų | 151 | 88% | 0.879 | 76% | 0.763 | S | S | * | * | trans | -72.9 | 91.2 | -179.2 | -153.2 | -179.4 | -160.6 | -177 | 5.7 | 109.7 | ||||
| 237 | H | 30.2 | Very low | 37.1 | Very low | 172 Ų | 172 | 148.9 Ų | 148.9 | 80% | 0.796 | 75% | 0.749 | S | S | * | * | trans | -54.4 | 127.3 | 161.6 | -81.5 | -75 | 0 | 0 | 0 | 109.2 | G235 K239 | G235-H237 PolarHBondContact O-N 3.02Å; H237-K239 PolarHBondContact O-N 3.44Å | ||
| 238 | P | 34.9 | Very low | 38.5 | Very low | 121 Ų | 121 | 143.6 Ų | 143.6 | 79% | 0.786 | 73% | 0.728 | S | S | * | * | trans | -69.5 | 111.5 | 175.2 | 26.5 | -29.7 | 0 | 0 | 0 | 108.3 | R240 | P238-R240 PolarHBondContact O-N 3.33Å; P238-R240 VanDerWaalsContact O-N 3.17Å | ||
| 239 | K | 31.7 | Very low | 40 | Very low | 196 Ų | 196 | 140.9 Ų | 140.9 | 85% | 0.852 | 71% | 0.712 | S | S | * | * | trans | -53.4 | 120.5 | 165.8 | -79.3 | 179.6 | 177.1 | 177.1 | 0 | 107.3 | H237 E241 | H237-K239 PolarHBondContact O-N 3.44Å; K239-E241 PolarHBondContact O-N 3.47Å | ||
| 240 | R | 43.5 | Very low | 41.5 | Very low | 240 Ų | 240 | 139.9 Ų | 139.9 | 91% | 0.906 | 69% | 0.694 | S | S | * | * | trans | -66.1 | 87.1 | 167.8 | -116.1 | -179.6 | 177.3 | 178.1 | -0.2 | 107.4 | P238 K242 | P238-R240 PolarHBondContact O-N 3.33Å; P238-R240 VanDerWaalsContact O-N 3.17Å; R240-K242 PolarHBondContact O-N 3.19Å | ||
| 241 | E | 40.5 | Very low | 43 | Very low | 161 Ų | 161 | 138 Ų | 138 | 75% | 0.752 | 68% | 0.68 | S | S | * | * | trans | -58.5 | 133.1 | 169.5 | -81.4 | -179.4 | 158 | 0 | 0 | 108.9 | K239 R243 | K239-E241 PolarHBondContact O-N 3.47Å; E241-R243 VanDerWaalsContact C-N 3.34Å; E241-R243 PolarHBondContact O-N 3.43Å | ||
| 242 | K | 45 | Very low | 44.4 | Very low | 211 Ų | 211 | 136.5 Ų | 136.5 | 92% | 0.917 | 66% | 0.663 | S | S | * | * | trans | -64.1 | 99.6 | 170.3 | -71 | -180 | -179.7 | 177.5 | 0 | 106.7 | R240 S244 | R240-K242 PolarHBondContact O-N 3.19Å; K242-S244 PolarHBondContact O-N 3.4Å | ||
| 243 | R | 47.9 | Very low | 46.1 | Very low | 161 Ų | 161 | 131.5 Ų | 131.5 | 61% | 0.608 | 64% | 0.636 | S | S | * | * | trans | -54 | 132.2 | 179.4 | -68.2 | -178.7 | 178.7 | -176.1 | -2.7 | 109.8 | E241 | E241-R243 VanDerWaalsContact C-N 3.34Å; E241-R243 PolarHBondContact O-N 3.43Å | ||
| 244 | S | 50.4 | Low | 48.2 | Very low | 65 Ų | 65 | 124.9 Ų | 124.9 | 46% | 0.455 | 60% | 0.602 | S | S | . | * | trans | -60.5 | 147.8 | 173.8 | 174.3 | 0 | 0 | 0 | 0 | 110.1 | K242 F246 Q247 T248 | K242-S244 PolarHBondContact O-N 3.4Å; S244-F246 PolarHBondContact O-N 3.29Å; S244-F246 VanDerWaalsContact O-N 3.14Å; S244-F246 PolarHBondContact OG-N 3.26Å; S244-Q247 PolarHBondContact O-N 2.89Å; S244-T248 PolarHBondContact O-N 3.37Å; S244-T248 PolarHBondContact O-OG1 3.21Å | ||
| 245 | V | 57.9 | Low | 50.3 | Low | 109 Ų | 109 | 120.4 Ų | 120.4 | 66% | 0.661 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -52.2 | -36.2 | 173.5 | 177.6 | 0 | 0 | 0 | 0 | 110 | T248 I249 | V245-T248 WeakPolarHBondContact O-CB 3.48Å; V245-T248 PolarHBondContact O-N 3.04Å; V245-I249 HydrophobicContact CG1-CD1 3.82Å; V245-I249 HydrophobicContact CG1-CG1 4.39Å; V245-I249 VanDerWaalsContact O-CG1 3.25Å; V245-I249 WeakPolarHBondContact O-CG1 3.47Å; V245-I249 PolarHBondContact O-N 3.33Å |
| 246 | F | 48.6 | Very low | 52.9 | Low | 140 Ų | 140 | 120.6 Ų | 120.6 | 61% | 0.614 | 57% | 0.567 | S | S | * | * | H | α-helix | trans | -67 | -38.7 | 177.2 | -157.1 | -94.2 | 0 | 0 | 0 | 113.5 | S244 T248 I249 N250 | S244-F246 PolarHBondContact O-N 3.29Å; S244-F246 VanDerWaalsContact O-N 3.14Å; S244-F246 PolarHBondContact OG-N 3.26Å; F246-T248 VanDerWaalsContact C-N 3.31Å; F246-I249 PolarHBondContact O-N 3.48Å; F246-N250 VanDerWaalsContact O-CB 3.32Å; F246-N250 WeakPolarHBondContact O-CB 3.48Å; F246-N250 PolarHBondContact O-N 3.01Å |
| 247 | Q | 55.3 | Low | 55.6 | Low | 113 Ų | 113 | 109.6 Ų | 109.6 | 53% | 0.528 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -69.3 | -32.2 | 173.6 | -79.6 | 174.1 | -23.3 | 0 | 0 | 111.9 | S244 Q251 | S244-Q247 PolarHBondContact O-N 2.89Å; Q247-Q251 VanDerWaalsContact O-CB 3.32Å; Q247-Q251 WeakPolarHBondContact O-CB 3.47Å; Q247-Q251 PolarHBondContact O-N 3.25Å |
| 248 | T | 54.7 | Low | 58.4 | Low | 51 Ų | 51 | 105.1 Ų | 105.1 | 31% | 0.313 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -68.9 | -44.5 | 173.8 | -52.5 | 0 | 0 | 0 | 0 | 110.1 | S244 V245 F246 Q251 F252 | S244-T248 PolarHBondContact O-N 3.37Å; S244-T248 PolarHBondContact O-OG1 3.21Å; V245-T248 WeakPolarHBondContact O-CB 3.48Å; V245-T248 PolarHBondContact O-N 3.04Å; F246-T248 VanDerWaalsContact C-N 3.31Å; T248-Q251 WeakPolarHBondContact O-CB 3.29Å; T248-Q251 PolarHBondContact O-N 3.05Å; T248-F252 HydrophobicContact CG2-CD2 4Å; T248-F252 HydrophobicContact CG2-CE2 3.76Å; T248-F252 WeakPolarHBondContact O-CD2 3.41Å; T248-F252 PolarHBondContact O-N 3.31Å |
| 249 | I | 57.7 | Low | 60.8 | Low | 79 Ų | 79 | 104.9 Ų | 104.9 | 41% | 0.405 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -61.8 | -46.6 | 175.3 | -69 | 167.6 | 0 | 0 | 0 | 110.9 | V245 F246 Q251 F252 L253 | V245-I249 HydrophobicContact CG1-CD1 3.82Å; V245-I249 HydrophobicContact CG1-CG1 4.39Å; V245-I249 VanDerWaalsContact O-CG1 3.25Å; V245-I249 WeakPolarHBondContact O-CG1 3.47Å; V245-I249 PolarHBondContact O-N 3.33Å; F246-I249 PolarHBondContact O-N 3.48Å; I249-Q251 PolarHBondContact O-N 3.25Å; I249-F252 CarbonylContact O-C 3.54Å; I249-F252 PolarHBondContact O-N 3.03Å; I249-L253 HydrophobicContact CG2-CD1 3.99Å; I249-L253 WeakPolarHBondContact O-CB 3.44Å; I249-L253 PolarHBondContact O-N 2.98Å |
| 250 | N | 56.7 | Low | 63.6 | Low | 76 Ų | 76 | 99.4 Ų | 99.4 | 41% | 0.406 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -66.9 | -24.4 | 178.4 | -161.6 | 37.1 | 0 | 0 | 0 | 113 | F246 | F246-N250 VanDerWaalsContact O-CB 3.32Å; F246-N250 WeakPolarHBondContact O-CB 3.48Å; F246-N250 PolarHBondContact O-N 3.01Å |
| 251 | Q | 59.6 | Low | 65.8 | Low | 118 Ų | 118 | 94.3 Ų | 94.3 | 55% | 0.551 | 46% | 0.459 | S | S | * | . | H | α-helix | trans | -73.1 | -28.2 | 172.5 | -167.4 | -178.8 | -0.7 | 0 | 0 | 112.2 | Q247 T248 I249 | Q247-Q251 VanDerWaalsContact O-CB 3.32Å; Q247-Q251 WeakPolarHBondContact O-CB 3.47Å; Q247-Q251 PolarHBondContact O-N 3.25Å; T248-Q251 WeakPolarHBondContact O-CB 3.29Å; T248-Q251 PolarHBondContact O-N 3.05Å; I249-Q251 PolarHBondContact O-N 3.25Å |
| 252 | F | 58.8 | Low | 68.2 | Low | 89 Ų | 89 | 86.7 Ų | 86.7 | 39% | 0.39 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -98.4 | -28.6 | -179.9 | -73.4 | -68 | 0 | 0 | 0 | 113.8 | T248 I249 | T248-F252 HydrophobicContact CG2-CD2 4Å; T248-F252 HydrophobicContact CG2-CE2 3.76Å; T248-F252 WeakPolarHBondContact O-CD2 3.41Å; T248-F252 PolarHBondContact O-N 3.31Å; I249-F252 CarbonylContact O-C 3.54Å; I249-F252 PolarHBondContact O-N 3.03Å |
| 253 | L | 66.9 | Low | 70.5 | Confident | 27 Ų | 27 | 76.6 Ų | 76.6 | 14% | 0.141 | 38% | 0.38 | C | S | . | . | S | Bend | trans | -118.4 | 94.1 | 178.1 | -62.2 | 178.4 | 0 | 0 | 0 | 107 | I249 L255 L393 I396 | I249-L253 HydrophobicContact CG2-CD1 3.99Å; I249-L253 WeakPolarHBondContact O-CB 3.44Å; I249-L253 PolarHBondContact O-N 2.98Å; L253-L255 VanDerWaalsContact C-N 3.3Å; L253-L255 PolarHBondContact O-N 2.83Å; L253-L393 HydrophobicContact CB-CD2 3.89Å; L253-L393 HydrophobicContact CB-CG 4.26Å; L253-L393 HydrophobicContact CD1-CD2 4.25Å; L253-L393 HydrophobicContact CD2-CD2 4.04Å; L253-L393 HydrophobicContact CD2-CG 4.05Å; L253-L393 HydrophobicContact CG-CD2 4.28Å; L253-I396 HydrophobicContact CD1-CD1 3.69Å; L253-I396 HydrophobicContact CD2-CD1 3.94Å; L253-I396 HydrophobicContact CG-CD1 4.5Å |
| 254 | D | 76.2 | Confident | 72.7 | Confident | 37 Ų | 37 | 72.5 Ų | 72.5 | 20% | 0.198 | 37% | 0.37 | C | S | . | . | trans | -65.4 | 87.6 | 178.2 | 179.1 | 8.2 | 0 | 0 | 0 | 110.1 | T256 L257 R386 | D254-T256 VanDerWaalsContact CG-OG1 3.27Å; D254-T256 PolarHBondContact O-N 3.44Å; D254-T256 VanDerWaalsContact OD1-CB 3.3Å; D254-T256 WeakPolarHBondContact OD1-CB 3.45Å; D254-T256 WeakPolarHBondContact OD1-CG2 3.39Å; D254-T256 PolarHBondContact OD1-N 3.13Å; D254-T256 PolarHBondContact OD1-OG1 3.2Å; D254-T256 PolarHBondContact OD2-OG1 2.98Å; D254-L257 HydrophobicContact CB-CD1 4.07Å; D254-L257 WeakPolarHBondContact O-CB 3.3Å; D254-L257 WeakPolarHBondContact O-CD1 3.15Å; D254-L257 WeakPolarHBondContact O-CG 3.29Å; D254-L257 PolarHBondContact O-N 3.31Å; D254-R386 IonicContact OD2-NE 3.84Å; D254-R386 IonicContact OD2-NH1 3.99Å | ||
| 255 | L | 80.2 | Confident | 74.8 | Confident | 65 Ų | 65 | 71.3 Ų | 71.3 | 34% | 0.34 | 36% | 0.358 | S | S | . | . | G | 310 helix | trans | -63.1 | -13.3 | -176.8 | -64.3 | 178.8 | 0 | 0 | 0 | 112.8 | L253 L257 F258 L393 | L253-L255 VanDerWaalsContact C-N 3.3Å; L253-L255 PolarHBondContact O-N 2.83Å; L255-L257 PolarHBondContact O-N 3.21Å; L255-F258 HydrophobicContact CD2-CD2 4.11Å; L255-F258 HydrophobicContact CD2-CE2 3.83Å; L255-F258 PolarHBondContact O-N 3.31Å; L255-F258 VanDerWaalsContact O-N 3.13Å; L255-L393 HydrophobicContact CD2-CD2 4.14Å |
| 256 | T | 84.4 | Confident | 76.5 | Confident | 68 Ų | 68 | 66.2 Ų | 66.2 | 42% | 0.417 | 33% | 0.327 | S | S | . | . | G | 310 helix | trans | -62.9 | -19.9 | 173 | 76 | 0 | 0 | 0 | 0 | 111.9 | D254 F258 T259 R386 | D254-T256 VanDerWaalsContact CG-OG1 3.27Å; D254-T256 PolarHBondContact O-N 3.44Å; D254-T256 VanDerWaalsContact OD1-CB 3.3Å; D254-T256 WeakPolarHBondContact OD1-CB 3.45Å; D254-T256 WeakPolarHBondContact OD1-CG2 3.39Å; D254-T256 PolarHBondContact OD1-N 3.13Å; D254-T256 PolarHBondContact OD1-OG1 3.2Å; D254-T256 PolarHBondContact OD2-OG1 2.98Å; T256-F258 PolarHBondContact O-N 3.44Å; T256-T259 WeakPolarHBondContact O-CB 3.15Å; T256-T259 PolarHBondContact O-N 2.91Å; T256-T259 PolarHBondContact O-OG1 3.29Å; T256-R386 PolarHBondContact OG1-NH1 2.88Å |
| 257 | L | 85.6 | Confident | 78.8 | Confident | 3 Ų | 3 | 60.1 Ų | 60.1 | 2% | 0.016 | 30% | 0.301 | C | S | . | . | G | 310 helix | trans | -57.7 | -29.6 | 172.8 | -79.6 | 156.3 | 0 | 0 | 0 | 113.3 | D254 L255 T259 H260 F263 V382 R386 A390 L393 | D254-L257 HydrophobicContact CB-CD1 4.07Å; D254-L257 WeakPolarHBondContact O-CB 3.3Å; D254-L257 WeakPolarHBondContact O-CD1 3.15Å; D254-L257 WeakPolarHBondContact O-CG 3.29Å; D254-L257 PolarHBondContact O-N 3.31Å; L255-L257 PolarHBondContact O-N 3.21Å; L257-T259 PolarHBondContact O-N 3.01Å; L257-H260 WeakPolarHBondContact O-CB 3.49Å; L257-H260 PolarHBondContact O-N 3.25Å; L257-F263 HydrophobicContact CB-CD1 3.97Å; L257-F263 HydrophobicContact CB-CE1 3.97Å; L257-F263 HydrophobicContact CB-CG 4.41Å; L257-F263 HydrophobicContact CB-CZ 4.41Å; L257-F263 HydrophobicContact CD2-CD2 4.41Å; L257-F263 HydrophobicContact CD2-CG 4.39Å; L257-F263 VanDerWaalsContact O-CD1 3.23Å; L257-F263 WeakPolarHBondContact O-CD1 3.17Å; L257-V382 HydrophobicContact CD2-CB 4.48Å; L257-V382 HydrophobicContact CD2-CG1 3.46Å; L257-V382 VanDerWaalsContact CD2-CG1 3.46Å; L257-V382 HydrophobicContact CD2-CG2 4.16Å; L257-R386 HydrophobicContact CD2-CB 4.49Å; L257-A390 HydrophobicContact CD1-CB 3.98Å; L257-A390 HydrophobicContact CD2-CB 4.25Å; L257-L393 HydrophobicContact CB-CD1 4.06Å; L257-L393 HydrophobicContact CD1-CD1 3.88Å |
| 258 | F | 89.1 | Confident | 80.7 | Confident | 77 Ų | 77 | 56.6 Ų | 56.6 | 34% | 0.338 | 29% | 0.288 | S | S | . | . | G | 310 helix | trans | -69.1 | -8.3 | 174.9 | -70.9 | -73.2 | 0 | 0 | 0 | 113.8 | L255 T256 F263 L264 L267 L393 | L255-F258 HydrophobicContact CD2-CD2 4.11Å; L255-F258 HydrophobicContact CD2-CE2 3.83Å; L255-F258 PolarHBondContact O-N 3.31Å; L255-F258 VanDerWaalsContact O-N 3.13Å; T256-F258 PolarHBondContact O-N 3.44Å; F258-F263 HydrophobicContact CD1-CE1 4.41Å; F258-F263 HydrophobicContact CE1-CE1 4.39Å; F258-L264 HydrophobicContact CB-CD2 4.39Å; F258-L264 HydrophobicContact CD1-CD2 3.87Å; F258-L264 VanDerWaalsContact O-CD1 3.26Å; F258-L264 WeakPolarHBondContact O-CD1 3.5Å; F258-L264 WeakPolarHBondContact O-CD2 3.25Å; F258-L264 WeakPolarHBondContact O-CG 3.26Å; F258-L267 HydrophobicContact CD1-CD2 4.35Å; F258-L267 HydrophobicContact CE1-CD2 3.57Å; F258-L267 HydrophobicContact CZ-CD2 4.39Å; F258-L393 HydrophobicContact CE2-CD1 4.12Å; F258-L393 HydrophobicContact CE2-CD2 3.85Å; F258-L393 HydrophobicContact CZ-CD2 4.2Å |
| 259 | T | 86.9 | Confident | 82.6 | Confident | 117 Ų | 117 | 54.1 Ų | 54.1 | 72% | 0.718 | 27% | 0.274 | S | S | * | . | G | 310 helix | trans | -89.1 | -14.5 | 170.2 | 68.4 | 0 | 0 | 0 | 0 | 112.6 | T256 L257 R261 | T256-T259 WeakPolarHBondContact O-CB 3.15Å; T256-T259 PolarHBondContact O-N 2.91Å; T256-T259 PolarHBondContact O-OG1 3.29Å; L257-T259 PolarHBondContact O-N 3.01Å; T259-R261 PolarHBondContact O-N 3.49Å |
| 260 | H | 88.9 | Confident | 84.4 | Confident | 80 Ų | 80 | 50.4 Ų | 50.4 | 37% | 0.37 | 25% | 0.254 | S | S | . | . | trans | -80.5 | 112.7 | -178.4 | -170.8 | -97.7 | 0 | 0 | 0 | 110.6 | L257 G262 F263 L264 L381 | L257-H260 WeakPolarHBondContact O-CB 3.49Å; L257-H260 PolarHBondContact O-N 3.25Å; H260-G262 VanDerWaalsContact C-N 3.33Å; H260-G262 PolarHBondContact O-N 2.82Å; H260-F263 HydrophobicContact CB-CB 3.97Å; H260-F263 PolarHBondContact ND1-N 3.35Å; H260-F263 WeakPolarHBondContact O-CB 3.47Å; H260-F263 PolarHBondContact O-N 2.92Å; H260-L264 PolarHBondContact O-N 2.89Å; H260-L381 PolarHBondContact CE1-O 3.35Å; H260-L381 VanDerWaalsContact CE1-O 3.25Å | ||
| 261 | R | 90.6 | Very high | 86.3 | Confident | 133 Ų | 133 | 48.5 Ų | 48.5 | 50% | 0.502 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -53.4 | -47.5 | -174.5 | -61.5 | 179.5 | -174 | 153.3 | 3.6 | 113 | T259 F263 L264 L265 E451 | T259-R261 PolarHBondContact O-N 3.49Å; R261-F263 VanDerWaalsContact C-N 3.34Å; R261-F263 PolarHBondContact O-N 2.97Å; R261-L264 PolarHBondContact O-N 2.84Å; R261-L265 WeakPolarHBondContact O-CG 3.29Å; R261-L265 PolarHBondContact O-N 3.43Å; R261-L265 VanDerWaalsContact O-N 3.13Å; R261-E451 IonicContact CZ-OE1 2.74Å; R261-E451 IonicContact NH1-OE1 2.67Å; R261-E451 PolarHBondContact NH1-OE1 3.15Å; R261-E451 IonicContact NH2-OE1 2.78Å |
| 262 | G | 90.8 | Very high | 88 | Confident | 1 Ų | 1 | 45.9 Ų | 45.9 | 1% | 0.01 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -61.9 | -42.8 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | H260 L264 L265 Y266 L381 | H260-G262 VanDerWaalsContact C-N 3.33Å; H260-G262 PolarHBondContact O-N 2.82Å; G262-L264 VanDerWaalsContact C-N 3.34Å; G262-L264 PolarHBondContact O-N 2.89Å; G262-L265 PolarHBondContact O-N 3.49Å; G262-Y266 WeakPolarHBondContact O-CB 3.5Å; G262-Y266 PolarHBondContact O-N 3.43Å; G262-L381 VanDerWaalsContact O-CD2 3.22Å; G262-L381 WeakPolarHBondContact O-CD2 3.22Å |
| 263 | F | 93 | Very high | 89.8 | Confident | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -64.2 | -41.3 | -179.4 | 177 | -101.6 | 0 | 0 | 0 | 111.3 | L257 F258 H260 R261 Y266 L267 L378 V382 A390 L393 V394 | L257-F263 HydrophobicContact CB-CD1 3.97Å; L257-F263 HydrophobicContact CB-CE1 3.97Å; L257-F263 HydrophobicContact CB-CG 4.41Å; L257-F263 HydrophobicContact CB-CZ 4.41Å; L257-F263 HydrophobicContact CD2-CD2 4.41Å; L257-F263 HydrophobicContact CD2-CG 4.39Å; L257-F263 VanDerWaalsContact O-CD1 3.23Å; L257-F263 WeakPolarHBondContact O-CD1 3.17Å; F258-F263 HydrophobicContact CD1-CE1 4.41Å; F258-F263 HydrophobicContact CE1-CE1 4.39Å; H260-F263 HydrophobicContact CB-CB 3.97Å; H260-F263 PolarHBondContact ND1-N 3.35Å; H260-F263 WeakPolarHBondContact O-CB 3.47Å; H260-F263 PolarHBondContact O-N 2.92Å; R261-F263 VanDerWaalsContact C-N 3.34Å; R261-F263 PolarHBondContact O-N 2.97Å; F263-Y266 PolarHBondContact O-N 3.02Å; F263-L267 HydrophobicContact CE1-CD2 4.12Å; F263-L267 HydrophobicContact CZ-CD2 4.48Å; F263-L267 VanDerWaalsContact O-CB 3.24Å; F263-L267 WeakPolarHBondContact O-CB 3.13Å; F263-L267 PolarHBondContact O-N 3.39Å; F263-L378 HydrophobicContact CD2-CD1 4.04Å; F263-L378 HydrophobicContact CE2-CD1 4.15Å; F263-V382 HydrophobicContact CB-CG2 4.26Å; F263-V382 HydrophobicContact CD2-CG2 3.8Å; F263-V382 HydrophobicContact CG-CG2 4.43Å; F263-A390 HydrophobicContact CD2-CB 4.37Å; F263-A390 HydrophobicContact CE2-CB 3.87Å; F263-L393 HydrophobicContact CZ-CB 4.11Å; F263-V394 HydrophobicContact CE2-CG2 3.54Å; F263-V394 HydrophobicContact CZ-CG2 3.84Å |
| 264 | L | 94.1 | Very high | 91.2 | Very high | 74 Ų | 74 | 40.6 Ų | 40.6 | 39% | 0.387 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -60.3 | -46 | 174.8 | -72.9 | 178.1 | 0 | 0 | 0 | 112.5 | F258 H260 R261 G262 L267 S268 | F258-L264 HydrophobicContact CB-CD2 4.39Å; F258-L264 HydrophobicContact CD1-CD2 3.87Å; F258-L264 VanDerWaalsContact O-CD1 3.26Å; F258-L264 WeakPolarHBondContact O-CD1 3.5Å; F258-L264 WeakPolarHBondContact O-CD2 3.25Å; F258-L264 WeakPolarHBondContact O-CG 3.26Å; H260-L264 PolarHBondContact O-N 2.89Å; R261-L264 PolarHBondContact O-N 2.84Å; G262-L264 VanDerWaalsContact C-N 3.34Å; G262-L264 PolarHBondContact O-N 2.89Å; L264-L267 PolarHBondContact O-N 3.28Å; L264-S268 WeakPolarHBondContact O-CB 3.48Å; L264-S268 PolarHBondContact O-N 3.37Å; L264-S268 PolarHBondContact O-OG 2.98Å; L264-S268 VanDerWaalsContact O-OG 3.04Å |
| 265 | L | 94.6 | Very high | 92.1 | Very high | 41 Ų | 41 | 42 Ų | 42 | 22% | 0.215 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -62.7 | -42 | 177.5 | -72.6 | 170 | 0 | 0 | 0 | 112.2 | R261 G262 S268 G269 L437 M441 N444 | R261-L265 WeakPolarHBondContact O-CG 3.29Å; R261-L265 PolarHBondContact O-N 3.43Å; R261-L265 VanDerWaalsContact O-N 3.13Å; G262-L265 PolarHBondContact O-N 3.49Å; L265-S268 PolarHBondContact O-OG 3.44Å; L265-S268 VanDerWaalsContact O-OG 3.06Å; L265-G269 PolarHBondContact O-N 3.42Å; L265-G269 VanDerWaalsContact O-N 3.12Å; L265-L437 VanDerWaalsContact O-CD2 3.29Å; L265-L437 WeakPolarHBondContact O-CD2 3.23Å; L265-M441 HydrophobicContact CB-CE 3.8Å; L265-N444 HydrophobicContact CD1-CB 4.03Å |
| 266 | Y | 94.9 | Very high | 92.7 | Very high | 1 Ų | 1 | 38.9 Ų | 38.9 | 0% | 0.004 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -63.2 | -47.2 | 175.7 | 176.5 | -88.7 | 0 | 0 | 0 | 110.9 | G262 F263 G269 N270 F333 L374 T377 L378 L381 V394 | G262-Y266 WeakPolarHBondContact O-CB 3.5Å; G262-Y266 PolarHBondContact O-N 3.43Å; F263-Y266 PolarHBondContact O-N 3.02Å; Y266-G269 PolarHBondContact O-N 3.37Å; Y266-N270 WeakPolarHBondContact CE1-ND2 3.39Å; Y266-N270 WeakPolarHBondContact O-CB 3.17Å; Y266-N270 PolarHBondContact O-N 2.91Å; Y266-N270 PolarHBondContact O-OD1 2.79Å; Y266-N270 PolarHBondContact OH-ND2 3.34Å; Y266-F333 HydrophobicContact CD2-CE1 4.45Å; Y266-F333 AromaticContact CE2-CE1 3.98Å; Y266-F333 HydrophobicContact CE2-CE1 3.98Å; Y266-F333 HydrophobicContact CE2-CZ 4.43Å; Y266-L374 WeakPolarHBondContact OH-CD1 3.27Å; Y266-L374 WeakPolarHBondContact OH-CG 3.35Å; Y266-L374 PolarHBondContact OH-O 3.03Å; Y266-L374 VanDerWaalsContact OH-O 3.08Å; Y266-T377 HydrophobicContact CD2-CG2 4.31Å; Y266-T377 HydrophobicContact CE2-CG2 4.24Å; Y266-L378 HydrophobicContact CD1-CD1 3.97Å; Y266-L378 HydrophobicContact CE1-CB 4.22Å; Y266-L378 HydrophobicContact CE1-CD1 3.87Å; Y266-L378 HydrophobicContact CE1-CD2 4.45Å; Y266-L378 HydrophobicContact CE1-CG 4.4Å; Y266-L378 HydrophobicContact CE2-CB 4.44Å; Y266-L381 HydrophobicContact CG-CD2 4.2Å; Y266-V394 HydrophobicContact CE1-CG1 4.38Å; Y266-V394 HydrophobicContact CE1-CG2 4.25Å |
| 267 | L | 95 | Very high | 93.2 | Very high | 12 Ų | 12 | 35.8 Ų | 35.8 | 6% | 0.063 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -63.5 | -46.9 | -179.1 | -176.4 | 64.6 | 0 | 0 | 0 | 112.1 | F258 F263 L264 N270 V271 V394 V397 | F258-L267 HydrophobicContact CD1-CD2 4.35Å; F258-L267 HydrophobicContact CE1-CD2 3.57Å; F258-L267 HydrophobicContact CZ-CD2 4.39Å; F263-L267 HydrophobicContact CE1-CD2 4.12Å; F263-L267 HydrophobicContact CZ-CD2 4.48Å; F263-L267 VanDerWaalsContact O-CB 3.24Å; F263-L267 WeakPolarHBondContact O-CB 3.13Å; F263-L267 PolarHBondContact O-N 3.39Å; L264-L267 PolarHBondContact O-N 3.28Å; L267-N270 PolarHBondContact O-N 2.86Å; L267-V271 WeakPolarHBondContact O-CG2 3.43Å; L267-V271 PolarHBondContact O-N 3.23Å; L267-V394 HydrophobicContact CD1-CB 4.45Å; L267-V394 HydrophobicContact CD1-CG2 4.05Å; L267-V397 HydrophobicContact CD1-CB 3.98Å; L267-V397 HydrophobicContact CD1-CG1 3.94Å; L267-V397 HydrophobicContact CD1-CG2 4.46Å; L267-V397 HydrophobicContact CD2-CG1 4.48Å; L267-V397 HydrophobicContact CD2-CG2 4.48Å; L267-V397 HydrophobicContact CG-CG1 4.33Å |
| 268 | S | 95.7 | Very high | 93.6 | Very high | 39 Ų | 39 | 35.9 Ų | 35.9 | 27% | 0.273 | 18% | 0.18 | S | C | . | . | H | α-helix | trans | -63.7 | -42.4 | 179.1 | 57.3 | 0 | 0 | 0 | 0 | 111.9 | L264 L265 V271 I272 Y436 | L264-S268 WeakPolarHBondContact O-CB 3.48Å; L264-S268 PolarHBondContact O-N 3.37Å; L264-S268 PolarHBondContact O-OG 2.98Å; L264-S268 VanDerWaalsContact O-OG 3.04Å; L265-S268 PolarHBondContact O-OG 3.44Å; L265-S268 VanDerWaalsContact O-OG 3.06Å; S268-V271 PolarHBondContact O-N 3.06Å; S268-I272 WeakPolarHBondContact O-CG1 3.39Å; S268-I272 PolarHBondContact O-N 3.06Å; S268-Y436 VanDerWaalsContact OG-CE1 3.29Å; S268-Y436 WeakPolarHBondContact OG-CE1 3.45Å; S268-Y436 PolarHBondContact OG-OH 3.18Å |
| 269 | G | 95.9 | Very high | 93.8 | Very high | 0 Ų | 0 | 32.2 Ų | 32.2 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -64 | -43.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | L265 Y266 I272 M273 S433 | L265-G269 PolarHBondContact O-N 3.42Å; L265-G269 VanDerWaalsContact O-N 3.12Å; Y266-G269 PolarHBondContact O-N 3.37Å; G269-I272 PolarHBondContact O-N 3.41Å; G269-M273 WeakPolarHBondContact O-CB 3.48Å; G269-M273 PolarHBondContact O-N 2.89Å; G269-S433 PolarHBondContact O-OG 3.21Å |
| 270 | N | 95.3 | Very high | 94.2 | Very high | 0 Ų | 0 | 26.7 Ų | 26.7 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -60.7 | -45.4 | 175.4 | -85.2 | 21.1 | 0 | 0 | 0 | 111.8 | Y266 L267 I272 M273 F274 E398 | Y266-N270 WeakPolarHBondContact CE1-ND2 3.39Å; Y266-N270 WeakPolarHBondContact O-CB 3.17Å; Y266-N270 PolarHBondContact O-N 2.91Å; Y266-N270 PolarHBondContact O-OD1 2.79Å; Y266-N270 PolarHBondContact OH-ND2 3.34Å; L267-N270 PolarHBondContact O-N 2.86Å; N270-I272 VanDerWaalsContact C-N 3.28Å; N270-I272 PolarHBondContact O-N 2.8Å; N270-M273 WeakPolarHBondContact O-CB 3.05Å; N270-M273 PolarHBondContact O-N 3.46Å; N270-M273 VanDerWaalsContact O-N 3.1Å; N270-F274 HydrophobicContact CB-CD2 4.13Å; N270-F274 HydrophobicContact CB-CE2 4.21Å; N270-F274 WeakPolarHBondContact O-CB 3.37Å; N270-F274 WeakPolarHBondContact O-CD2 3.45Å; N270-F274 PolarHBondContact O-N 2.92Å; N270-E398 PolarHBondContact ND2-OE1 3.4Å |
| 271 | V | 95.8 | Very high | 94.4 | Very high | 36 Ų | 36 | 22.9 Ų | 22.9 | 22% | 0.218 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -56.1 | -45.2 | 178.5 | 169 | 0 | 0 | 0 | 0 | 111.3 | L267 S268 F275 V397 P401 | L267-V271 WeakPolarHBondContact O-CG2 3.43Å; L267-V271 PolarHBondContact O-N 3.23Å; S268-V271 PolarHBondContact O-N 3.06Å; V271-F275 HydrophobicContact CG1-CE2 4.27Å; V271-F275 VanDerWaalsContact O-CD2 3.24Å; V271-F275 WeakPolarHBondContact O-CD2 3.18Å; V271-V397 HydrophobicContact CG2-CG1 3.56Å; V271-P401 HydrophobicContact CG1-CG 4.3Å; V271-P401 WeakPolarHBondContact O-CB 3.49Å |
| 272 | I | 96.4 | Very high | 94.6 | Very high | 63 Ų | 63 | 16.7 Ų | 16.7 | 32% | 0.323 | 9% | 0.089 | S | C | . | . | H | α-helix | trans | -64.3 | -45.7 | 176.4 | -59.7 | 167 | 0 | 0 | 0 | 110.5 | S268 G269 N270 F274 F275 V429 | S268-I272 WeakPolarHBondContact O-CG1 3.39Å; S268-I272 PolarHBondContact O-N 3.06Å; G269-I272 PolarHBondContact O-N 3.41Å; N270-I272 VanDerWaalsContact C-N 3.28Å; N270-I272 PolarHBondContact O-N 2.8Å; I272-F274 PolarHBondContact O-N 2.97Å; I272-F275 PolarHBondContact O-N 3.19Å; I272-V429 HydrophobicContact CG2-CG1 4.24Å; I272-V429 WeakPolarHBondContact O-CG1 3.44Å |
| 273 | M | 96.3 | Very high | 94.8 | Very high | 0 Ų | 0 | 16.7 Ų | 16.7 | 0% | 0 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -57.5 | -47.2 | 179.6 | -176.3 | -169 | 65.6 | 0 | 0 | 111.9 | G269 N270 F275 G276 L277 F333 I337 L370 L374 L430 S433 | G269-M273 WeakPolarHBondContact O-CB 3.48Å; G269-M273 PolarHBondContact O-N 2.89Å; N270-M273 WeakPolarHBondContact O-CB 3.05Å; N270-M273 PolarHBondContact O-N 3.46Å; N270-M273 VanDerWaalsContact O-N 3.1Å; M273-F275 PolarHBondContact O-N 2.93Å; M273-G276 PolarHBondContact O-N 3.25Å; M273-L277 HydrophobicContact CE-CD2 4.13Å; M273-L277 PolarHBondContact O-N 2.89Å; M273-F333 HydrophobicContact SD-CZ 4.33Å; M273-I337 HydrophobicContact CG-CD1 4.45Å; M273-I337 HydrophobicContact CG-CG2 4.06Å; M273-I337 HydrophobicContact SD-CD1 3.61Å; M273-I337 HydrophobicContact SD-CG1 3.69Å; M273-I337 HydrophobicContact SD-CG2 4.33Å; M273-L370 HydrophobicContact SD-CD1 3.79Å; M273-L370 HydrophobicContact SD-CG 4.44Å; M273-L374 HydrophobicContact CE-CD1 4.4Å; M273-L430 HydrophobicContact CB-CD2 4.33Å; M273-L430 HydrophobicContact CG-CD2 3.58Å; M273-L430 VanDerWaalsContact O-CD2 3.29Å; M273-L430 WeakPolarHBondContact O-CD2 3.2Å; M273-S433 WeakPolarHBondContact CB-OG 3.21Å |
| 274 | F | 95.4 | Very high | 94.8 | Very high | 6 Ų | 6 | 16.7 Ų | 16.7 | 3% | 0.026 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -66.7 | -20.2 | -173.3 | -86.7 | -73.1 | 0 | 0 | 0 | 113.7 | N270 I272 G276 L277 F278 L374 E398 P401 V402 | N270-F274 HydrophobicContact CB-CD2 4.13Å; N270-F274 HydrophobicContact CB-CE2 4.21Å; N270-F274 WeakPolarHBondContact O-CB 3.37Å; N270-F274 WeakPolarHBondContact O-CD2 3.45Å; N270-F274 PolarHBondContact O-N 2.92Å; I272-F274 PolarHBondContact O-N 2.97Å; F274-G276 VanDerWaalsContact C-N 3.3Å; F274-G276 PolarHBondContact O-N 3.48Å; F274-L277 HydrophobicContact CD1-CD2 4.05Å; F274-L277 HydrophobicContact CE1-CD2 3.81Å; F274-L277 HydrophobicContact CZ-CD2 4.39Å; F274-F278 AromaticContact CD1-CD2 3.98Å; F274-F278 HydrophobicContact CD1-CD2 3.98Å; F274-F278 AromaticContact CD1-CE2 3.44Å; F274-F278 HydrophobicContact CD1-CE2 3.44Å; F274-F278 VanDerWaalsContact CD1-CE2 3.44Å; F274-F278 HydrophobicContact CD1-CZ 4.37Å; F274-F278 HydrophobicContact CE1-CD2 4.43Å; F274-F278 AromaticContact CE1-CE2 3.51Å; F274-F278 HydrophobicContact CE1-CE2 3.51Å; F274-F278 HydrophobicContact CE1-CZ 4.02Å; F274-L374 HydrophobicContact CZ-CD2 4.36Å; F274-E398 HydrophobicContact CD2-CB 4.33Å; F274-E398 HydrophobicContact CD2-CG 3.67Å; F274-E398 HydrophobicContact CE2-CG 3.84Å; F274-E398 WeakPolarHBondContact CE2-OE1 3.33Å; F274-E398 HydrophobicContact CG-CG 4.43Å; F274-P401 HydrophobicContact CB-CB 3.95Å; F274-P401 HydrophobicContact CB-CG 3.78Å; F274-V402 HydrophobicContact CB-CG2 4.23Å; F274-V402 HydrophobicContact CD1-CG2 3.82Å; F274-V402 HydrophobicContact CG-CG2 4.29Å |
| 275 | F | 94.8 | Very high | 94.8 | Very high | 65 Ų | 65 | 13.1 Ų | 13.1 | 29% | 0.285 | 7% | 0.07 | S | C | . | . | H | α-helix | trans | -62.1 | -37.7 | 170.2 | -86.6 | -78.3 | 0 | 0 | 0 | 112.2 | V271 I272 M273 P401 L404 G405 L409 V429 | V271-F275 HydrophobicContact CG1-CE2 4.27Å; V271-F275 VanDerWaalsContact O-CD2 3.24Å; V271-F275 WeakPolarHBondContact O-CD2 3.18Å; I272-F275 PolarHBondContact O-N 3.19Å; M273-F275 PolarHBondContact O-N 2.93Å; F275-P401 HydrophobicContact CD1-CB 4.24Å; F275-P401 HydrophobicContact CD2-CB 3.51Å; F275-P401 HydrophobicContact CE1-CB 4.33Å; F275-P401 HydrophobicContact CE2-CB 3.61Å; F275-P401 HydrophobicContact CG-CB 3.83Å; F275-P401 HydrophobicContact CZ-CB 4.03Å; F275-L404 HydrophobicContact CE1-CB 3.96Å; F275-G405 WeakPolarHBondContact O-CA 3.47Å; F275-L409 WeakPolarHBondContact O-CD1 3.43Å; F275-V429 HydrophobicContact CB-CG1 4.28Å |
| 276 | G | 93.8 | Very high | 94.7 | Very high | 0 Ų | 0 | 11.2 Ų | 11.2 | 0% | 0 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -101.9 | -13.5 | -175.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | M273 F274 P280 | M273-G276 PolarHBondContact O-N 3.25Å; F274-G276 VanDerWaalsContact C-N 3.3Å; F274-G276 PolarHBondContact O-N 3.48Å; G276-P280 WeakPolarHBondContact O-CD 3.42Å |
| 277 | L | 94.8 | Very high | 94.7 | Very high | 3 Ų | 3 | 11.3 Ų | 11.3 | 2% | 0.016 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -73.1 | -42.1 | -170.7 | -175.8 | 63.7 | 0 | 0 | 0 | 113.8 | M273 F274 F367 L370 L430 | M273-L277 HydrophobicContact CE-CD2 4.13Å; M273-L277 PolarHBondContact O-N 2.89Å; F274-L277 HydrophobicContact CD1-CD2 4.05Å; F274-L277 HydrophobicContact CE1-CD2 3.81Å; F274-L277 HydrophobicContact CZ-CD2 4.39Å; L277-F367 HydrophobicContact CD1-CD2 4.13Å; L277-F367 HydrophobicContact CD1-CE2 4.17Å; L277-F367 HydrophobicContact CD2-CE2 4.39Å; L277-F367 HydrophobicContact CG-CE2 4.18Å; L277-L370 HydrophobicContact CD1-CD1 3.9Å; L277-L370 HydrophobicContact CD2-CD1 4.47Å; L277-L370 HydrophobicContact CD2-CD2 4.13Å; L277-L430 HydrophobicContact CB-CD2 4.36Å |
| 278 | F | 92.9 | Very high | 94.5 | Very high | 6 Ų | 6 | 10.8 Ų | 10.8 | 3% | 0.026 | 6% | 0.057 | C | C | . | . | S | Bend | trans | -91.3 | -26.7 | -171.8 | -74 | -67 | 0 | 0 | 0 | 114.3 | L66 F274 L281 V282 F367 V402 | L66-F278 HydrophobicContact CD1-CD1 4.29Å; L66-F278 HydrophobicContact CD1-CG 4.44Å; F274-F278 AromaticContact CD1-CD2 3.98Å; F274-F278 HydrophobicContact CD1-CD2 3.98Å; F274-F278 AromaticContact CD1-CE2 3.44Å; F274-F278 HydrophobicContact CD1-CE2 3.44Å; F274-F278 VanDerWaalsContact CD1-CE2 3.44Å; F274-F278 HydrophobicContact CD1-CZ 4.37Å; F274-F278 HydrophobicContact CE1-CD2 4.43Å; F274-F278 AromaticContact CE1-CE2 3.51Å; F274-F278 HydrophobicContact CE1-CE2 3.51Å; F274-F278 HydrophobicContact CE1-CZ 4.02Å; F278-L281 WeakPolarHBondContact O-CB 3.24Å; F278-L281 PolarHBondContact O-N 3.35Å; F278-L281 VanDerWaalsContact O-N 3.15Å; F278-V282 WeakPolarHBondContact O-CG2 3.47Å; F278-V282 PolarHBondContact O-N 3.46Å; F278-F367 HydrophobicContact CE1-CZ 4.47Å; F278-V402 HydrophobicContact CD2-CG1 4.26Å; F278-V402 HydrophobicContact CD2-CG2 3.81Å; F278-V402 HydrophobicContact CE2-CG1 4.38Å; F278-V402 HydrophobicContact CE2-CG2 3.66Å |
| 279 | A | 94.3 | Very high | 94.3 | Very high | 0 Ų | 0 | 10 Ų | 10 | 0% | 0 | 5% | 0.049 | C | C | . | . | H | α-helix | trans | -59.9 | -45.2 | -175.5 | 0 | 0 | 0 | 0 | 0 | 113.3 | L281 V282 F283 P406 L409 | A279-L281 VanDerWaalsContact C-N 3.27Å; A279-L281 PolarHBondContact O-N 2.84Å; A279-V282 PolarHBondContact O-N 3.26Å; A279-F283 HydrophobicContact CB-CD2 4.23Å; A279-F283 HydrophobicContact CB-CE2 4.14Å; A279-F283 WeakPolarHBondContact O-CB 2.95Å; A279-F283 WeakPolarHBondContact O-CD2 3.46Å; A279-F283 WeakPolarHBondContact O-CG 3.17Å; A279-F283 PolarHBondContact O-N 3Å; A279-P406 HydrophobicContact CB-CB 4.31Å; A279-P406 HydrophobicContact CB-CG 4.37Å; A279-L409 HydrophobicContact CB-CB 4.14Å; A279-L409 HydrophobicContact CB-CD1 3.63Å |
| 280 | P | 95.1 | Very high | 94 | Very high | 0 Ų | 0 | 12 Ų | 12 | 0% | 0 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -63.2 | -33.6 | 176.2 | -24.3 | 37.1 | 0 | 0 | 0 | 112.8 | G276 L284 F363 Y423 C426 | G276-P280 WeakPolarHBondContact O-CD 3.42Å; P280-L284 WeakPolarHBondContact O-CB 3.36Å; P280-L284 PolarHBondContact O-N 3.02Å; P280-L284 VanDerWaalsContact O-N 3.14Å; P280-F363 HydrophobicContact CB-CE1 4.48Å; P280-Y423 HydrophobicContact CB-CD1 4.2Å; P280-Y423 HydrophobicContact CB-CE1 3.83Å; P280-Y423 PolarHBondContact O-OH 3.45Å; P280-Y423 VanDerWaalsContact O-OH 3.07Å; P280-C426 HydrophobicContact CG-CB 3.57Å; P280-C426 VanDerWaalsContact CG-SG 3.59Å |
| 281 | L | 93.8 | Very high | 93.8 | Very high | 0 Ų | 0 | 15.5 Ų | 15.5 | 0% | 0 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -66.9 | -47.2 | 175.6 | -164.4 | 161.2 | 0 | 0 | 0 | 110.4 | K38 F278 A279 F283 L284 L302 F363 F367 | K38-L281 HydrophobicContact CB-CD2 3.68Å; K38-L281 HydrophobicContact CD-CD1 3.95Å; K38-L281 HydrophobicContact CD-CD2 3.73Å; K38-L281 HydrophobicContact CG-CD2 3.5Å; F278-L281 WeakPolarHBondContact O-CB 3.24Å; F278-L281 PolarHBondContact O-N 3.35Å; F278-L281 VanDerWaalsContact O-N 3.15Å; A279-L281 VanDerWaalsContact C-N 3.27Å; A279-L281 PolarHBondContact O-N 2.84Å; L281-F283 PolarHBondContact O-N 3.41Å; L281-L284 PolarHBondContact O-N 3.4Å; L281-L302 HydrophobicContact CD2-CD2 4.42Å; L281-F363 HydrophobicContact CB-CE1 4.03Å; L281-F363 HydrophobicContact CB-CZ 3.97Å; L281-F363 HydrophobicContact CG-CE1 4.42Å; L281-F363 HydrophobicContact CG-CZ 4.49Å; L281-F367 HydrophobicContact CD1-CE2 4.22Å; L281-F367 HydrophobicContact CD1-CZ 4.21Å |
| 282 | V | 93.6 | Very high | 93.6 | Very high | 3 Ų | 3 | 22.3 Ų | 22.3 | 2% | 0.018 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -62.4 | -44.5 | -179.5 | 168.8 | 0 | 0 | 0 | 0 | 111.3 | T41 F44 F278 A279 | T41-V282 VanDerWaalsContact CB-O 3.29Å; T41-V282 WeakPolarHBondContact CB-O 3.48Å; T41-V282 HydrophobicContact CG2-CB 4.29Å; T41-V282 HydrophobicContact CG2-CG1 3.9Å; T41-V282 HydrophobicContact CG2-CG2 4.34Å; T41-V282 PolarHBondContact OG1-O 3.04Å; F44-V282 HydrophobicContact CD2-CG1 4.14Å; F44-V282 HydrophobicContact CE2-CG1 3.67Å; F278-V282 WeakPolarHBondContact O-CG2 3.47Å; F278-V282 PolarHBondContact O-N 3.46Å; A279-V282 PolarHBondContact O-N 3.26Å |
| 283 | F | 94.9 | Very high | 93.4 | Very high | 1 Ų | 1 | 22 Ų | 22 | 0% | 0.004 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -88.6 | 2.4 | -175 | -60.6 | -46.9 | 0 | 0 | 0 | 114.7 | T55 A279 L281 S285 S286 Y287 P406 Y419 T422 | T55-F283 HydrophobicContact CG2-CD1 3.95Å; T55-F283 HydrophobicContact CG2-CE1 3.5Å; T55-F283 HydrophobicContact CG2-CZ 4.08Å; A279-F283 HydrophobicContact CB-CD2 4.23Å; A279-F283 HydrophobicContact CB-CE2 4.14Å; A279-F283 WeakPolarHBondContact O-CB 2.95Å; A279-F283 WeakPolarHBondContact O-CD2 3.46Å; A279-F283 WeakPolarHBondContact O-CG 3.17Å; A279-F283 PolarHBondContact O-N 3Å; L281-F283 PolarHBondContact O-N 3.41Å; F283-S285 PolarHBondContact O-N 3.44Å; F283-S286 PolarHBondContact O-N 3.45Å; F283-Y287 WeakPolarHBondContact O-CB 3.24Å; F283-Y287 PolarHBondContact O-N 3.35Å; F283-P406 HydrophobicContact CE2-CB 4.37Å; F283-P406 WeakPolarHBondContact CE2-O 3.26Å; F283-P406 HydrophobicContact CZ-CB 4.26Å; F283-P406 WeakPolarHBondContact CZ-O 3.24Å; F283-Y419 HydrophobicContact CB-CD1 4Å; F283-Y419 HydrophobicContact CB-CE1 3.87Å; F283-Y419 HydrophobicContact CD1-CE1 4.03Å; F283-Y419 HydrophobicContact CG-CD1 4.3Å; F283-Y419 AromaticContact CG-CE1 3.91Å; F283-Y419 HydrophobicContact CG-CE1 3.91Å; F283-T422 HydrophobicContact CD2-CG2 3.9Å; F283-T422 HydrophobicContact CE2-CG2 4.24Å |
| 284 | L | 94.7 | Very high | 93.3 | Very high | 0 Ų | 0 | 24.7 Ų | 24.7 | 0% | 0 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -59.5 | -46 | -177.1 | -175.5 | 56.5 | 0 | 0 | 0 | 113.1 | P280 L281 Y287 G288 L301 L302 L305 Y359 Y423 | P280-L284 WeakPolarHBondContact O-CB 3.36Å; P280-L284 PolarHBondContact O-N 3.02Å; P280-L284 VanDerWaalsContact O-N 3.14Å; L281-L284 PolarHBondContact O-N 3.4Å; L284-Y287 PolarHBondContact O-N 3.06Å; L284-G288 PolarHBondContact O-N 3.44Å; L284-G288 VanDerWaalsContact O-N 3.09Å; L284-L301 HydrophobicContact CD1-CD1 4.46Å; L284-L301 HydrophobicContact CD2-CB 4.13Å; L284-L301 HydrophobicContact CG-CB 4.25Å; L284-L302 HydrophobicContact CB-CD2 4.2Å; L284-L302 HydrophobicContact CD2-CD2 4.03Å; L284-L302 HydrophobicContact CD2-CG 4.43Å; L284-L305 HydrophobicContact CD2-CD1 4Å; L284-Y359 HydrophobicContact CD1-CD1 4.3Å; L284-Y359 HydrophobicContact CD1-CE1 3.81Å; L284-Y423 WeakPolarHBondContact CA-OH 3.34Å |
| 285 | S | 93 | Very high | 93.1 | Very high | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -64.4 | -45.2 | 177.6 | 53.4 | 0 | 0 | 0 | 0 | 111.3 | T41 F283 Y287 G288 K289 S298 | T41-S285 PolarHBondContact O-OG 2.8Å; F283-S285 PolarHBondContact O-N 3.44Å; S285-Y287 VanDerWaalsContact C-N 3.34Å; S285-Y287 PolarHBondContact O-N 3.11Å; S285-G288 PolarHBondContact O-N 3.33Å; S285-K289 WeakPolarHBondContact O-CG 3.23Å; S285-K289 PolarHBondContact O-N 2.94Å; S285-S298 WeakPolarHBondContact O-CB 3.49Å |
| 286 | S | 92.7 | Very high | 92.9 | Very high | 0 Ų | 0 | 29.7 Ų | 29.7 | 0% | 0 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -64.2 | -38.1 | 178.1 | -58.1 | 0 | 0 | 0 | 0 | 112.1 | F283 K289 S290 Y419 | F283-S286 PolarHBondContact O-N 3.45Å; S286-K289 PolarHBondContact O-N 3.46Å; S286-S290 WeakPolarHBondContact O-CB 3.26Å; S286-S290 PolarHBondContact O-N 3.06Å; S286-Y419 VanDerWaalsContact CB-OH 3.28Å; S286-Y419 WeakPolarHBondContact CB-OH 3.33Å |
| 287 | Y | 93.7 | Very high | 92.9 | Very high | 4 Ų | 4 | 34.4 Ų | 34.4 | 2% | 0.016 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -65.6 | -44.8 | 177.2 | -171.1 | -160.6 | 0 | 0 | 0 | 111.2 | F283 L284 S285 K289 S290 Q291 F356 Y419 Y423 | F283-Y287 WeakPolarHBondContact O-CB 3.24Å; F283-Y287 PolarHBondContact O-N 3.35Å; L284-Y287 PolarHBondContact O-N 3.06Å; S285-Y287 VanDerWaalsContact C-N 3.34Å; S285-Y287 PolarHBondContact O-N 3.11Å; Y287-K289 VanDerWaalsContact C-N 3.34Å; Y287-K289 PolarHBondContact O-N 3.34Å; Y287-S290 WeakPolarHBondContact CD2-OG 3.45Å; Y287-S290 PolarHBondContact O-N 3.44Å; Y287-S290 PolarHBondContact O-OG 3.27Å; Y287-Q291 HydrophobicContact CD2-CG 4.24Å; Y287-Q291 HydrophobicContact CE2-CG 4.07Å; Y287-Q291 PolarHBondContact O-N 3.13Å; Y287-F356 AromaticContact CD1-CE1 3.63Å; Y287-F356 HydrophobicContact CD1-CE1 3.63Å; Y287-F356 HydrophobicContact CD1-CZ 4.11Å; Y287-F356 AromaticContact CE1-CE1 3.61Å; Y287-F356 HydrophobicContact CE1-CE1 3.61Å; Y287-F356 AromaticContact CE1-CZ 3.84Å; Y287-F356 HydrophobicContact CE1-CZ 3.84Å; Y287-F356 HydrophobicContact CE2-CZ 4.38Å; Y287-F356 HydrophobicContact CG-CE1 4.28Å; Y287-F356 AromaticContact CZ-CZ 3.99Å; Y287-Y419 VanDerWaalsContact CD2-CB 3.49Å; Y287-Y419 AromaticContact CD2-CD2 3.97Å; Y287-Y419 HydrophobicContact CD2-CD2 3.97Å; Y287-Y419 HydrophobicContact CD2-CG 4.08Å; Y287-Y419 HydrophobicContact CG-CD2 4.4Å; Y287-Y419 HydrophobicContact CG-CG 4.25Å; Y287-Y423 HydrophobicContact CD1-CD2 4.18Å; Y287-Y423 HydrophobicContact CD1-CE1 4.25Å; Y287-Y423 AromaticContact CD1-CE2 3.68Å; Y287-Y423 HydrophobicContact CD1-CE2 3.68Å; Y287-Y423 AromaticContact CD1-CZ 3.71Å; Y287-Y423 HydrophobicContact CE1-CD2 4.38Å; Y287-Y423 HydrophobicContact CE1-CE2 4.31Å; Y287-Y423 HydrophobicContact CG-CE2 4.24Å |
| 288 | G | 91.9 | Very high | 92.8 | Very high | 0 Ų | 0 | 34.2 Ų | 34.2 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -57.2 | -44.8 | 173.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | L284 S285 S290 Q291 Y293 S298 | L284-G288 PolarHBondContact O-N 3.44Å; L284-G288 VanDerWaalsContact O-N 3.09Å; S285-G288 PolarHBondContact O-N 3.33Å; G288-S290 PolarHBondContact O-N 3.48Å; G288-Q291 PolarHBondContact O-N 2.86Å; G288-Y293 WeakPolarHBondContact O-CB 3.5Å; G288-Y293 PolarHBondContact O-N 3.32Å; G288-S298 VanDerWaalsContact C-OG 3.26Å |
| 289 | K | 91.3 | Very high | 92.8 | Very high | 24 Ų | 24 | 34 Ų | 34 | 10% | 0.104 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -64.8 | -36.7 | 176.5 | -69.5 | 178.2 | -172.3 | -174.7 | 0 | 112.5 | V42 K45 E46 S285 S286 Y287 Q291 H292 S295 S298 | V42-K289 PolarHBondContact O-NZ 2.94Å; K45-K289 HydrophobicContact CB-CD 3.84Å; K45-K289 HydrophobicContact CG-CD 4.18Å; E46-K289 IonicContact OE1-NZ 2.77Å; E46-K289 PolarHBondContact OE1-NZ 3.37Å; E46-K289 IonicContact OE2-NZ 3.75Å; E46-K289 PolarHBondContact OE2-NZ 3.12Å; S285-K289 WeakPolarHBondContact O-CG 3.23Å; S285-K289 PolarHBondContact O-N 2.94Å; S286-K289 PolarHBondContact O-N 3.46Å; Y287-K289 VanDerWaalsContact C-N 3.34Å; Y287-K289 PolarHBondContact O-N 3.34Å; K289-Q291 VanDerWaalsContact C-N 3.25Å; K289-Q291 PolarHBondContact O-N 2.85Å; K289-H292 PolarHBondContact O-N 2.87Å; K289-S295 WeakPolarHBondContact CE-OG 2.99Å; K289-S298 PolarHBondContact N-OG 3.36Å |
| 290 | S | 90.8 | Very high | 92.8 | Very high | 41 Ų | 41 | 39.1 Ų | 39.1 | 29% | 0.287 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -66.3 | -27.4 | 177.7 | 72.9 | 0 | 0 | 0 | 0 | 113.1 | S286 Y287 G288 H292 | S286-S290 WeakPolarHBondContact O-CB 3.26Å; S286-S290 PolarHBondContact O-N 3.06Å; Y287-S290 WeakPolarHBondContact CD2-OG 3.45Å; Y287-S290 PolarHBondContact O-N 3.44Å; Y287-S290 PolarHBondContact O-OG 3.27Å; G288-S290 PolarHBondContact O-N 3.48Å; S290-H292 PolarHBondContact O-N 2.94Å |
| 291 | Q | 90.8 | Very high | 92.8 | Very high | 74 Ų | 74 | 39.2 Ų | 39.2 | 35% | 0.346 | 19% | 0.192 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -84.6 | 19.1 | 172.7 | -60.3 | -69 | 59 | 0 | 0 | 112.8 | Y287 G288 K289 Y293 F356 | Y287-Q291 HydrophobicContact CD2-CG 4.24Å; Y287-Q291 HydrophobicContact CE2-CG 4.07Å; Y287-Q291 PolarHBondContact O-N 3.13Å; G288-Q291 PolarHBondContact O-N 2.86Å; K289-Q291 VanDerWaalsContact C-N 3.25Å; K289-Q291 PolarHBondContact O-N 2.85Å; Q291-Y293 HydrophobicContact CB-CD2 3.86Å; Q291-Y293 HydrophobicContact CB-CE2 3.81Å; Q291-Y293 PolarHBondContact O-N 3.38Å; Q291-F356 HydrophobicContact CG-CE2 4.1Å; Q291-F356 HydrophobicContact CG-CZ 4.05Å |
| 292 | H | 90.1 | Very high | 92.9 | Very high | 179 Ų | 179 | 39.2 Ų | 39.2 | 83% | 0.829 | 19% | 0.192 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 61.4 | 20.5 | 179.1 | -52.8 | -69.2 | 0 | 0 | 0 | 115.4 | K289 S290 | K289-H292 PolarHBondContact O-N 2.87Å; S290-H292 PolarHBondContact O-N 2.94Å |
| 293 | Y | 93.6 | Very high | 93 | Very high | 55 Ų | 55 | 39.4 Ų | 39.4 | 22% | 0.216 | 19% | 0.194 | C | C | . | . | trans | -78.4 | 149.8 | 168.8 | -62.5 | -60.2 | 0 | 0 | 0 | 111.2 | G288 Q291 T351 T352 Y353 F356 | G288-Y293 WeakPolarHBondContact O-CB 3.5Å; G288-Y293 PolarHBondContact O-N 3.32Å; Q291-Y293 HydrophobicContact CB-CD2 3.86Å; Q291-Y293 HydrophobicContact CB-CE2 3.81Å; Q291-Y293 PolarHBondContact O-N 3.38Å; Y293-T351 PolarHBondContact OH-O 3.4Å; Y293-T352 VanDerWaalsContact OH-C 3.23Å; Y293-T352 VanDerWaalsContact OH-CA 3.27Å; Y293-T352 WeakPolarHBondContact OH-CA 3.44Å; Y293-Y353 HydrophobicContact CD1-CD2 4.38Å; Y293-Y353 HydrophobicContact CG-CD2 4.32Å; Y293-Y353 PolarHBondContact OH-N 2.82Å; Y293-F356 AromaticContact CE2-CD2 3.91Å; Y293-F356 HydrophobicContact CE2-CD2 3.91Å; Y293-F356 HydrophobicContact CE2-CE2 4.03Å | ||
| 294 | S | 93.8 | Very high | 93 | Very high | 57 Ų | 57 | 41.1 Ų | 41.1 | 40% | 0.399 | 20% | 0.203 | S | C | . | . | trans | -59.9 | 149.7 | -179.9 | 67.3 | 0 | 0 | 0 | 0 | 111.8 | E296 K297 S298 | S294-E296 PolarHBondContact O-N 2.95Å; S294-K297 PolarHBondContact O-N 3.08Å; S294-K297 VanDerWaalsContact O-N 3.13Å; S294-K297 WeakPolarHBondContact OG-CB 3.34Å; S294-K297 VanDerWaalsContact OG-CG 3.31Å; S294-K297 WeakPolarHBondContact OG-CG 3.26Å; S294-K297 PolarHBondContact OG-N 3.32Å; S294-S298 PolarHBondContact O-N 2.83Å; S294-S298 PolarHBondContact O-OG 3Å | ||
| 295 | S | 90.4 | Very high | 93.1 | Very high | 34 Ų | 34 | 41.1 Ų | 41.1 | 24% | 0.238 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -59 | -34.1 | 179.3 | -59.8 | 0 | 0 | 0 | 0 | 112.6 | K289 S298 A299 | K289-S295 WeakPolarHBondContact CE-OG 2.99Å; S295-S298 PolarHBondContact O-N 3.34Å; S295-A299 WeakPolarHBondContact O-CB 3.14Å; S295-A299 PolarHBondContact O-N 3.17Å |
| 296 | E | 91.8 | Very high | 93.3 | Very high | 143 Ų | 143 | 41.1 Ų | 41.1 | 67% | 0.668 | 20% | 0.203 | S | C | * | . | H | α-helix | trans | -64.5 | -48.8 | 174.2 | -173.4 | -178.8 | -174.8 | 0 | 0 | 111.9 | S294 S298 A299 F300 | S294-E296 PolarHBondContact O-N 2.95Å; E296-S298 VanDerWaalsContact C-N 3.26Å; E296-S298 PolarHBondContact O-N 3.05Å; E296-A299 PolarHBondContact O-N 3.39Å; E296-F300 WeakPolarHBondContact O-CB 3.42Å; E296-F300 PolarHBondContact O-N 2.89Å |
| 297 | K | 93.8 | Very high | 93.4 | Very high | 98 Ų | 98 | 47.2 Ų | 47.2 | 43% | 0.426 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -59.1 | -39.1 | 176.6 | -81.4 | -178.1 | -177.4 | -179.5 | 0 | 112 | S294 F300 L301 Y353 | S294-K297 PolarHBondContact O-N 3.08Å; S294-K297 VanDerWaalsContact O-N 3.13Å; S294-K297 WeakPolarHBondContact OG-CB 3.34Å; S294-K297 VanDerWaalsContact OG-CG 3.31Å; S294-K297 WeakPolarHBondContact OG-CG 3.26Å; S294-K297 PolarHBondContact OG-N 3.32Å; K297-F300 PolarHBondContact O-N 3.15Å; K297-L301 PolarHBondContact O-N 3.36Å; K297-Y353 HydrophobicContact CB-CD2 4.27Å; K297-Y353 HydrophobicContact CB-CE2 3.57Å; K297-Y353 HydrophobicContact CD-CD1 4.48Å; K297-Y353 HydrophobicContact CD-CD2 4.35Å; K297-Y353 HydrophobicContact CD-CE1 4.36Å; K297-Y353 HydrophobicContact CD-CE2 4.26Å; K297-Y353 HydrophobicContact CD-CG 4.47Å; K297-Y353 HydrophobicContact CG-CE1 4.33Å; K297-Y353 HydrophobicContact CG-CE2 4.08Å; K297-Y353 PolarHBondContact O-OH 3.33Å |
| 298 | S | 92.9 | Very high | 93.6 | Very high | 0 Ų | 0 | 48.9 Ų | 48.9 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -69.1 | -39.2 | 177.8 | -61.9 | 0 | 0 | 0 | 0 | 112.7 | S285 G288 K289 S294 S295 E296 F300 L301 | S285-S298 WeakPolarHBondContact O-CB 3.49Å; G288-S298 VanDerWaalsContact C-OG 3.26Å; K289-S298 PolarHBondContact N-OG 3.36Å; S294-S298 PolarHBondContact O-N 2.83Å; S294-S298 PolarHBondContact O-OG 3Å; S295-S298 PolarHBondContact O-N 3.34Å; E296-S298 VanDerWaalsContact C-N 3.26Å; E296-S298 PolarHBondContact O-N 3.05Å; S298-F300 VanDerWaalsContact C-N 3.31Å; S298-L301 WeakPolarHBondContact O-CB 3.37Å; S298-L301 PolarHBondContact O-N 3.24Å |
| 299 | A | 91.4 | Very high | 93.7 | Very high | 1 Ų | 1 | 49 Ų | 49 | 1% | 0.008 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -67 | -34.5 | 172.6 | 0 | 0 | 0 | 0 | 0 | 112 | V42 Q166 S295 E296 L301 L302 S303 | V42-A299 HydrophobicContact CG1-CB 4.24Å; Q166-A299 HydrophobicContact CB-CB 4.08Å; S295-A299 WeakPolarHBondContact O-CB 3.14Å; S295-A299 PolarHBondContact O-N 3.17Å; E296-A299 PolarHBondContact O-N 3.39Å; A299-L301 VanDerWaalsContact C-N 3.28Å; A299-L301 PolarHBondContact O-N 3.38Å; A299-L302 PolarHBondContact O-N 2.97Å; A299-S303 PolarHBondContact O-N 3.07Å; A299-S303 PolarHBondContact O-OG 3.26Å |
| 300 | F | 94.9 | Very high | 93.7 | Very high | 108 Ų | 108 | 50.2 Ų | 50.2 | 47% | 0.474 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -65.5 | -28.7 | 177.1 | -161.5 | -110.1 | 0 | 0 | 0 | 112.8 | E296 K297 S298 L302 S303 I304 | E296-F300 WeakPolarHBondContact O-CB 3.42Å; E296-F300 PolarHBondContact O-N 2.89Å; K297-F300 PolarHBondContact O-N 3.15Å; S298-F300 VanDerWaalsContact C-N 3.31Å; F300-L302 VanDerWaalsContact C-N 3.34Å; F300-L302 PolarHBondContact O-N 3.22Å; F300-S303 WeakPolarHBondContact O-CA 3.27Å; F300-S303 VanDerWaalsContact O-CB 3.29Å; F300-S303 WeakPolarHBondContact O-CB 3.45Å; F300-S303 PolarHBondContact O-N 2.88Å; F300-I304 HydrophobicContact CD1-CD1 3.78Å; F300-I304 HydrophobicContact CD1-CG1 3.98Å; F300-I304 HydrophobicContact CE1-CD1 3.9Å; F300-I304 HydrophobicContact CE1-CG1 3.89Å; F300-I304 WeakPolarHBondContact O-CG1 3.4Å; F300-I304 PolarHBondContact O-N 2.97Å |
| 301 | L | 96 | Very high | 93.8 | Very high | 1 Ų | 1 | 52.5 Ų | 52.5 | 1% | 0.005 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -59.2 | -41.9 | 173.2 | -66 | 174.4 | 0 | 0 | 0 | 112.5 | L284 K297 S298 A299 S303 I304 L305 Y353 F356 A360 | L284-L301 HydrophobicContact CD1-CD1 4.46Å; L284-L301 HydrophobicContact CD2-CB 4.13Å; L284-L301 HydrophobicContact CG-CB 4.25Å; K297-L301 PolarHBondContact O-N 3.36Å; S298-L301 WeakPolarHBondContact O-CB 3.37Å; S298-L301 PolarHBondContact O-N 3.24Å; A299-L301 VanDerWaalsContact C-N 3.28Å; A299-L301 PolarHBondContact O-N 3.38Å; L301-S303 PolarHBondContact O-N 2.94Å; L301-I304 PolarHBondContact O-N 2.9Å; L301-L305 WeakPolarHBondContact O-CB 3.41Å; L301-L305 PolarHBondContact O-N 3.48Å; L301-Y353 HydrophobicContact CD2-CE2 3.97Å; L301-Y353 HydrophobicContact CG-CE2 4.2Å; L301-F356 HydrophobicContact CD1-CB 4.05Å; L301-F356 HydrophobicContact CD2-CB 3.94Å; L301-A360 HydrophobicContact CB-CB 4.5Å; L301-A360 HydrophobicContact CD2-CB 4.38Å |
| 302 | L | 94.6 | Very high | 94 | Very high | 0 Ų | 0 | 49.1 Ų | 49.1 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -63 | -31.3 | 174.2 | -71.6 | 167.8 | 0 | 0 | 0 | 111.6 | V42 A162 L281 L284 A299 F300 A306 | V42-L302 HydrophobicContact CG1-CD1 4.02Å; A162-L302 HydrophobicContact CB-CB 4.01Å; A162-L302 HydrophobicContact CB-CD1 4.29Å; L281-L302 HydrophobicContact CD2-CD2 4.42Å; L284-L302 HydrophobicContact CB-CD2 4.2Å; L284-L302 HydrophobicContact CD2-CD2 4.03Å; L284-L302 HydrophobicContact CD2-CG 4.43Å; A299-L302 PolarHBondContact O-N 2.97Å; F300-L302 VanDerWaalsContact C-N 3.34Å; F300-L302 PolarHBondContact O-N 3.22Å; L302-A306 VanDerWaalsContact O-CB 3.27Å; L302-A306 WeakPolarHBondContact O-CB 3.43Å; L302-A306 PolarHBondContact O-N 3.13Å |
| 303 | S | 95.3 | Very high | 94 | Very high | 8 Ų | 8 | 42.1 Ų | 42.1 | 6% | 0.056 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -74.4 | -41.5 | 178.6 | -52 | 0 | 0 | 0 | 0 | 112.2 | C159 P163 A299 F300 L301 A306 F307 | C159-S303 PolarHBondContact O-OG 3.07Å; P163-S303 VanDerWaalsContact CD-OG 3.26Å; P163-S303 WeakPolarHBondContact CD-OG 3.45Å; P163-S303 WeakPolarHBondContact CG-OG 3.24Å; A299-S303 PolarHBondContact O-N 3.07Å; A299-S303 PolarHBondContact O-OG 3.26Å; F300-S303 WeakPolarHBondContact O-CA 3.27Å; F300-S303 VanDerWaalsContact O-CB 3.29Å; F300-S303 WeakPolarHBondContact O-CB 3.45Å; F300-S303 PolarHBondContact O-N 2.88Å; L301-S303 PolarHBondContact O-N 2.94Å; S303-A306 PolarHBondContact O-N 3.43Å; S303-F307 WeakPolarHBondContact O-CB 3.43Å; S303-F307 PolarHBondContact O-N 3.03Å |
| 304 | I | 96.6 | Very high | 93.9 | Very high | 36 Ų | 36 | 43 Ų | 43 | 19% | 0.185 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -58.7 | -50.2 | 172.2 | -66.4 | 169.4 | 0 | 0 | 0 | 109.7 | F300 L301 A306 F307 V308 C357 A360 | F300-I304 HydrophobicContact CD1-CD1 3.78Å; F300-I304 HydrophobicContact CD1-CG1 3.98Å; F300-I304 HydrophobicContact CE1-CD1 3.9Å; F300-I304 HydrophobicContact CE1-CG1 3.89Å; F300-I304 WeakPolarHBondContact O-CG1 3.4Å; F300-I304 PolarHBondContact O-N 2.97Å; L301-I304 PolarHBondContact O-N 2.9Å; I304-A306 VanDerWaalsContact C-N 3.33Å; I304-A306 PolarHBondContact O-N 2.92Å; I304-F307 PolarHBondContact O-N 3.39Å; I304-V308 WeakPolarHBondContact O-CG2 3.45Å; I304-V308 PolarHBondContact O-N 3.17Å; I304-C357 HydrophobicContact CD1-CB 3.98Å; I304-A360 HydrophobicContact CB-CB 4.45Å; I304-A360 HydrophobicContact CG2-CB 4.24Å |
| 305 | L | 96.6 | Very high | 93.7 | Very high | 1 Ų | 1 | 42.3 Ų | 42.3 | 1% | 0.005 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -54.2 | -50.6 | 176.6 | -178.8 | 165.4 | 0 | 0 | 0 | 111.3 | L284 L301 F307 V308 D309 A360 F363 G364 | L284-L305 HydrophobicContact CD2-CD1 4Å; L301-L305 WeakPolarHBondContact O-CB 3.41Å; L301-L305 PolarHBondContact O-N 3.48Å; L305-F307 PolarHBondContact O-N 3.27Å; L305-V308 PolarHBondContact O-N 2.91Å; L305-D309 WeakPolarHBondContact O-CB 3.24Å; L305-D309 PolarHBondContact O-N 3.39Å; L305-A360 WeakPolarHBondContact CA-O 3.47Å; L305-A360 HydrophobicContact CB-CB 4.41Å; L305-F363 HydrophobicContact CD1-CD1 3.25Å; L305-F363 HydrophobicContact CD1-CE1 3.49Å; L305-F363 VanDerWaalsContact CD1-CE1 3.49Å; L305-F363 HydrophobicContact CD1-CG 4.03Å; L305-F363 HydrophobicContact CD1-CZ 4.42Å; L305-F363 HydrophobicContact CG-CD1 4.3Å; L305-G364 WeakPolarHBondContact O-CA 3.43Å |
| 306 | A | 96 | Very high | 93.9 | Very high | 0 Ų | 0 | 42 Ų | 42 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -64 | -39.7 | -178.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | P155 L158 C159 L302 S303 I304 D309 M310 | P155-A306 HydrophobicContact CB-CB 4.35Å; P155-A306 WeakPolarHBondContact CB-O 3.41Å; P155-A306 WeakPolarHBondContact O-CB 3.45Å; L158-A306 HydrophobicContact CB-CB 3.9Å; L158-A306 HydrophobicContact CD2-CB 3.95Å; L158-A306 HydrophobicContact CG-CB 3.9Å; C159-A306 HydrophobicContact CB-CB 3.94Å; L302-A306 VanDerWaalsContact O-CB 3.27Å; L302-A306 WeakPolarHBondContact O-CB 3.43Å; L302-A306 PolarHBondContact O-N 3.13Å; S303-A306 PolarHBondContact O-N 3.43Å; I304-A306 VanDerWaalsContact C-N 3.33Å; I304-A306 PolarHBondContact O-N 2.92Å; A306-D309 PolarHBondContact O-N 2.85Å; A306-M310 WeakPolarHBondContact O-CB 3.47Å; A306-M310 PolarHBondContact O-N 2.91Å |
| 307 | F | 95.6 | Very high | 93.7 | Very high | 127 Ų | 127 | 36 Ų | 36 | 56% | 0.557 | 19% | 0.19 | S | C | * | . | H | α-helix | trans | -63 | -43.1 | 176 | -176.5 | -100.1 | 0 | 0 | 0 | 111.8 | S303 I304 L305 M310 V311 | S303-F307 WeakPolarHBondContact O-CB 3.43Å; S303-F307 PolarHBondContact O-N 3.03Å; I304-F307 PolarHBondContact O-N 3.39Å; L305-F307 PolarHBondContact O-N 3.27Å; F307-M310 HydrophobicContact CD2-CE 4.28Å; F307-M310 VanDerWaalsContact O-CB 3.27Å; F307-M310 WeakPolarHBondContact O-CB 3.41Å; F307-M310 PolarHBondContact O-N 3.49Å; F307-V311 PolarHBondContact O-N 3.19Å |
| 308 | V | 96.9 | Very high | 93.5 | Very high | 40 Ų | 40 | 37.5 Ų | 37.5 | 24% | 0.242 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -68.9 | -41.4 | 177.5 | -179.2 | 0 | 0 | 0 | 0 | 111.6 | I304 L305 M310 V311 A312 G361 F365 | I304-V308 WeakPolarHBondContact O-CG2 3.45Å; I304-V308 PolarHBondContact O-N 3.17Å; L305-V308 PolarHBondContact O-N 2.91Å; V308-M310 VanDerWaalsContact C-N 3.27Å; V308-M310 PolarHBondContact O-N 2.9Å; V308-V311 PolarHBondContact O-N 3.5Å; V308-V311 VanDerWaalsContact O-N 3.15Å; V308-A312 VanDerWaalsContact O-CB 3.26Å; V308-A312 WeakPolarHBondContact O-CB 3.44Å; V308-A312 PolarHBondContact O-N 3.32Å; V308-G361 WeakPolarHBondContact CG1-O 3.39Å; V308-F365 HydrophobicContact CG1-CB 3.83Å |
| 309 | D | 94.8 | Very high | 93.5 | Very high | 3 Ų | 3 | 39.8 Ų | 39.8 | 2% | 0.016 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -55.7 | -42.6 | 172.8 | 175.6 | 12.8 | 0 | 0 | 0 | 111.3 | L305 A306 V311 A312 R313 G364 G368 | L305-D309 WeakPolarHBondContact O-CB 3.24Å; L305-D309 PolarHBondContact O-N 3.39Å; A306-D309 PolarHBondContact O-N 2.85Å; D309-V311 PolarHBondContact O-N 3.13Å; D309-A312 PolarHBondContact O-N 3.34Å; D309-R313 VanDerWaalsContact CG-NH2 3.34Å; D309-R313 VanDerWaalsContact O-CB 3.27Å; D309-R313 WeakPolarHBondContact O-CB 3.12Å; D309-R313 PolarHBondContact O-N 2.86Å; D309-R313 IonicContact OD1-CZ 3.85Å; D309-R313 IonicContact OD1-NE 2.83Å; D309-R313 PolarHBondContact OD1-NE 3.13Å; D309-R313 IonicContact OD1-NH2 3.75Å; D309-R313 PolarHBondContact OD1-NH2 3.08Å; D309-R313 IonicContact OD2-CZ 2.71Å; D309-R313 IonicContact OD2-NH2 3.66Å; D309-R313 PolarHBondContact OD2-NH2 3.29Å; D309-G364 WeakPolarHBondContact CA-O 3.19Å; D309-G368 WeakPolarHBondContact OD1-CA 3.24Å |
| 310 | M | 91.8 | Very high | 93.4 | Very high | 48 Ų | 48 | 39.8 Ų | 39.8 | 24% | 0.236 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -54.2 | -38.2 | 178 | -161.8 | -173 | -44.4 | 0 | 0 | 113.1 | P155 V156 A306 F307 V308 P314 | P155-M310 HydrophobicContact CB-CB 3.93Å; P155-M310 HydrophobicContact CB-CE 4.47Å; P155-M310 HydrophobicContact CB-CG 4.38Å; P155-M310 HydrophobicContact CG-CB 3.94Å; P155-M310 HydrophobicContact CG-CG 4.02Å; V156-M310 HydrophobicContact CB-CE 4.39Å; V156-M310 HydrophobicContact CG2-CE 3.53Å; V156-M310 HydrophobicContact CG2-CG 4.42Å; V156-M310 HydrophobicContact CG2-SD 3.59Å; V156-M310 VanDerWaalsContact CG2-SD 3.59Å; A306-M310 WeakPolarHBondContact O-CB 3.47Å; A306-M310 PolarHBondContact O-N 2.91Å; F307-M310 HydrophobicContact CD2-CE 4.28Å; F307-M310 VanDerWaalsContact O-CB 3.27Å; F307-M310 WeakPolarHBondContact O-CB 3.41Å; F307-M310 PolarHBondContact O-N 3.49Å; V308-M310 VanDerWaalsContact C-N 3.27Å; V308-M310 PolarHBondContact O-N 2.9Å; M310-P314 WeakPolarHBondContact O-CD 3.25Å; M310-P314 WeakPolarHBondContact O-CG 3.38Å |
| 311 | V | 93.2 | Very high | 93 | Very high | 90 Ų | 90 | 38.5 Ų | 38.5 | 55% | 0.545 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -87.9 | -38.3 | 179.6 | -177.9 | 0 | 0 | 0 | 0 | 111.5 | F307 V308 D309 R313 S315 | F307-V311 PolarHBondContact O-N 3.19Å; V308-V311 PolarHBondContact O-N 3.5Å; V308-V311 VanDerWaalsContact O-N 3.15Å; D309-V311 PolarHBondContact O-N 3.13Å; V311-R313 PolarHBondContact O-N 3.05Å; V311-S315 WeakPolarHBondContact O-CB 3.32Å; V311-S315 PolarHBondContact O-N 3.36Å; V311-S315 PolarHBondContact O-OG 2.84Å |
| 312 | A | 94.3 | Very high | 92.7 | Very high | 2 Ų | 2 | 41.1 Ų | 41.1 | 2% | 0.017 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -65.9 | -38.3 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | V308 D309 S315 M316 F365 | V308-A312 VanDerWaalsContact O-CB 3.26Å; V308-A312 WeakPolarHBondContact O-CB 3.44Å; V308-A312 PolarHBondContact O-N 3.32Å; D309-A312 PolarHBondContact O-N 3.34Å; A312-S315 VanDerWaalsContact CA-OG 3.31Å; A312-S315 WeakPolarHBondContact CA-OG 3.46Å; A312-S315 PolarHBondContact O-N 2.83Å; A312-S315 PolarHBondContact O-OG 3.22Å; A312-M316 VanDerWaalsContact O-CB 3.27Å; A312-M316 WeakPolarHBondContact O-CB 3.26Å; A312-M316 VanDerWaalsContact O-CG 3.29Å; A312-M316 WeakPolarHBondContact O-CG 3.23Å; A312-M316 PolarHBondContact O-N 2.88Å; A312-F365 HydrophobicContact CB-CB 4.37Å; A312-F365 HydrophobicContact CB-CD2 3.62Å; A312-F365 HydrophobicContact CB-CE2 4.23Å; A312-F365 HydrophobicContact CB-CG 4.25Å |
| 313 | R | 90.8 | Very high | 92.4 | Very high | 32 Ų | 32 | 50.4 Ų | 50.4 | 12% | 0.121 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -67.5 | -48.7 | -173.3 | -173 | -174.6 | -60.8 | -155.2 | -2.6 | 113.4 | D309 V311 G317 S372 | D309-R313 VanDerWaalsContact CG-NH2 3.34Å; D309-R313 VanDerWaalsContact O-CB 3.27Å; D309-R313 WeakPolarHBondContact O-CB 3.12Å; D309-R313 PolarHBondContact O-N 2.86Å; D309-R313 IonicContact OD1-CZ 3.85Å; D309-R313 IonicContact OD1-NE 2.83Å; D309-R313 PolarHBondContact OD1-NE 3.13Å; D309-R313 IonicContact OD1-NH2 3.75Å; D309-R313 PolarHBondContact OD1-NH2 3.08Å; D309-R313 IonicContact OD2-CZ 2.71Å; D309-R313 IonicContact OD2-NH2 3.66Å; D309-R313 PolarHBondContact OD2-NH2 3.29Å; V311-R313 PolarHBondContact O-N 3.05Å; R313-G317 PolarHBondContact O-N 3.39Å; R313-S372 VanDerWaalsContact O-CB 3.25Å; R313-S372 WeakPolarHBondContact O-CB 3.35Å |
| 314 | P | 89.6 | Confident | 92.3 | Very high | 74 Ų | 74 | 54.8 Ų | 54.8 | 48% | 0.481 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -65.8 | -41.3 | 173.3 | -20.8 | 33.5 | 0 | 0 | 0 | 112.4 | M310 G317 L318 | M310-P314 WeakPolarHBondContact O-CD 3.25Å; M310-P314 WeakPolarHBondContact O-CG 3.38Å; P314-G317 PolarHBondContact O-N 3.46Å; P314-L318 WeakPolarHBondContact O-CG 3.3Å; P314-L318 PolarHBondContact O-N 2.96Å |
| 315 | S | 91.6 | Very high | 92.1 | Very high | 43 Ų | 43 | 55 Ų | 55 | 30% | 0.301 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -63.7 | -48.7 | -178.3 | 56.3 | 0 | 0 | 0 | 0 | 112 | V311 A312 G317 L318 V319 | V311-S315 WeakPolarHBondContact O-CB 3.32Å; V311-S315 PolarHBondContact O-N 3.36Å; V311-S315 PolarHBondContact O-OG 2.84Å; A312-S315 VanDerWaalsContact CA-OG 3.31Å; A312-S315 WeakPolarHBondContact CA-OG 3.46Å; A312-S315 PolarHBondContact O-N 2.83Å; A312-S315 PolarHBondContact O-OG 3.22Å; S315-G317 VanDerWaalsContact C-N 3.33Å; S315-G317 PolarHBondContact O-N 3.43Å; S315-L318 WeakPolarHBondContact O-CB 3.48Å; S315-L318 PolarHBondContact O-N 3.44Å; S315-V319 VanDerWaalsContact O-CG2 3.32Å; S315-V319 WeakPolarHBondContact O-CG2 3.32Å; S315-V319 PolarHBondContact O-N 2.84Å |
| 316 | M | 93.6 | Very high | 91.7 | Very high | 27 Ų | 27 | 57.4 Ų | 57.4 | 13% | 0.133 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -68.6 | -31.5 | 177.3 | -66 | -60.3 | 104.1 | 0 | 0 | 112.6 | A312 L318 V319 A320 F332 F365 W369 | A312-M316 VanDerWaalsContact O-CB 3.27Å; A312-M316 WeakPolarHBondContact O-CB 3.26Å; A312-M316 VanDerWaalsContact O-CG 3.29Å; A312-M316 WeakPolarHBondContact O-CG 3.23Å; A312-M316 PolarHBondContact O-N 2.88Å; M316-L318 VanDerWaalsContact C-N 3.35Å; M316-V319 HydrophobicContact CE-CG2 4Å; M316-V319 PolarHBondContact O-N 3.39Å; M316-A320 WeakPolarHBondContact O-CB 3.42Å; M316-A320 PolarHBondContact O-N 3.23Å; M316-F332 HydrophobicContact SD-CZ 4.16Å; M316-F365 HydrophobicContact CE-CE2 4.11Å; M316-F365 HydrophobicContact CE-CZ 3.95Å; M316-F365 HydrophobicContact CG-CE2 4.39Å; M316-F365 HydrophobicContact CG-CZ 4.26Å; M316-F365 HydrophobicContact SD-CE2 4.39Å; M316-F365 HydrophobicContact SD-CZ 3.84Å; M316-W369 HydrophobicContact CB-CB 4.19Å; M316-W369 HydrophobicContact CB-CG 4.14Å; M316-W369 HydrophobicContact CG-CB 3.79Å; M316-W369 HydrophobicContact CG-CG 3.86Å; M316-W369 HydrophobicContact SD-CD2 4.36Å; M316-W369 HydrophobicContact SD-CG 4.25Å |
| 317 | G | 88.5 | Confident | 91.3 | Very high | 17 Ų | 17 | 61.3 Ų | 61.3 | 18% | 0.175 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -63.9 | -36.4 | 170.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | R313 P314 S315 N321 | R313-G317 PolarHBondContact O-N 3.39Å; P314-G317 PolarHBondContact O-N 3.46Å; S315-G317 VanDerWaalsContact C-N 3.33Å; S315-G317 PolarHBondContact O-N 3.43Å; G317-N321 PolarHBondContact O-ND2 3.01Å |
| 318 | L | 88.6 | Confident | 91.2 | Very high | 129 Ų | 129 | 63.5 Ų | 63.5 | 68% | 0.675 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -69.6 | -44.2 | 172.8 | -69.9 | 171.1 | 0 | 0 | 0 | 111.3 | P314 S315 M316 A320 N321 | P314-L318 WeakPolarHBondContact O-CG 3.3Å; P314-L318 PolarHBondContact O-N 2.96Å; S315-L318 WeakPolarHBondContact O-CB 3.48Å; S315-L318 PolarHBondContact O-N 3.44Å; M316-L318 VanDerWaalsContact C-N 3.35Å; L318-A320 VanDerWaalsContact C-N 3.33Å; L318-A320 PolarHBondContact O-N 3.24Å; L318-N321 PolarHBondContact O-N 3.02Å; L318-N321 VanDerWaalsContact O-N 3.09Å |
| 319 | V | 93.1 | Very high | 91 | Very high | 49 Ų | 49 | 61.6 Ų | 61.6 | 30% | 0.297 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -59 | -43.6 | 177 | 171.2 | 0 | 0 | 0 | 0 | 111.1 | S315 M316 N321 T322 I325 F332 | S315-V319 VanDerWaalsContact O-CG2 3.32Å; S315-V319 WeakPolarHBondContact O-CG2 3.32Å; S315-V319 PolarHBondContact O-N 2.84Å; M316-V319 HydrophobicContact CE-CG2 4Å; M316-V319 PolarHBondContact O-N 3.39Å; V319-N321 PolarHBondContact O-N 2.85Å; V319-N321 VanDerWaalsContact O-N 3.11Å; V319-T322 WeakPolarHBondContact O-CB 3.47Å; V319-T322 WeakPolarHBondContact O-CG2 3.39Å; V319-T322 PolarHBondContact O-N 3.14Å; V319-T322 VanDerWaalsContact O-N 3.08Å; V319-T322 PolarHBondContact O-OG1 3.31Å; V319-I325 HydrophobicContact CG1-CD1 3.3Å; V319-F332 HydrophobicContact CB-CZ 4.37Å; V319-F332 HydrophobicContact CG1-CE2 4.11Å; V319-F332 HydrophobicContact CG1-CZ 3.72Å |
| 320 | A | 89.4 | Confident | 90.9 | Very high | 1 Ų | 1 | 61.9 Ų | 61.9 | 1% | 0.008 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -59.4 | -23.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | M316 L318 R326 I329 F332 V373 | M316-A320 WeakPolarHBondContact O-CB 3.42Å; M316-A320 PolarHBondContact O-N 3.23Å; L318-A320 VanDerWaalsContact C-N 3.33Å; L318-A320 PolarHBondContact O-N 3.24Å; A320-R326 WeakPolarHBondContact O-CA 3.28Å; A320-I329 HydrophobicContact CB-CD1 4.2Å; A320-F332 HydrophobicContact CB-CD1 4.11Å; A320-F332 HydrophobicContact CB-CE1 3.9Å; A320-V373 HydrophobicContact CB-CG2 4.22Å |
| 321 | N | 86.5 | Confident | 91.1 | Very high | 81 Ų | 81 | 62.5 Ų | 62.5 | 43% | 0.433 | 33% | 0.328 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -93.9 | 2.4 | -179.3 | -75.8 | -50.3 | 0 | 0 | 0 | 114.1 | G317 L318 V319 R326 | G317-N321 PolarHBondContact O-ND2 3.01Å; L318-N321 PolarHBondContact O-N 3.02Å; L318-N321 VanDerWaalsContact O-N 3.09Å; V319-N321 PolarHBondContact O-N 2.85Å; V319-N321 VanDerWaalsContact O-N 3.11Å; N321-R326 PolarHBondContact OD1-NH1 2.98Å |
| 322 | T | 89.6 | Confident | 91.2 | Very high | 56 Ų | 56 | 59.7 Ų | 59.7 | 34% | 0.344 | 31% | 0.309 | S | S | . | . | S | Bend | trans | -73.3 | 151.5 | 175.9 | 63 | 0 | 0 | 0 | 0 | 111.7 | V319 P324 I325 R326 | V319-T322 WeakPolarHBondContact O-CB 3.47Å; V319-T322 WeakPolarHBondContact O-CG2 3.39Å; V319-T322 PolarHBondContact O-N 3.14Å; V319-T322 VanDerWaalsContact O-N 3.08Å; V319-T322 PolarHBondContact O-OG1 3.31Å; T322-P324 VanDerWaalsContact C-CD 3.44Å; T322-I325 PolarHBondContact O-N 3.38Å; T322-I325 VanDerWaalsContact O-N 3.17Å; T322-R326 WeakPolarHBondContact O-CB 3.3Å; T322-R326 PolarHBondContact O-N 2.91Å |
| 323 | K | 88.5 | Confident | 91.3 | Very high | 195 Ų | 195 | 59.8 Ų | 59.8 | 85% | 0.848 | 31% | 0.309 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -49.8 | -42.7 | -179.1 | -68.8 | -175.1 | 179.4 | -179.8 | 0 | 115 | P327 | K323-P327 WeakPolarHBondContact O-CD 3.26Š|
| 324 | P | 92.7 | Very high | 91.6 | Very high | 99 Ų | 99 | 58.3 Ų | 58.3 | 64% | 0.643 | 30% | 0.303 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77 | -29.2 | -178.7 | 27.9 | -33.8 | 0 | 0 | 0 | 113.6 | T322 | T322-P324 VanDerWaalsContact C-CD 3.44Š|
| 325 | I | 91.8 | Very high | 92 | Very high | 41 Ų | 41 | 56.9 Ų | 56.9 | 21% | 0.21 | 30% | 0.298 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -91 | -38.1 | -172.4 | -63.3 | 174.7 | 0 | 0 | 0 | 111.1 | V319 T322 R328 I329 F332 | V319-I325 HydrophobicContact CG1-CD1 3.3Å; T322-I325 PolarHBondContact O-N 3.38Å; T322-I325 VanDerWaalsContact O-N 3.17Å; I325-R328 CarbonylContact O-C 3.18Å; I325-R328 WeakPolarHBondContact O-CA 3.41Å; I325-R328 PolarHBondContact O-N 3.01Å; I325-I329 PolarHBondContact O-N 3.19Å; I325-F332 HydrophobicContact CD1-CE2 4.37Å; I325-F332 HydrophobicContact CG2-CB 3.93Å; I325-F332 HydrophobicContact CG2-CD1 3.99Å; I325-F332 HydrophobicContact CG2-CD2 3.95Å; I325-F332 HydrophobicContact CG2-CE1 4.49Å; I325-F332 HydrophobicContact CG2-CE2 4.46Å; I325-F332 HydrophobicContact CG2-CG 3.7Å |
| 326 | R | 88.7 | Confident | 92.3 | Very high | 52 Ų | 52 | 54.8 Ų | 54.8 | 20% | 0.196 | 28% | 0.283 | C | S | . | . | G | 310 helix | trans | -54.3 | -46.5 | -174.6 | -174.7 | 70.2 | -171.3 | -167.5 | 13.2 | 113.7 | A320 N321 T322 R328 I329 E376 D380 | A320-R326 WeakPolarHBondContact O-CA 3.28Å; N321-R326 PolarHBondContact OD1-NH1 2.98Å; T322-R326 WeakPolarHBondContact O-CB 3.3Å; T322-R326 PolarHBondContact O-N 2.91Å; R326-R328 PolarHBondContact O-N 3.07Å; R326-R328 VanDerWaalsContact O-N 3.12Å; R326-I329 WeakPolarHBondContact O-CB 3.38Å; R326-I329 PolarHBondContact O-N 3.43Å; R326-E376 IonicContact CZ-OE2 3.48Å; R326-E376 IonicContact NH1-OE2 2.74Å; R326-E376 PolarHBondContact NH1-OE2 3.01Å; R326-E376 IonicContact NH2-OE2 2.98Å; R326-E376 PolarHBondContact NH2-OE2 3.32Å; R326-D380 IonicContact NH2-OD1 3.27Å |
| 327 | P | 88.9 | Confident | 92.5 | Very high | 82 Ų | 82 | 53.5 Ų | 53.5 | 53% | 0.532 | 28% | 0.277 | S | S | . | . | G | 310 helix | trans | -65.3 | -15.7 | 178.2 | -21 | 34.4 | 0 | 0 | 0 | 114.1 | K323 Y445 | K323-P327 WeakPolarHBondContact O-CD 3.26Å; P327-Y445 PolarHBondContact O-OH 3.48Å |
| 328 | R | 92.4 | Very high | 92.9 | Very high | 172 Ų | 172 | 54.9 Ų | 54.9 | 65% | 0.649 | 28% | 0.282 | S | S | * | . | G | 310 helix | trans | -122.7 | 24.7 | -175 | -66.6 | -177.4 | -175.7 | 179.5 | 2.4 | 111.7 | I325 R326 Q330 Y331 F332 | I325-R328 CarbonylContact O-C 3.18Å; I325-R328 WeakPolarHBondContact O-CA 3.41Å; I325-R328 PolarHBondContact O-N 3.01Å; R326-R328 PolarHBondContact O-N 3.07Å; R326-R328 VanDerWaalsContact O-N 3.12Å; R328-Q330 PolarHBondContact O-N 3.08Å; R328-Q330 VanDerWaalsContact O-N 3.13Å; R328-Y331 HydrophobicContact CB-CD2 4.07Å; R328-Y331 HydrophobicContact CG-CD2 4.43Å; R328-Y331 PolarHBondContact O-N 3.48Å; R328-F332 PolarHBondContact O-N 2.94Å |
| 329 | I | 91.9 | Very high | 93.4 | Very high | 0 Ų | 0 | 50.4 Ų | 50.4 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -58.2 | -30.3 | -173.7 | -168.4 | 167.8 | 0 | 0 | 0 | 112.9 | A320 I325 R326 Y331 F332 F333 V373 E376 D380 | A320-I329 HydrophobicContact CB-CD1 4.2Å; I325-I329 PolarHBondContact O-N 3.19Å; R326-I329 WeakPolarHBondContact O-CB 3.38Å; R326-I329 PolarHBondContact O-N 3.43Å; I329-Y331 VanDerWaalsContact C-N 3.35Å; I329-Y331 PolarHBondContact O-N 3.22Å; I329-F332 WeakPolarHBondContact O-CB 3.4Å; I329-F332 PolarHBondContact O-N 3.09Å; I329-F333 PolarHBondContact O-N 3.39Å; I329-V373 HydrophobicContact CD1-CG1 4.37Å; I329-V373 HydrophobicContact CG1-CG1 3.9Å; I329-E376 HydrophobicContact CD1-CB 3.82Å; I329-D380 HydrophobicContact CG2-CB 4.15Å |
| 330 | Q | 93.1 | Very high | 93.6 | Very high | 10 Ų | 10 | 48.1 Ų | 48.1 | 5% | 0.047 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -62.7 | -37.1 | 176.5 | -68.1 | 173.1 | 9 | 0 | 0 | 113.1 | R328 F333 A334 T377 M441 Y445 | R328-Q330 PolarHBondContact O-N 3.08Å; R328-Q330 VanDerWaalsContact O-N 3.13Å; Q330-F333 WeakPolarHBondContact O-CB 3.32Å; Q330-F333 PolarHBondContact O-N 3.34Å; Q330-A334 PolarHBondContact O-N 3.2Å; Q330-A334 VanDerWaalsContact O-N 3.07Å; Q330-T377 HydrophobicContact CB-CG2 4.44Å; Q330-T377 HydrophobicContact CG-CG2 3.74Å; Q330-M441 HydrophobicContact CB-CB 4.2Å; Q330-M441 HydrophobicContact CB-CG 4.07Å; Q330-M441 HydrophobicContact CG-CG 4.48Å; Q330-M441 HydrophobicContact CG-SD 4.43Å; Q330-M441 PolarHBondContact OE1-SD 2.73Å; Q330-Y445 HydrophobicContact CB-CE2 4.25Å |
| 331 | Y | 95.9 | Very high | 94 | Very high | 61 Ų | 61 | 48 Ų | 48 | 24% | 0.239 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -73.7 | -35.7 | 174.4 | -61.9 | -66.9 | 0 | 0 | 0 | 111.7 | R328 I329 F333 A334 A335 F438 G442 Y445 | R328-Y331 HydrophobicContact CB-CD2 4.07Å; R328-Y331 HydrophobicContact CG-CD2 4.43Å; R328-Y331 PolarHBondContact O-N 3.48Å; I329-Y331 VanDerWaalsContact C-N 3.35Å; I329-Y331 PolarHBondContact O-N 3.22Å; Y331-F333 VanDerWaalsContact C-N 3.26Å; Y331-F333 PolarHBondContact O-N 3.27Å; Y331-A334 PolarHBondContact O-N 3.01Å; Y331-A335 WeakPolarHBondContact O-CB 3.31Å; Y331-A335 PolarHBondContact O-N 2.84Å; Y331-F438 AromaticContact CD1-CD2 3.6Å; Y331-F438 HydrophobicContact CD1-CD2 3.6Å; Y331-F438 HydrophobicContact CD1-CE1 4.46Å; Y331-F438 AromaticContact CD1-CE2 3.47Å; Y331-F438 HydrophobicContact CD1-CE2 3.47Å; Y331-F438 VanDerWaalsContact CD1-CE2 3.47Å; Y331-F438 HydrophobicContact CD1-CG 4.14Å; Y331-F438 AromaticContact CD1-CZ 3.94Å; Y331-F438 HydrophobicContact CD1-CZ 3.94Å; Y331-F438 HydrophobicContact CE1-CD2 4.36Å; Y331-F438 HydrophobicContact CE1-CE1 4.43Å; Y331-F438 HydrophobicContact CE1-CE2 4.21Å; Y331-F438 HydrophobicContact CE1-CZ 4.24Å; Y331-F438 HydrophobicContact CG-CE2 4.19Å; Y331-G442 WeakPolarHBondContact OH-CA 3.43Å; Y331-Y445 HydrophobicContact CD2-CE2 4.34Å; Y331-Y445 AromaticContact CE2-CD2 3.83Å; Y331-Y445 HydrophobicContact CE2-CD2 3.83Å; Y331-Y445 AromaticContact CE2-CE2 3.75Å; Y331-Y445 HydrophobicContact CE2-CE2 3.75Å; Y331-Y445 AromaticContact CZ-CD2 3.95Å |
| 332 | F | 96.4 | Very high | 94.5 | Very high | 31 Ų | 31 | 47.1 Ų | 47.1 | 14% | 0.136 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -61.7 | -37.2 | 173.3 | -169.9 | -114.5 | 0 | 0 | 0 | 111.3 | M316 V319 A320 I325 R328 I329 S336 W369 V373 | M316-F332 HydrophobicContact SD-CZ 4.16Å; V319-F332 HydrophobicContact CB-CZ 4.37Å; V319-F332 HydrophobicContact CG1-CE2 4.11Å; V319-F332 HydrophobicContact CG1-CZ 3.72Å; A320-F332 HydrophobicContact CB-CD1 4.11Å; A320-F332 HydrophobicContact CB-CE1 3.9Å; I325-F332 HydrophobicContact CD1-CE2 4.37Å; I325-F332 HydrophobicContact CG2-CB 3.93Å; I325-F332 HydrophobicContact CG2-CD1 3.99Å; I325-F332 HydrophobicContact CG2-CD2 3.95Å; I325-F332 HydrophobicContact CG2-CE1 4.49Å; I325-F332 HydrophobicContact CG2-CE2 4.46Å; I325-F332 HydrophobicContact CG2-CG 3.7Å; R328-F332 PolarHBondContact O-N 2.94Å; I329-F332 WeakPolarHBondContact O-CB 3.4Å; I329-F332 PolarHBondContact O-N 3.09Å; F332-S336 PolarHBondContact O-N 3.42Å; F332-W369 AromaticContact CD1-NE1 3.37Å; F332-W369 AromaticContact CD2-CZ2 3.52Å; F332-W369 HydrophobicContact CD2-CZ2 3.52Å; F332-W369 AromaticContact CD2-NE1 3.93Å; F332-W369 AromaticContact CE1-CD1 3.67Å; F332-W369 AromaticContact CE1-CE2 3.88Å; F332-W369 HydrophobicContact CE1-CZ2 4.37Å; F332-W369 AromaticContact CE1-NE1 2.97Å; F332-W369 AromaticContact CE2-CE2 3.6Å; F332-W369 HydrophobicContact CE2-CH2 4.32Å; F332-W369 AromaticContact CE2-CZ2 3.32Å; F332-W369 HydrophobicContact CE2-CZ2 3.32Å; F332-W369 AromaticContact CE2-NE1 3.57Å; F332-W369 HydrophobicContact CG-CZ2 4.12Å; F332-W369 AromaticContact CG-NE1 3.83Å; F332-W369 AromaticContact CZ-CD1 3.89Å; F332-W369 AromaticContact CZ-CE2 3.53Å; F332-W369 AromaticContact CZ-CZ2 3.79Å; F332-W369 HydrophobicContact CZ-CZ2 3.79Å; F332-W369 AromaticContact CZ-NE1 3.08Å; F332-W369 WeakPolarHBondContact O-CZ2 3.35Å; F332-V373 HydrophobicContact CD1-CG1 4.3Å; F332-V373 HydrophobicContact CD1-CG2 3.67Å; F332-V373 HydrophobicContact CE1-CG2 3.67Å |
| 333 | F | 96.4 | Very high | 94.8 | Very high | 4 Ų | 4 | 45.2 Ų | 45.2 | 2% | 0.018 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -63.4 | -52.2 | 171.2 | -176.6 | -124.3 | 0 | 0 | 0 | 111.9 | Y266 M273 I329 Q330 Y331 A335 S336 I337 L370 V373 L374 T377 L437 | Y266-F333 HydrophobicContact CD2-CE1 4.45Å; Y266-F333 AromaticContact CE2-CE1 3.98Å; Y266-F333 HydrophobicContact CE2-CE1 3.98Å; Y266-F333 HydrophobicContact CE2-CZ 4.43Å; M273-F333 HydrophobicContact SD-CZ 4.33Å; I329-F333 PolarHBondContact O-N 3.39Å; Q330-F333 WeakPolarHBondContact O-CB 3.32Å; Q330-F333 PolarHBondContact O-N 3.34Å; Y331-F333 VanDerWaalsContact C-N 3.26Å; Y331-F333 PolarHBondContact O-N 3.27Å; F333-A335 VanDerWaalsContact C-N 3.27Å; F333-A335 PolarHBondContact O-N 2.94Å; F333-S336 WeakPolarHBondContact O-CB 3.4Å; F333-S336 PolarHBondContact O-N 3.34Å; F333-S336 PolarHBondContact O-OG 3.03Å; F333-I337 HydrophobicContact CD1-CD1 4.08Å; F333-I337 HydrophobicContact CE1-CD1 3.67Å; F333-I337 HydrophobicContact CE2-CD1 4.3Å; F333-I337 HydrophobicContact CE2-CG1 4.45Å; F333-I337 HydrophobicContact CZ-CD1 3.78Å; F333-I337 HydrophobicContact CZ-CG1 4.37Å; F333-I337 PolarHBondContact O-N 3.23Å; F333-L370 HydrophobicContact CE2-CG 4.21Å; F333-V373 HydrophobicContact CB-CG1 3.7Å; F333-V373 HydrophobicContact CD2-CB 4.24Å; F333-V373 HydrophobicContact CD2-CG1 3.99Å; F333-V373 HydrophobicContact CG-CG1 4.25Å; F333-L374 HydrophobicContact CE2-CB 4.23Å; F333-L374 HydrophobicContact CE2-CD1 3.77Å; F333-L374 HydrophobicContact CZ-CD1 3.51Å; F333-T377 HydrophobicContact CB-CG2 4.41Å; F333-T377 HydrophobicContact CD1-CG2 4.39Å; F333-L437 HydrophobicContact CD1-CD1 4.34Å; F333-L437 HydrophobicContact CE1-CD1 3.9Å |
| 334 | A | 97.1 | Very high | 95.1 | Very high | 1 Ų | 1 | 35.9 Ų | 35.9 | 1% | 0.008 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -57.9 | -39.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | Q330 Y331 S336 I337 V338 L437 F438 | Q330-A334 PolarHBondContact O-N 3.2Å; Q330-A334 VanDerWaalsContact O-N 3.07Å; Y331-A334 PolarHBondContact O-N 3.01Å; A334-S336 VanDerWaalsContact C-N 3.33Å; A334-S336 PolarHBondContact O-N 3.13Å; A334-I337 PolarHBondContact O-N 3Å; A334-V338 WeakPolarHBondContact O-CG2 3.3Å; A334-V338 PolarHBondContact O-N 3.46Å; A334-L437 HydrophobicContact CB-CB 4.44Å; A334-F438 HydrophobicContact CB-CB 3.95Å; A334-F438 HydrophobicContact CB-CD2 4.13Å |
| 335 | A | 97.6 | Very high | 95.3 | Very high | 43 Ų | 43 | 34.7 Ų | 34.7 | 36% | 0.355 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -60.1 | -41.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | Y331 F333 I337 V338 A339 W369 | Y331-A335 WeakPolarHBondContact O-CB 3.31Å; Y331-A335 PolarHBondContact O-N 2.84Å; F333-A335 VanDerWaalsContact C-N 3.27Å; F333-A335 PolarHBondContact O-N 2.94Å; A335-I337 VanDerWaalsContact C-N 3.32Å; A335-I337 PolarHBondContact O-N 2.97Å; A335-V338 PolarHBondContact O-N 3.12Å; A335-A339 WeakPolarHBondContact O-CB 3.46Å; A335-A339 PolarHBondContact O-N 2.91Å; A335-W369 HydrophobicContact CB-CH2 3.85Å; A335-W369 HydrophobicContact CB-CZ2 3.97Å |
| 336 | S | 97.4 | Very high | 95.3 | Very high | 0 Ų | 0 | 37.3 Ų | 37.3 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -62.8 | -37.4 | 176 | 78.7 | 0 | 0 | 0 | 0 | 112.5 | F332 F333 A334 A339 N340 W369 L370 | F332-S336 PolarHBondContact O-N 3.42Å; F333-S336 WeakPolarHBondContact O-CB 3.4Å; F333-S336 PolarHBondContact O-N 3.34Å; F333-S336 PolarHBondContact O-OG 3.03Å; A334-S336 VanDerWaalsContact C-N 3.33Å; A334-S336 PolarHBondContact O-N 3.13Å; S336-A339 PolarHBondContact O-N 3.25Å; S336-N340 PolarHBondContact O-N 3.48Å; S336-N340 PolarHBondContact O-ND2 3.3Å; S336-W369 VanDerWaalsContact CB-CD2 3.5Å; S336-L370 WeakPolarHBondContact OG-CA 3.47Å |
| 337 | I | 97.9 | Very high | 95.4 | Very high | 0 Ų | 0 | 34.9 Ų | 34.9 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -67.9 | -47.4 | 178.8 | -59.8 | 172.7 | 0 | 0 | 0 | 110.2 | M273 F333 A334 A335 A339 N340 G341 L370 L430 L437 | M273-I337 HydrophobicContact CG-CD1 4.45Å; M273-I337 HydrophobicContact CG-CG2 4.06Å; M273-I337 HydrophobicContact SD-CD1 3.61Å; M273-I337 HydrophobicContact SD-CG1 3.69Å; M273-I337 HydrophobicContact SD-CG2 4.33Å; F333-I337 HydrophobicContact CD1-CD1 4.08Å; F333-I337 HydrophobicContact CE1-CD1 3.67Å; F333-I337 HydrophobicContact CE2-CD1 4.3Å; F333-I337 HydrophobicContact CE2-CG1 4.45Å; F333-I337 HydrophobicContact CZ-CD1 3.78Å; F333-I337 HydrophobicContact CZ-CG1 4.37Å; F333-I337 PolarHBondContact O-N 3.23Å; A334-I337 PolarHBondContact O-N 3Å; A335-I337 VanDerWaalsContact C-N 3.32Å; A335-I337 PolarHBondContact O-N 2.97Å; I337-A339 VanDerWaalsContact C-N 3.3Å; I337-A339 PolarHBondContact O-N 3.29Å; I337-N340 PolarHBondContact O-N 2.83Å; I337-G341 PolarHBondContact O-N 3.32Å; I337-L370 HydrophobicContact CG1-CD1 4.02Å; I337-L430 HydrophobicContact CG2-CB 4.35Å; I337-L430 HydrophobicContact CG2-CD2 4.35Å; I337-L430 VanDerWaalsContact CG2-O 3.3Å; I337-L430 WeakPolarHBondContact CG2-O 3.33Å; I337-L437 HydrophobicContact CD1-CD1 3.46Å; I337-L437 VanDerWaalsContact CD1-CD1 3.46Å |
| 338 | V | 98.1 | Very high | 95.5 | Very high | 45 Ų | 45 | 32.1 Ų | 32.1 | 27% | 0.273 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -61.9 | -40.7 | 176.4 | 177.1 | 0 | 0 | 0 | 0 | 110.7 | A334 A335 N340 G341 V342 | A334-V338 WeakPolarHBondContact O-CG2 3.3Å; A334-V338 PolarHBondContact O-N 3.46Å; A335-V338 PolarHBondContact O-N 3.12Å; V338-N340 VanDerWaalsContact C-N 3.34Å; V338-N340 PolarHBondContact O-N 3.37Å; V338-G341 PolarHBondContact O-N 3.4Å; V338-G341 VanDerWaalsContact O-N 3.12Å; V338-V342 HydrophobicContact CG1-CG2 4.13Å; V338-V342 WeakPolarHBondContact O-CG2 3.48Å; V338-V342 PolarHBondContact O-N 2.92Å |
| 339 | A | 97.6 | Very high | 95.3 | Very high | 36 Ų | 36 | 30.1 Ų | 30.1 | 30% | 0.298 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -59.5 | -42.4 | 176 | 0 | 0 | 0 | 0 | 0 | 112.3 | A335 S336 I337 C343 A366 W369 | A335-A339 WeakPolarHBondContact O-CB 3.46Å; A335-A339 PolarHBondContact O-N 2.91Å; S336-A339 PolarHBondContact O-N 3.25Å; I337-A339 VanDerWaalsContact C-N 3.3Å; I337-A339 PolarHBondContact O-N 3.29Å; A339-C343 VanDerWaalsContact O-CB 3.27Å; A339-C343 WeakPolarHBondContact O-CB 3.46Å; A339-C343 PolarHBondContact O-N 2.93Å; A339-A366 HydrophobicContact CB-CB 4.39Å; A339-W369 HydrophobicContact CB-CZ3 4.35Å |
| 340 | N | 97.7 | Very high | 95 | Very high | 0 Ų | 0 | 30.9 Ų | 30.9 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -62 | -45.5 | 172.2 | -79.6 | -90.1 | 0 | 0 | 0 | 111.3 | S336 I337 V338 C343 H344 A366 F367 L430 | S336-N340 PolarHBondContact O-N 3.48Å; S336-N340 PolarHBondContact O-ND2 3.3Å; I337-N340 PolarHBondContact O-N 2.83Å; V338-N340 VanDerWaalsContact C-N 3.34Å; V338-N340 PolarHBondContact O-N 3.37Å; N340-C343 WeakPolarHBondContact O-CB 3.22Å; N340-C343 PolarHBondContact O-N 3.48Å; N340-H344 PolarHBondContact O-CD2 3.21Å; N340-H344 VanDerWaalsContact O-CD2 3.25Å; N340-H344 VanDerWaalsContact O-CG 3.32Å; N340-H344 PolarHBondContact O-N 2.91Å; N340-A366 HydrophobicContact CB-CB 4.42Å; N340-A366 WeakPolarHBondContact ND2-CB 3.23Å; N340-A366 PolarHBondContact ND2-O 3.26Å; N340-F367 PolarHBondContact OD1-N 3.44Å; N340-L430 HydrophobicContact CB-CD1 3.7Å |
| 341 | G | 97.6 | Very high | 94.6 | Very high | 0 Ų | 0 | 35.7 Ų | 35.7 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -61.8 | -45.2 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | I337 V338 H344 M345 G427 | I337-G341 PolarHBondContact O-N 3.32Å; V338-G341 PolarHBondContact O-N 3.4Å; V338-G341 VanDerWaalsContact O-N 3.12Å; G341-H344 PolarHBondContact O-N 3.21Å; G341-M345 PolarHBondContact O-N 3.47Å; G341-G427 VanDerWaalsContact O-CA 3.26Å; G341-G427 WeakPolarHBondContact O-CA 3.49Å |
| 342 | V | 97.1 | Very high | 94.5 | Very high | 62 Ų | 62 | 36.5 Ų | 36.5 | 38% | 0.376 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -62.9 | -43.4 | 174 | 173.9 | 0 | 0 | 0 | 0 | 110.5 | V338 H344 M345 L346 I431 | V338-V342 HydrophobicContact CG1-CG2 4.13Å; V338-V342 WeakPolarHBondContact O-CG2 3.48Å; V338-V342 PolarHBondContact O-N 2.92Å; V342-H344 VanDerWaalsContact C-N 3.29Å; V342-H344 PolarHBondContact O-N 2.97Å; V342-M345 PolarHBondContact O-N 3.31Å; V342-L346 HydrophobicContact CG1-CD1 3.81Å; V342-L346 HydrophobicContact CG1-CG 4.3Å; V342-L346 VanDerWaalsContact O-CG 3.3Å; V342-L346 WeakPolarHBondContact O-CG 3.44Å; V342-L346 PolarHBondContact O-N 3.33Å; V342-I431 HydrophobicContact CG2-CD1 4.16Å; V342-I431 HydrophobicContact CG2-CG1 4.42Å |
| 343 | C | 96.2 | Very high | 94.3 | Very high | 15 Ų | 15 | 37.3 Ų | 37.3 | 10% | 0.101 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -56.7 | -43.3 | 175.8 | -166.9 | 0 | 0 | 0 | 0 | 111.6 | A339 N340 L346 A347 Y359 | A339-C343 VanDerWaalsContact O-CB 3.27Å; A339-C343 WeakPolarHBondContact O-CB 3.46Å; A339-C343 PolarHBondContact O-N 2.93Å; N340-C343 WeakPolarHBondContact O-CB 3.22Å; N340-C343 PolarHBondContact O-N 3.48Å; C343-L346 PolarHBondContact O-N 2.99Å; C343-A347 PolarHBondContact O-N 2.88Å; C343-A347 VanDerWaalsContact O-N 3.09Å; C343-Y359 VanDerWaalsContact O-CE2 3.3Å; C343-Y359 WeakPolarHBondContact O-CE2 3.49Å; C343-Y359 VanDerWaalsContact SG-CE2 3.58Å |
| 344 | H | 95.9 | Very high | 94.3 | Very high | 0 Ų | 0 | 41.9 Ų | 41.9 | 0% | 0 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -69.6 | -36.9 | 177.4 | -63.2 | -34.3 | 0 | 0 | 0 | 113.4 | N340 G341 V342 L346 A347 Y359 F363 L430 | N340-H344 PolarHBondContact O-CD2 3.21Å; N340-H344 VanDerWaalsContact O-CD2 3.25Å; N340-H344 VanDerWaalsContact O-CG 3.32Å; N340-H344 PolarHBondContact O-N 2.91Å; G341-H344 PolarHBondContact O-N 3.21Å; V342-H344 VanDerWaalsContact C-N 3.29Å; V342-H344 PolarHBondContact O-N 2.97Å; H344-L346 VanDerWaalsContact C-N 3.26Å; H344-L346 PolarHBondContact O-N 3.49Å; H344-A347 WeakPolarHBondContact O-CB 3.41Å; H344-A347 PolarHBondContact O-N 3.5Å; H344-Y359 PolarHBondContact CE1-OH 3.41Å; H344-Y359 AromaticContact ND1-CZ 3.92Å; H344-Y359 PolarHBondContact ND1-OH 3.26Å; H344-F363 AromaticContact CE1-CD2 3.45Å; H344-F363 VanDerWaalsContact CE1-CD2 3.45Å; H344-F363 WeakPolarHBondContact CE1-CD2 3.5Å; H344-F363 AromaticContact CE1-CE1 3.93Å; H344-F363 AromaticContact CE1-CE2 3.3Å; H344-F363 WeakPolarHBondContact CE1-CE2 3.48Å; H344-F363 AromaticContact CE1-CG 3.88Å; H344-F363 AromaticContact CE1-CZ 3.56Å; H344-F363 AromaticContact NE2-CE2 3.67Å; H344-L430 VanDerWaalsContact CD2-CD1 3.46Å; H344-L430 WeakPolarHBondContact CD2-CD1 3.48Å |
| 345 | M | 95.1 | Very high | 94.2 | Very high | 74 Ų | 74 | 42.7 Ų | 42.7 | 37% | 0.365 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -63.3 | -34.7 | 174.2 | -76.6 | -162.8 | 67.6 | 0 | 0 | 112.6 | G341 V342 P348 W424 I428 I431 | G341-M345 PolarHBondContact O-N 3.47Å; V342-M345 PolarHBondContact O-N 3.31Å; M345-P348 WeakPolarHBondContact O-CD 3.29Å; M345-W424 PolarHBondContact O-NE1 2.92Å; M345-I428 HydrophobicContact SD-CG1 4.47Å; M345-I431 HydrophobicContact CG-CD1 4.13Å; M345-I431 HydrophobicContact SD-CD1 3.41Å; M345-I431 WeakPolarHBondContact SD-CD1 3.34Å |
| 346 | L | 92.4 | Very high | 94.1 | Very high | 96 Ų | 96 | 40.6 Ų | 40.6 | 50% | 0.503 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -83.5 | -13.6 | 179.5 | -62.9 | 175.7 | 0 | 0 | 0 | 113.1 | V342 C343 H344 L349 | V342-L346 HydrophobicContact CG1-CD1 3.81Å; V342-L346 HydrophobicContact CG1-CG 4.3Å; V342-L346 VanDerWaalsContact O-CG 3.3Å; V342-L346 WeakPolarHBondContact O-CG 3.44Å; V342-L346 PolarHBondContact O-N 3.33Å; C343-L346 PolarHBondContact O-N 2.99Å; H344-L346 VanDerWaalsContact C-N 3.26Å; H344-L346 PolarHBondContact O-N 3.49Å; L346-L349 HydrophobicContact CB-CD1 4.34Å; L346-L349 HydrophobicContact CD2-CD1 3.58Å; L346-L349 WeakPolarHBondContact O-CB 3.38Å; L346-L349 PolarHBondContact O-N 3.14Å; L346-L349 VanDerWaalsContact O-N 3.16Å |
| 347 | A | 91.1 | Very high | 94.1 | Very high | 0 Ų | 0 | 41.9 Ų | 41.9 | 0% | 0 | 25% | 0.247 | C | C | . | . | G | 310 helix | trans | -55.1 | -45.7 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.3 | C343 H344 L349 S350 Y359 Y423 | C343-A347 PolarHBondContact O-N 2.88Å; C343-A347 VanDerWaalsContact O-N 3.09Å; H344-A347 WeakPolarHBondContact O-CB 3.41Å; H344-A347 PolarHBondContact O-N 3.5Å; A347-L349 PolarHBondContact O-N 3.33Å; A347-L349 VanDerWaalsContact O-N 3.12Å; A347-S350 VanDerWaalsContact O-CB 3.22Å; A347-S350 WeakPolarHBondContact O-CB 3.42Å; A347-S350 PolarHBondContact O-N 3.15Å; A347-S350 PolarHBondContact O-OG 3.21Å; A347-S350 VanDerWaalsContact O-OG 3.08Å; A347-Y359 HydrophobicContact CB-CD1 4.43Å; A347-Y359 HydrophobicContact CB-CD2 3.55Å; A347-Y359 HydrophobicContact CB-CE1 4.26Å; A347-Y359 HydrophobicContact CB-CE2 3.34Å; A347-Y359 HydrophobicContact CB-CG 4.11Å; A347-Y423 HydrophobicContact CB-CD1 3.52Å; A347-Y423 HydrophobicContact CB-CE1 4.02Å; A347-Y423 HydrophobicContact CB-CG 4.4Å |
| 348 | P | 90.7 | Very high | 94 | Very high | 25 Ų | 25 | 45.5 Ų | 45.5 | 16% | 0.162 | 27% | 0.268 | C | S | . | . | G | 310 helix | trans | -67.7 | -11.7 | -177.8 | -23.7 | 38.1 | 0 | 0 | 0 | 115.3 | M345 S350 K420 | M345-P348 WeakPolarHBondContact O-CD 3.29Å; P348-S350 PolarHBondContact O-N 3.06Å; P348-K420 HydrophobicContact CB-CB 3.78Å; P348-K420 HydrophobicContact CG-CB 3.96Å |
| 349 | L | 88.5 | Confident | 93.9 | Very high | 129 Ų | 129 | 43.8 Ų | 43.8 | 68% | 0.675 | 26% | 0.257 | S | S | * | . | G | 310 helix | trans | -72.1 | -13.5 | 172.1 | -64.7 | 162.2 | 0 | 0 | 0 | 112 | L346 A347 T351 | L346-L349 HydrophobicContact CB-CD1 4.34Å; L346-L349 HydrophobicContact CD2-CD1 3.58Å; L346-L349 WeakPolarHBondContact O-CB 3.38Å; L346-L349 PolarHBondContact O-N 3.14Å; L346-L349 VanDerWaalsContact O-N 3.16Å; A347-L349 PolarHBondContact O-N 3.33Å; A347-L349 VanDerWaalsContact O-N 3.12Å; L349-T351 PolarHBondContact O-N 3.1Å; L349-T351 VanDerWaalsContact O-N 3.14Å |
| 350 | S | 86.3 | Confident | 93.9 | Very high | 16 Ų | 16 | 42.1 Ų | 42.1 | 11% | 0.112 | 24% | 0.243 | C | C | . | . | trans | -76.8 | 98.2 | 179.7 | -56.1 | 0 | 0 | 0 | 0 | 110.6 | A347 P348 G355 F356 | A347-S350 VanDerWaalsContact O-CB 3.22Å; A347-S350 WeakPolarHBondContact O-CB 3.42Å; A347-S350 PolarHBondContact O-N 3.15Å; A347-S350 PolarHBondContact O-OG 3.21Å; A347-S350 VanDerWaalsContact O-OG 3.08Å; P348-S350 PolarHBondContact O-N 3.06Å; S350-G355 PolarHBondContact OG-O 3.03Å; S350-F356 WeakPolarHBondContact O-CE2 3.41Å | ||
| 351 | T | 83 | Confident | 93.8 | Very high | 111 Ų | 111 | 42.9 Ų | 42.9 | 68% | 0.681 | 25% | 0.251 | S | S | * | . | trans | -89.7 | -21.7 | 176.8 | 55.9 | 0 | 0 | 0 | 0 | 113 | Y293 L349 | Y293-T351 PolarHBondContact OH-O 3.4Å; L349-T351 PolarHBondContact O-N 3.1Å; L349-T351 VanDerWaalsContact O-N 3.14Å | ||
| 352 | T | 94 | Very high | 93.8 | Very high | 78 Ų | 78 | 49.2 Ų | 49.2 | 48% | 0.479 | 28% | 0.279 | S | S | . | . | S | Bend | trans | -108 | 156.4 | -177.6 | 63.7 | 0 | 0 | 0 | 0 | 112.1 | Y293 V354 G355 F356 | Y293-T352 VanDerWaalsContact OH-C 3.23Å; Y293-T352 VanDerWaalsContact OH-CA 3.27Å; Y293-T352 WeakPolarHBondContact OH-CA 3.44Å; T352-V354 PolarHBondContact O-N 2.78Å; T352-G355 WeakPolarHBondContact O-CA 3.42Å; T352-G355 PolarHBondContact O-N 3.24Å; T352-G355 PolarHBondContact OG1-N 3.05Å; T352-F356 WeakPolarHBondContact O-CD2 3.29Å; T352-F356 PolarHBondContact O-N 2.92Å; T352-F356 VanDerWaalsContact O-N 3.07Å |
| 353 | Y | 93.9 | Very high | 93.8 | Very high | 49 Ų | 49 | 46.2 Ų | 46.2 | 19% | 0.192 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -58.2 | -38.8 | 176.2 | -177.6 | -113.3 | 0 | 0 | 0 | 112.2 | Y293 K297 L301 G355 F356 C357 | Y293-Y353 HydrophobicContact CD1-CD2 4.38Å; Y293-Y353 HydrophobicContact CG-CD2 4.32Å; Y293-Y353 PolarHBondContact OH-N 2.82Å; K297-Y353 HydrophobicContact CB-CD2 4.27Å; K297-Y353 HydrophobicContact CB-CE2 3.57Å; K297-Y353 HydrophobicContact CD-CD1 4.48Å; K297-Y353 HydrophobicContact CD-CD2 4.35Å; K297-Y353 HydrophobicContact CD-CE1 4.36Å; K297-Y353 HydrophobicContact CD-CE2 4.26Å; K297-Y353 HydrophobicContact CD-CG 4.47Å; K297-Y353 HydrophobicContact CG-CE1 4.33Å; K297-Y353 HydrophobicContact CG-CE2 4.08Å; K297-Y353 PolarHBondContact O-OH 3.33Å; L301-Y353 HydrophobicContact CD2-CE2 3.97Å; L301-Y353 HydrophobicContact CG-CE2 4.2Å; Y353-G355 VanDerWaalsContact C-N 3.32Å; Y353-G355 PolarHBondContact O-N 3.45Å; Y353-F356 PolarHBondContact O-N 3.39Å; Y353-C357 VanDerWaalsContact CE1-SG 3.53Å; Y353-C357 PolarHBondContact O-N 3.39Å; Y353-C357 PolarHBondContact O-SG 3.01Å |
| 354 | V | 95.3 | Very high | 93.9 | Very high | 100 Ų | 100 | 45.5 Ų | 45.5 | 61% | 0.606 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -62.8 | -40.8 | 175.3 | 179.8 | 0 | 0 | 0 | 0 | 110.5 | T352 F356 C357 V358 | T352-V354 PolarHBondContact O-N 2.78Å; V354-F356 VanDerWaalsContact C-N 3.35Å; V354-F356 PolarHBondContact O-N 3.08Å; V354-C357 WeakPolarHBondContact O-CB 3.45Å; V354-C357 PolarHBondContact O-N 3.15Å; V354-C357 VanDerWaalsContact O-N 3.13Å; V354-V358 HydrophobicContact CG1-CG2 4.46Å; V354-V358 WeakPolarHBondContact O-CG2 3.46Å; V354-V358 PolarHBondContact O-N 3.37Å |
| 355 | G | 95.3 | Very high | 94 | Very high | 17 Ų | 17 | 49.3 Ų | 49.3 | 18% | 0.175 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -56.3 | -46.4 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | S350 T352 Y353 C357 V358 Y359 | S350-G355 PolarHBondContact OG-O 3.03Å; T352-G355 WeakPolarHBondContact O-CA 3.42Å; T352-G355 PolarHBondContact O-N 3.24Å; T352-G355 PolarHBondContact OG1-N 3.05Å; Y353-G355 VanDerWaalsContact C-N 3.32Å; Y353-G355 PolarHBondContact O-N 3.45Å; G355-C357 VanDerWaalsContact C-N 3.34Å; G355-C357 PolarHBondContact O-N 2.96Å; G355-V358 PolarHBondContact O-N 3.15Å; G355-Y359 WeakPolarHBondContact O-CB 3.38Å; G355-Y359 PolarHBondContact O-N 2.83Å |
| 356 | F | 95.1 | Very high | 94.1 | Very high | 0 Ų | 0 | 46 Ų | 46 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -63.3 | -36 | 174.6 | -82.7 | -75.1 | 0 | 0 | 0 | 113.4 | Y287 Q291 Y293 L301 S350 T352 Y353 V354 Y359 A360 | Y287-F356 AromaticContact CD1-CE1 3.63Å; Y287-F356 HydrophobicContact CD1-CE1 3.63Å; Y287-F356 HydrophobicContact CD1-CZ 4.11Å; Y287-F356 AromaticContact CE1-CE1 3.61Å; Y287-F356 HydrophobicContact CE1-CE1 3.61Å; Y287-F356 AromaticContact CE1-CZ 3.84Å; Y287-F356 HydrophobicContact CE1-CZ 3.84Å; Y287-F356 HydrophobicContact CE2-CZ 4.38Å; Y287-F356 HydrophobicContact CG-CE1 4.28Å; Y287-F356 AromaticContact CZ-CZ 3.99Å; Q291-F356 HydrophobicContact CG-CE2 4.1Å; Q291-F356 HydrophobicContact CG-CZ 4.05Å; Y293-F356 AromaticContact CE2-CD2 3.91Å; Y293-F356 HydrophobicContact CE2-CD2 3.91Å; Y293-F356 HydrophobicContact CE2-CE2 4.03Å; L301-F356 HydrophobicContact CD1-CB 4.05Å; L301-F356 HydrophobicContact CD2-CB 3.94Å; S350-F356 WeakPolarHBondContact O-CE2 3.41Å; T352-F356 WeakPolarHBondContact O-CD2 3.29Å; T352-F356 PolarHBondContact O-N 2.92Å; T352-F356 VanDerWaalsContact O-N 3.07Å; Y353-F356 PolarHBondContact O-N 3.39Å; V354-F356 VanDerWaalsContact C-N 3.35Å; V354-F356 PolarHBondContact O-N 3.08Å; F356-Y359 PolarHBondContact O-N 2.85Å; F356-A360 WeakPolarHBondContact O-CB 3.43Å; F356-A360 PolarHBondContact O-N 2.97Å |
| 357 | C | 96.6 | Very high | 94.2 | Very high | 27 Ų | 27 | 41.8 Ų | 41.8 | 18% | 0.182 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -66.1 | -43.2 | 175.3 | -65.6 | 0 | 0 | 0 | 0 | 111.7 | I304 Y353 V354 G355 A360 G361 | I304-C357 HydrophobicContact CD1-CB 3.98Å; Y353-C357 VanDerWaalsContact CE1-SG 3.53Å; Y353-C357 PolarHBondContact O-N 3.39Å; Y353-C357 PolarHBondContact O-SG 3.01Å; V354-C357 WeakPolarHBondContact O-CB 3.45Å; V354-C357 PolarHBondContact O-N 3.15Å; V354-C357 VanDerWaalsContact O-N 3.13Å; G355-C357 VanDerWaalsContact C-N 3.34Å; G355-C357 PolarHBondContact O-N 2.96Å; C357-A360 PolarHBondContact O-N 3.29Å; C357-G361 PolarHBondContact O-N 3.37Å |
| 358 | V | 96.8 | Very high | 94.4 | Very high | 75 Ų | 75 | 41.8 Ų | 41.8 | 46% | 0.455 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -62.6 | -45.9 | 175.5 | 171.4 | 0 | 0 | 0 | 0 | 110.3 | V354 G355 A360 G361 F362 | V354-V358 HydrophobicContact CG1-CG2 4.46Å; V354-V358 WeakPolarHBondContact O-CG2 3.46Å; V354-V358 PolarHBondContact O-N 3.37Å; G355-V358 PolarHBondContact O-N 3.15Å; V358-A360 PolarHBondContact O-N 3.4Å; V358-G361 PolarHBondContact O-N 2.9Å; V358-F362 HydrophobicContact CG1-CD2 3.71Å; V358-F362 HydrophobicContact CG1-CE2 3.43Å; V358-F362 VanDerWaalsContact CG1-CE2 3.43Å; V358-F362 VanDerWaalsContact O-CD2 3.27Å; V358-F362 WeakPolarHBondContact O-CD2 3.32Å; V358-F362 PolarHBondContact O-N 2.66Å |
| 359 | Y | 96.2 | Very high | 94.7 | Very high | 10 Ų | 10 | 42.4 Ų | 42.4 | 4% | 0.039 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -57 | -48.3 | 172.7 | 163.5 | -99.7 | 0 | 0 | 0 | 111.9 | L284 C343 H344 A347 G355 F356 G361 F362 F363 Y423 | L284-Y359 HydrophobicContact CD1-CD1 4.3Å; L284-Y359 HydrophobicContact CD1-CE1 3.81Å; C343-Y359 VanDerWaalsContact O-CE2 3.3Å; C343-Y359 WeakPolarHBondContact O-CE2 3.49Å; C343-Y359 VanDerWaalsContact SG-CE2 3.58Å; H344-Y359 PolarHBondContact CE1-OH 3.41Å; H344-Y359 AromaticContact ND1-CZ 3.92Å; H344-Y359 PolarHBondContact ND1-OH 3.26Å; A347-Y359 HydrophobicContact CB-CD1 4.43Å; A347-Y359 HydrophobicContact CB-CD2 3.55Å; A347-Y359 HydrophobicContact CB-CE1 4.26Å; A347-Y359 HydrophobicContact CB-CE2 3.34Å; A347-Y359 HydrophobicContact CB-CG 4.11Å; G355-Y359 WeakPolarHBondContact O-CB 3.38Å; G355-Y359 PolarHBondContact O-N 2.83Å; F356-Y359 PolarHBondContact O-N 2.85Å; Y359-G361 VanDerWaalsContact C-N 3.25Å; Y359-G361 PolarHBondContact O-N 3.42Å; Y359-F362 PolarHBondContact O-N 2.93Å; Y359-F363 HydrophobicContact CE1-CD1 4.33Å; Y359-F363 HydrophobicContact CE2-CB 4.25Å; Y359-F363 WeakPolarHBondContact O-CB 3.16Å; Y359-F363 PolarHBondContact O-N 3.31Å; Y359-Y423 HydrophobicContact CE1-CE1 4.14Å; Y359-Y423 AromaticContact CZ-CE1 3.86Å; Y359-Y423 WeakPolarHBondContact OH-CE1 3.32Å |
| 360 | A | 96.4 | Very high | 95 | Very high | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -60.5 | -36.6 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112 | L301 I304 L305 F356 C357 V358 G364 | L301-A360 HydrophobicContact CB-CB 4.5Å; L301-A360 HydrophobicContact CD2-CB 4.38Å; I304-A360 HydrophobicContact CB-CB 4.45Å; I304-A360 HydrophobicContact CG2-CB 4.24Å; L305-A360 WeakPolarHBondContact CA-O 3.47Å; L305-A360 HydrophobicContact CB-CB 4.41Å; F356-A360 WeakPolarHBondContact O-CB 3.43Å; F356-A360 PolarHBondContact O-N 2.97Å; C357-A360 PolarHBondContact O-N 3.29Å; V358-A360 PolarHBondContact O-N 3.4Å; A360-G364 PolarHBondContact O-N 3.04Å |
| 361 | G | 97.4 | Very high | 95.2 | Very high | 16 Ų | 16 | 37 Ų | 37 | 17% | 0.165 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -64.4 | -50.6 | 173 | 0 | 0 | 0 | 0 | 0 | 112.7 | V308 C357 V358 Y359 F363 G364 F365 | V308-G361 WeakPolarHBondContact CG1-O 3.39Å; C357-G361 PolarHBondContact O-N 3.37Å; V358-G361 PolarHBondContact O-N 2.9Å; Y359-G361 VanDerWaalsContact C-N 3.25Å; Y359-G361 PolarHBondContact O-N 3.42Å; G361-F363 VanDerWaalsContact C-N 3.33Å; G361-F363 PolarHBondContact O-N 3.46Å; G361-G364 PolarHBondContact O-N 3.12Å; G361-F365 PolarHBondContact O-N 3.17Å |
| 362 | F | 97.6 | Very high | 95.6 | Very high | 133 Ų | 133 | 32.6 Ų | 32.6 | 58% | 0.583 | 18% | 0.18 | S | C | * | . | H | α-helix | trans | -62.4 | -40.7 | 177.2 | -76.6 | -59.3 | 0 | 0 | 0 | 112.5 | V358 Y359 F365 A366 | V358-F362 HydrophobicContact CG1-CD2 3.71Å; V358-F362 HydrophobicContact CG1-CE2 3.43Å; V358-F362 VanDerWaalsContact CG1-CE2 3.43Å; V358-F362 VanDerWaalsContact O-CD2 3.27Å; V358-F362 WeakPolarHBondContact O-CD2 3.32Å; V358-F362 PolarHBondContact O-N 2.66Å; Y359-F362 PolarHBondContact O-N 2.93Å; F362-F365 PolarHBondContact O-N 2.89Å; F362-A366 WeakPolarHBondContact O-CB 3.4Å; F362-A366 PolarHBondContact O-N 3.45Å |
| 363 | F | 96.9 | Very high | 95.5 | Very high | 0 Ų | 0 | 28.9 Ų | 28.9 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -64.3 | -45.2 | 175.5 | 179.8 | -153.2 | 0 | 0 | 0 | 111 | P280 L281 L305 H344 Y359 G361 F365 A366 F367 | P280-F363 HydrophobicContact CB-CE1 4.48Å; L281-F363 HydrophobicContact CB-CE1 4.03Å; L281-F363 HydrophobicContact CB-CZ 3.97Å; L281-F363 HydrophobicContact CG-CE1 4.42Å; L281-F363 HydrophobicContact CG-CZ 4.49Å; L305-F363 HydrophobicContact CD1-CD1 3.25Å; L305-F363 HydrophobicContact CD1-CE1 3.49Å; L305-F363 VanDerWaalsContact CD1-CE1 3.49Å; L305-F363 HydrophobicContact CD1-CG 4.03Å; L305-F363 HydrophobicContact CD1-CZ 4.42Å; L305-F363 HydrophobicContact CG-CD1 4.3Å; H344-F363 AromaticContact CE1-CD2 3.45Å; H344-F363 VanDerWaalsContact CE1-CD2 3.45Å; H344-F363 WeakPolarHBondContact CE1-CD2 3.5Å; H344-F363 AromaticContact CE1-CE1 3.93Å; H344-F363 AromaticContact CE1-CE2 3.3Å; H344-F363 WeakPolarHBondContact CE1-CE2 3.48Å; H344-F363 AromaticContact CE1-CG 3.88Å; H344-F363 AromaticContact CE1-CZ 3.56Å; H344-F363 AromaticContact NE2-CE2 3.67Å; Y359-F363 HydrophobicContact CE1-CD1 4.33Å; Y359-F363 HydrophobicContact CE2-CB 4.25Å; Y359-F363 WeakPolarHBondContact O-CB 3.16Å; Y359-F363 PolarHBondContact O-N 3.31Å; G361-F363 VanDerWaalsContact C-N 3.33Å; G361-F363 PolarHBondContact O-N 3.46Å; F363-F365 VanDerWaalsContact C-N 3.3Å; F363-F365 PolarHBondContact O-N 3.16Å; F363-A366 PolarHBondContact O-N 3.45Å; F363-F367 HydrophobicContact CD2-CB 4.26Å; F363-F367 HydrophobicContact CE2-CB 4.08Å; F363-F367 HydrophobicContact CE2-CD2 4.04Å; F363-F367 HydrophobicContact CE2-CG 4.43Å; F363-F367 HydrophobicContact CZ-CD2 4.42Å; F363-F367 WeakPolarHBondContact O-CB 3.45Å; F363-F367 PolarHBondContact O-N 3.41Å |
| 364 | G | 96.9 | Very high | 95.4 | Very high | 0 Ų | 0 | 27.2 Ų | 27.2 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -58.1 | -41.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | L305 D309 A360 G361 G368 | L305-G364 WeakPolarHBondContact O-CA 3.43Å; D309-G364 WeakPolarHBondContact CA-O 3.19Å; A360-G364 PolarHBondContact O-N 3.04Å; G361-G364 PolarHBondContact O-N 3.12Å; G364-G368 PolarHBondContact O-N 3.07Å |
| 365 | F | 97.8 | Very high | 95 | Very high | 79 Ų | 79 | 25.8 Ų | 25.8 | 35% | 0.346 | 14% | 0.137 | S | C | . | . | H | α-helix | trans | -63.7 | -51.8 | 175.9 | 178.9 | -94.9 | 0 | 0 | 0 | 112.1 | V308 A312 M316 G361 F362 F363 F367 G368 W369 | V308-F365 HydrophobicContact CG1-CB 3.83Å; A312-F365 HydrophobicContact CB-CB 4.37Å; A312-F365 HydrophobicContact CB-CD2 3.62Å; A312-F365 HydrophobicContact CB-CE2 4.23Å; A312-F365 HydrophobicContact CB-CG 4.25Å; M316-F365 HydrophobicContact CE-CE2 4.11Å; M316-F365 HydrophobicContact CE-CZ 3.95Å; M316-F365 HydrophobicContact CG-CE2 4.39Å; M316-F365 HydrophobicContact CG-CZ 4.26Å; M316-F365 HydrophobicContact SD-CE2 4.39Å; M316-F365 HydrophobicContact SD-CZ 3.84Å; G361-F365 PolarHBondContact O-N 3.17Å; F362-F365 PolarHBondContact O-N 2.89Å; F363-F365 VanDerWaalsContact C-N 3.3Å; F363-F365 PolarHBondContact O-N 3.16Å; F365-F367 VanDerWaalsContact C-N 3.32Å; F365-F367 PolarHBondContact O-N 3.38Å; F365-G368 PolarHBondContact O-N 3.25Å; F365-W369 HydrophobicContact CE1-CE3 4.12Å; F365-W369 WeakPolarHBondContact O-CB 3.44Å; F365-W369 PolarHBondContact O-N 3.47Å |
| 366 | A | 97.6 | Very high | 94.6 | Very high | 4 Ų | 4 | 27.5 Ų | 27.5 | 3% | 0.033 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -64.9 | -37.1 | -179.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | A339 N340 F362 F363 W369 L370 | A339-A366 HydrophobicContact CB-CB 4.39Å; N340-A366 HydrophobicContact CB-CB 4.42Å; N340-A366 WeakPolarHBondContact ND2-CB 3.23Å; N340-A366 PolarHBondContact ND2-O 3.26Å; F362-A366 WeakPolarHBondContact O-CB 3.4Å; F362-A366 PolarHBondContact O-N 3.45Å; F363-A366 PolarHBondContact O-N 3.45Å; A366-W369 PolarHBondContact O-N 3.05Å; A366-L370 WeakPolarHBondContact O-CB 3.26Å; A366-L370 PolarHBondContact O-N 3.32Å |
| 367 | F | 95.4 | Very high | 94.4 | Very high | 8 Ų | 8 | 27.5 Ų | 27.5 | 4% | 0.035 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -67.9 | -41 | 176.3 | -171 | -93.7 | 0 | 0 | 0 | 111.7 | L277 F278 L281 N340 F363 F365 L370 S371 | L277-F367 HydrophobicContact CD1-CD2 4.13Å; L277-F367 HydrophobicContact CD1-CE2 4.17Å; L277-F367 HydrophobicContact CD2-CE2 4.39Å; L277-F367 HydrophobicContact CG-CE2 4.18Å; F278-F367 HydrophobicContact CE1-CZ 4.47Å; L281-F367 HydrophobicContact CD1-CE2 4.22Å; L281-F367 HydrophobicContact CD1-CZ 4.21Å; N340-F367 PolarHBondContact OD1-N 3.44Å; F363-F367 HydrophobicContact CD2-CB 4.26Å; F363-F367 HydrophobicContact CE2-CB 4.08Å; F363-F367 HydrophobicContact CE2-CD2 4.04Å; F363-F367 HydrophobicContact CE2-CG 4.43Å; F363-F367 HydrophobicContact CZ-CD2 4.42Å; F363-F367 WeakPolarHBondContact O-CB 3.45Å; F363-F367 PolarHBondContact O-N 3.41Å; F365-F367 VanDerWaalsContact C-N 3.32Å; F365-F367 PolarHBondContact O-N 3.38Å; F367-L370 PolarHBondContact O-N 3.31Å; F367-S371 WeakPolarHBondContact CE1-OG 3.34Å; F367-S371 VanDerWaalsContact O-CB 3.28Å; F367-S371 WeakPolarHBondContact O-CB 3.3Å; F367-S371 PolarHBondContact O-N 2.98Å; F367-S371 PolarHBondContact O-OG 3.4Å |
| 368 | G | 94.4 | Very high | 94.1 | Very high | 0 Ų | 0 | 26.2 Ų | 26.2 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -67.1 | -38.9 | 175 | 0 | 0 | 0 | 0 | 0 | 112.9 | D309 G364 F365 S372 | D309-G368 WeakPolarHBondContact OD1-CA 3.24Å; G364-G368 PolarHBondContact O-N 3.07Å; F365-G368 PolarHBondContact O-N 3.25Å; G368-S372 WeakPolarHBondContact O-CB 3.39Å; G368-S372 PolarHBondContact O-N 3.23Å; G368-S372 PolarHBondContact O-OG 2.85Å |
| 369 | W | 96.6 | Very high | 93.5 | Very high | 38 Ų | 38 | 25.2 Ų | 25.2 | 14% | 0.144 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -57.4 | -56.7 | 170.6 | -176.6 | 1.8 | 0 | 0 | 0 | 110.8 | M316 F332 A335 S336 A339 F365 A366 S371 S372 V373 | M316-W369 HydrophobicContact CB-CB 4.19Å; M316-W369 HydrophobicContact CB-CG 4.14Å; M316-W369 HydrophobicContact CG-CB 3.79Å; M316-W369 HydrophobicContact CG-CG 3.86Å; M316-W369 HydrophobicContact SD-CD2 4.36Å; M316-W369 HydrophobicContact SD-CG 4.25Å; F332-W369 AromaticContact CD1-NE1 3.37Å; F332-W369 AromaticContact CD2-CZ2 3.52Å; F332-W369 HydrophobicContact CD2-CZ2 3.52Å; F332-W369 AromaticContact CD2-NE1 3.93Å; F332-W369 AromaticContact CE1-CD1 3.67Å; F332-W369 AromaticContact CE1-CE2 3.88Å; F332-W369 HydrophobicContact CE1-CZ2 4.37Å; F332-W369 AromaticContact CE1-NE1 2.97Å; F332-W369 AromaticContact CE2-CE2 3.6Å; F332-W369 HydrophobicContact CE2-CH2 4.32Å; F332-W369 AromaticContact CE2-CZ2 3.32Å; F332-W369 HydrophobicContact CE2-CZ2 3.32Å; F332-W369 AromaticContact CE2-NE1 3.57Å; F332-W369 HydrophobicContact CG-CZ2 4.12Å; F332-W369 AromaticContact CG-NE1 3.83Å; F332-W369 AromaticContact CZ-CD1 3.89Å; F332-W369 AromaticContact CZ-CE2 3.53Å; F332-W369 AromaticContact CZ-CZ2 3.79Å; F332-W369 HydrophobicContact CZ-CZ2 3.79Å; F332-W369 AromaticContact CZ-NE1 3.08Å; F332-W369 WeakPolarHBondContact O-CZ2 3.35Å; A335-W369 HydrophobicContact CB-CH2 3.85Å; A335-W369 HydrophobicContact CB-CZ2 3.97Å; S336-W369 VanDerWaalsContact CB-CD2 3.5Å; A339-W369 HydrophobicContact CB-CZ3 4.35Å; F365-W369 HydrophobicContact CE1-CE3 4.12Å; F365-W369 WeakPolarHBondContact O-CB 3.44Å; F365-W369 PolarHBondContact O-N 3.47Å; A366-W369 PolarHBondContact O-N 3.05Å; W369-S371 VanDerWaalsContact C-N 3.34Å; W369-S371 PolarHBondContact O-N 2.95Å; W369-S372 PolarHBondContact O-N 3.45Å; W369-S372 PolarHBondContact O-OG 3.11Å; W369-V373 WeakPolarHBondContact O-CG2 3.34Å; W369-V373 PolarHBondContact O-N 3.5Å |
| 370 | L | 95.6 | Very high | 93 | Very high | 3 Ų | 3 | 28 Ų | 28 | 2% | 0.016 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -55.3 | -48.7 | 179.2 | -176.7 | 158.1 | 0 | 0 | 0 | 111.6 | M273 L277 F333 S336 I337 A366 F367 S372 V373 L374 | M273-L370 HydrophobicContact SD-CD1 3.79Å; M273-L370 HydrophobicContact SD-CG 4.44Å; L277-L370 HydrophobicContact CD1-CD1 3.9Å; L277-L370 HydrophobicContact CD2-CD1 4.47Å; L277-L370 HydrophobicContact CD2-CD2 4.13Å; F333-L370 HydrophobicContact CE2-CG 4.21Å; S336-L370 WeakPolarHBondContact OG-CA 3.47Å; I337-L370 HydrophobicContact CG1-CD1 4.02Å; A366-L370 WeakPolarHBondContact O-CB 3.26Å; A366-L370 PolarHBondContact O-N 3.32Å; F367-L370 PolarHBondContact O-N 3.31Å; L370-S372 VanDerWaalsContact C-N 3.29Å; L370-S372 PolarHBondContact O-N 3.48Å; L370-V373 PolarHBondContact O-N 2.85Å; L370-L374 WeakPolarHBondContact O-CB 3.45Å; L370-L374 PolarHBondContact O-N 3.28Å |
| 371 | S | 91.1 | Very high | 92.6 | Very high | 28 Ų | 28 | 28.9 Ų | 28.9 | 20% | 0.196 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -62.5 | -33.8 | -178.5 | -61.8 | 0 | 0 | 0 | 0 | 113.1 | F367 W369 | F367-S371 WeakPolarHBondContact CE1-OG 3.34Å; F367-S371 VanDerWaalsContact O-CB 3.28Å; F367-S371 WeakPolarHBondContact O-CB 3.3Å; F367-S371 PolarHBondContact O-N 2.98Å; F367-S371 PolarHBondContact O-OG 3.4Å; W369-S371 VanDerWaalsContact C-N 3.34Å; W369-S371 PolarHBondContact O-N 2.95Å |
| 372 | S | 89.8 | Confident | 92.1 | Very high | 19 Ų | 19 | 29.2 Ų | 29.2 | 13% | 0.133 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -72.2 | -32.7 | 177.9 | 69.8 | 0 | 0 | 0 | 0 | 113.1 | R313 G368 W369 L370 | R313-S372 VanDerWaalsContact O-CB 3.25Å; R313-S372 WeakPolarHBondContact O-CB 3.35Å; G368-S372 WeakPolarHBondContact O-CB 3.39Å; G368-S372 PolarHBondContact O-N 3.23Å; G368-S372 PolarHBondContact O-OG 2.85Å; W369-S372 PolarHBondContact O-N 3.45Å; W369-S372 PolarHBondContact O-OG 3.11Å; L370-S372 VanDerWaalsContact C-N 3.29Å; L370-S372 PolarHBondContact O-N 3.48Å |
| 373 | V | 92.6 | Very high | 91.3 | Very high | 0 Ų | 0 | 23.8 Ų | 23.8 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -96.4 | -21.5 | -171.4 | -180 | 0 | 0 | 0 | 0 | 112.6 | A320 I329 F332 F333 W369 L370 F375 E376 T377 | A320-V373 HydrophobicContact CB-CG2 4.22Å; I329-V373 HydrophobicContact CD1-CG1 4.37Å; I329-V373 HydrophobicContact CG1-CG1 3.9Å; F332-V373 HydrophobicContact CD1-CG1 4.3Å; F332-V373 HydrophobicContact CD1-CG2 3.67Å; F332-V373 HydrophobicContact CE1-CG2 3.67Å; F333-V373 HydrophobicContact CB-CG1 3.7Å; F333-V373 HydrophobicContact CD2-CB 4.24Å; F333-V373 HydrophobicContact CD2-CG1 3.99Å; F333-V373 HydrophobicContact CG-CG1 4.25Å; W369-V373 WeakPolarHBondContact O-CG2 3.34Å; W369-V373 PolarHBondContact O-N 3.5Å; L370-V373 PolarHBondContact O-N 2.85Å; V373-F375 PolarHBondContact O-N 3.42Å; V373-E376 PolarHBondContact O-N 3.33Å; V373-T377 VanDerWaalsContact CG1-OG1 3.25Å; V373-T377 WeakPolarHBondContact CG1-OG1 3.31Å; V373-T377 WeakPolarHBondContact O-CB 3.27Å; V373-T377 PolarHBondContact O-N 2.89Å; V373-T377 PolarHBondContact O-OG1 3.49Å |
| 374 | L | 92.5 | Very high | 90.2 | Very high | 14 Ų | 14 | 28.6 Ų | 28.6 | 7% | 0.073 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -49.7 | -61.1 | -177.6 | -175.5 | 71.7 | 0 | 0 | 0 | 112.7 | Y266 M273 F274 F333 L370 T377 L378 | Y266-L374 WeakPolarHBondContact OH-CD1 3.27Å; Y266-L374 WeakPolarHBondContact OH-CG 3.35Å; Y266-L374 PolarHBondContact OH-O 3.03Å; Y266-L374 VanDerWaalsContact OH-O 3.08Å; M273-L374 HydrophobicContact CE-CD1 4.4Å; F274-L374 HydrophobicContact CZ-CD2 4.36Å; F333-L374 HydrophobicContact CE2-CB 4.23Å; F333-L374 HydrophobicContact CE2-CD1 3.77Å; F333-L374 HydrophobicContact CZ-CD1 3.51Å; L370-L374 WeakPolarHBondContact O-CB 3.45Å; L370-L374 PolarHBondContact O-N 3.28Å; L374-T377 PolarHBondContact O-N 2.87Å; L374-L378 PolarHBondContact O-N 3.17Å |
| 375 | F | 86.6 | Confident | 89.1 | Confident | 71 Ų | 71 | 37.6 Ų | 37.6 | 31% | 0.311 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -75.7 | -28.5 | -177.3 | -68.5 | -59.2 | 0 | 0 | 0 | 113.5 | V373 L378 M379 F387 V391 | V373-F375 PolarHBondContact O-N 3.42Å; F375-L378 PolarHBondContact O-N 3.29Å; F375-M379 WeakPolarHBondContact O-CB 3.3Å; F375-M379 PolarHBondContact O-N 3.47Å; F375-F387 HydrophobicContact CB-CE2 4.48Å; F375-F387 HydrophobicContact CB-CZ 4.14Å; F375-F387 HydrophobicContact CD1-CZ 4.34Å; F375-F387 WeakPolarHBondContact O-CE2 3.41Å; F375-V391 HydrophobicContact CD1-CG2 4.11Å; F375-V391 HydrophobicContact CE1-CG1 4.14Å; F375-V391 HydrophobicContact CE1-CG2 4.23Å |
| 376 | E | 86.3 | Confident | 88.2 | Confident | 52 Ų | 52 | 39.4 Ų | 39.4 | 24% | 0.243 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -65.2 | -40.9 | 174.3 | -77.9 | -70.2 | 166.6 | 0 | 0 | 111.4 | R326 I329 V373 M379 D380 | R326-E376 IonicContact CZ-OE2 3.48Å; R326-E376 IonicContact NH1-OE2 2.74Å; R326-E376 PolarHBondContact NH1-OE2 3.01Å; R326-E376 IonicContact NH2-OE2 2.98Å; R326-E376 PolarHBondContact NH2-OE2 3.32Å; I329-E376 HydrophobicContact CD1-CB 3.82Å; V373-E376 PolarHBondContact O-N 3.33Å; E376-M379 PolarHBondContact O-N 3.27Å; E376-D380 WeakPolarHBondContact O-CB 3.27Å; E376-D380 PolarHBondContact O-N 3.24Å |
| 377 | T | 91.1 | Very high | 87.2 | Confident | 1 Ų | 1 | 41.9 Ų | 41.9 | 1% | 0.006 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -65.6 | -42.7 | 176.2 | -56 | 0 | 0 | 0 | 0 | 111.1 | Y266 Q330 F333 V373 L374 M379 D380 L381 | Y266-T377 HydrophobicContact CD2-CG2 4.31Å; Y266-T377 HydrophobicContact CE2-CG2 4.24Å; Q330-T377 HydrophobicContact CB-CG2 4.44Å; Q330-T377 HydrophobicContact CG-CG2 3.74Å; F333-T377 HydrophobicContact CB-CG2 4.41Å; F333-T377 HydrophobicContact CD1-CG2 4.39Å; V373-T377 VanDerWaalsContact CG1-OG1 3.25Å; V373-T377 WeakPolarHBondContact CG1-OG1 3.31Å; V373-T377 WeakPolarHBondContact O-CB 3.27Å; V373-T377 PolarHBondContact O-N 2.89Å; V373-T377 PolarHBondContact O-OG1 3.49Å; L374-T377 PolarHBondContact O-N 2.87Å; T377-M379 VanDerWaalsContact C-N 3.33Å; T377-M379 PolarHBondContact O-N 3.4Å; T377-D380 PolarHBondContact O-N 2.97Å; T377-L381 VanDerWaalsContact O-CB 3.25Å; T377-L381 WeakPolarHBondContact O-CB 3.09Å; T377-L381 PolarHBondContact O-N 3.4Å |
| 378 | L | 89.8 | Confident | 86.2 | Confident | 0 Ų | 0 | 46.3 Ų | 46.3 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -62.3 | -41.3 | 174.9 | -179.1 | 60.8 | 0 | 0 | 0 | 112 | F263 Y266 L374 F375 L381 V382 F387 A390 V391 V394 | F263-L378 HydrophobicContact CD2-CD1 4.04Å; F263-L378 HydrophobicContact CE2-CD1 4.15Å; Y266-L378 HydrophobicContact CD1-CD1 3.97Å; Y266-L378 HydrophobicContact CE1-CB 4.22Å; Y266-L378 HydrophobicContact CE1-CD1 3.87Å; Y266-L378 HydrophobicContact CE1-CD2 4.45Å; Y266-L378 HydrophobicContact CE1-CG 4.4Å; Y266-L378 HydrophobicContact CE2-CB 4.44Å; L374-L378 PolarHBondContact O-N 3.17Å; F375-L378 PolarHBondContact O-N 3.29Å; L378-L381 PolarHBondContact O-N 2.97Å; L378-V382 HydrophobicContact CD1-CG2 3.87Å; L378-V382 WeakPolarHBondContact O-CB 3.38Å; L378-V382 PolarHBondContact O-N 3.46Å; L378-F387 HydrophobicContact CB-CE2 4.3Å; L378-F387 HydrophobicContact CD2-CE2 4.21Å; L378-F387 HydrophobicContact CG-CD2 4.34Å; L378-F387 HydrophobicContact CG-CE2 4.2Å; L378-A390 HydrophobicContact CD1-CB 4.19Å; L378-A390 HydrophobicContact CD2-CB 4.41Å; L378-A390 HydrophobicContact CG-CB 4.48Å; L378-V391 HydrophobicContact CD2-CG2 3.72Å; L378-V394 HydrophobicContact CD1-CG2 4.47Å; L378-V394 HydrophobicContact CD2-CG2 4.29Å |
| 379 | M | 84.4 | Confident | 85.6 | Confident | 53 Ų | 53 | 47.7 Ų | 47.7 | 26% | 0.261 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -65.8 | -40.7 | 178 | -177.1 | 174.4 | 162.8 | 0 | 0 | 112.2 | M1 F375 E376 T377 L381 G383 P384 F387 | M1-M379 HydrophobicContact CE-CE 3.98Å; F375-M379 WeakPolarHBondContact O-CB 3.3Å; F375-M379 PolarHBondContact O-N 3.47Å; E376-M379 PolarHBondContact O-N 3.27Å; T377-M379 VanDerWaalsContact C-N 3.33Å; T377-M379 PolarHBondContact O-N 3.4Å; M379-L381 VanDerWaalsContact C-N 3.32Å; M379-G383 WeakPolarHBondContact O-CA 3.41Å; M379-G383 PolarHBondContact O-N 3.14Å; M379-P384 HydrophobicContact CE-CB 4.29Å; M379-F387 HydrophobicContact CB-CD2 3.67Å; M379-F387 HydrophobicContact CB-CE2 3.74Å; M379-F387 HydrophobicContact CB-CG 4.49Å; M379-F387 HydrophobicContact CG-CD2 4.2Å |
| 380 | D | 87.3 | Confident | 85.1 | Confident | 70 Ų | 70 | 45.9 Ų | 45.9 | 37% | 0.374 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -64.5 | -38.6 | 175.8 | -165.9 | 74 | 0 | 0 | 0 | 111.6 | R326 I329 E376 T377 | R326-D380 IonicContact NH2-OD1 3.27Å; I329-D380 HydrophobicContact CG2-CB 4.15Å; E376-D380 WeakPolarHBondContact O-CB 3.27Å; E376-D380 PolarHBondContact O-N 3.24Å; T377-D380 PolarHBondContact O-N 2.97Å |
| 381 | L | 87.6 | Confident | 84.6 | Confident | 18 Ų | 18 | 47.3 Ų | 47.3 | 9% | 0.094 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -76.9 | -38.9 | -175.2 | -171.4 | 69.1 | 0 | 0 | 0 | 114.3 | H260 G262 Y266 T377 L378 M379 | H260-L381 PolarHBondContact CE1-O 3.35Å; H260-L381 VanDerWaalsContact CE1-O 3.25Å; G262-L381 VanDerWaalsContact O-CD2 3.22Å; G262-L381 WeakPolarHBondContact O-CD2 3.22Å; Y266-L381 HydrophobicContact CG-CD2 4.2Å; T377-L381 VanDerWaalsContact O-CB 3.25Å; T377-L381 WeakPolarHBondContact O-CB 3.09Å; T377-L381 PolarHBondContact O-N 3.4Å; L378-L381 PolarHBondContact O-N 2.97Å; M379-L381 VanDerWaalsContact C-N 3.32Å |
| 382 | V | 87.2 | Confident | 84.2 | Confident | 22 Ų | 22 | 46.7 Ų | 46.7 | 13% | 0.133 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -103.6 | -18.6 | -174.1 | 174.9 | 0 | 0 | 0 | 0 | 112.2 | L257 F263 L378 R386 A390 | L257-V382 HydrophobicContact CD2-CB 4.48Å; L257-V382 HydrophobicContact CD2-CG1 3.46Å; L257-V382 VanDerWaalsContact CD2-CG1 3.46Å; L257-V382 HydrophobicContact CD2-CG2 4.16Å; F263-V382 HydrophobicContact CB-CG2 4.26Å; F263-V382 HydrophobicContact CD2-CG2 3.8Å; F263-V382 HydrophobicContact CG-CG2 4.43Å; L378-V382 HydrophobicContact CD1-CG2 3.87Å; L378-V382 WeakPolarHBondContact O-CB 3.38Å; L378-V382 PolarHBondContact O-N 3.46Å; V382-R386 HydrophobicContact CG1-CB 3.52Å; V382-A390 HydrophobicContact CB-CB 4.43Å; V382-A390 HydrophobicContact CG1-CB 3.97Å; V382-A390 HydrophobicContact CG2-CB 4.25Å |
| 383 | G | 80.4 | Confident | 84.1 | Confident | 20 Ų | 20 | 46.2 Ų | 46.2 | 21% | 0.206 | 25% | 0.25 | C | C | . | . | trans | 81.2 | 165.5 | -176.2 | 0 | 0 | 0 | 0 | 0 | 113.8 | M379 Q385 F387 | M379-G383 WeakPolarHBondContact O-CA 3.41Å; M379-G383 PolarHBondContact O-N 3.14Å; G383-Q385 PolarHBondContact O-N 2.96Å; G383-F387 PolarHBondContact O-N 2.83Å | ||
| 384 | P | 72.6 | Confident | 84 | Confident | 101 Ų | 101 | 46.3 Ų | 46.3 | 66% | 0.656 | 25% | 0.25 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -68.8 | -31.2 | -170 | 25.4 | -34.5 | 0 | 0 | 0 | 114.1 | M379 | M379-P384 HydrophobicContact CE-CB 4.29Š|
| 385 | Q | 74 | Confident | 83.8 | Confident | 188 Ų | 188 | 46.6 Ų | 46.6 | 88% | 0.879 | 25% | 0.252 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71.5 | -38.1 | -175 | -65.8 | -176.5 | -4.6 | 0 | 0 | 112.5 | G383 | G383-Q385 PolarHBondContact O-N 2.96Š|
| 386 | R | 78.9 | Confident | 83.9 | Confident | 118 Ų | 118 | 46.1 Ų | 46.1 | 45% | 0.445 | 25% | 0.253 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.1 | -2.2 | -177.1 | -65 | -174.2 | -174.2 | -154.6 | 2.5 | 113.4 | D254 T256 L257 V382 S388 S389 A390 | D254-R386 IonicContact OD2-NE 3.84Å; D254-R386 IonicContact OD2-NH1 3.99Å; T256-R386 PolarHBondContact OG1-NH1 2.88Å; L257-R386 HydrophobicContact CD2-CB 4.49Å; V382-R386 HydrophobicContact CG1-CB 3.52Å; R386-S388 PolarHBondContact O-N 3.38Å; R386-S389 PolarHBondContact O-N 3.41Å; R386-A390 WeakPolarHBondContact O-CB 3.41Å; R386-A390 PolarHBondContact O-N 2.91Å |
| 387 | F | 77.3 | Confident | 84.1 | Confident | 55 Ų | 55 | 46 Ų | 46 | 24% | 0.241 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -55.3 | -46.6 | -176.5 | 179.8 | -106 | 0 | 0 | 0 | 113.7 | F375 L378 M379 G383 S389 A390 V391 | F375-F387 HydrophobicContact CB-CE2 4.48Å; F375-F387 HydrophobicContact CB-CZ 4.14Å; F375-F387 HydrophobicContact CD1-CZ 4.34Å; F375-F387 WeakPolarHBondContact O-CE2 3.41Å; L378-F387 HydrophobicContact CB-CE2 4.3Å; L378-F387 HydrophobicContact CD2-CE2 4.21Å; L378-F387 HydrophobicContact CG-CD2 4.34Å; L378-F387 HydrophobicContact CG-CE2 4.2Å; M379-F387 HydrophobicContact CB-CD2 3.67Å; M379-F387 HydrophobicContact CB-CE2 3.74Å; M379-F387 HydrophobicContact CB-CG 4.49Å; M379-F387 HydrophobicContact CG-CD2 4.2Å; G383-F387 PolarHBondContact O-N 2.83Å; F387-S389 VanDerWaalsContact C-N 3.33Å; F387-S389 PolarHBondContact O-N 3.37Å; F387-A390 PolarHBondContact O-N 2.92Å; F387-V391 HydrophobicContact CD1-CG2 4.24Å; F387-V391 HydrophobicContact CD2-CG2 4.19Å; F387-V391 HydrophobicContact CE1-CG2 3.8Å; F387-V391 HydrophobicContact CE2-CG2 3.74Å; F387-V391 HydrophobicContact CG-CG2 4.43Å; F387-V391 HydrophobicContact CZ-CG2 3.53Å; F387-V391 WeakPolarHBondContact O-CG2 3.45Å; F387-V391 PolarHBondContact O-N 3.14Å |
| 388 | S | 74.8 | Confident | 84.1 | Confident | 101 Ų | 101 | 46.2 Ų | 46.2 | 71% | 0.706 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -62.2 | -40 | -177.8 | -171.2 | 0 | 0 | 0 | 0 | 112.6 | R386 G392 | R386-S388 PolarHBondContact O-N 3.38Å; S388-G392 PolarHBondContact O-N 3.28Å |
| 389 | S | 81.9 | Confident | 84.2 | Confident | 29 Ų | 29 | 47 Ų | 47 | 20% | 0.203 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -70.3 | -39.4 | 177.4 | -54.2 | 0 | 0 | 0 | 0 | 111.1 | R386 F387 G392 L393 | R386-S389 PolarHBondContact O-N 3.41Å; F387-S389 VanDerWaalsContact C-N 3.33Å; F387-S389 PolarHBondContact O-N 3.37Å; S389-G392 PolarHBondContact O-N 3.41Å; S389-L393 PolarHBondContact O-N 3.01Å |
| 390 | A | 85.6 | Confident | 84.7 | Confident | 0 Ų | 0 | 48.2 Ų | 48.2 | 0% | 0 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -64.1 | -44.5 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | L257 F263 L378 V382 R386 F387 G392 L393 V394 | L257-A390 HydrophobicContact CD1-CB 3.98Å; L257-A390 HydrophobicContact CD2-CB 4.25Å; F263-A390 HydrophobicContact CD2-CB 4.37Å; F263-A390 HydrophobicContact CE2-CB 3.87Å; L378-A390 HydrophobicContact CD1-CB 4.19Å; L378-A390 HydrophobicContact CD2-CB 4.41Å; L378-A390 HydrophobicContact CG-CB 4.48Å; V382-A390 HydrophobicContact CB-CB 4.43Å; V382-A390 HydrophobicContact CG1-CB 3.97Å; V382-A390 HydrophobicContact CG2-CB 4.25Å; R386-A390 WeakPolarHBondContact O-CB 3.41Å; R386-A390 PolarHBondContact O-N 2.91Å; F387-A390 PolarHBondContact O-N 2.92Å; A390-G392 VanDerWaalsContact C-N 3.31Å; A390-G392 PolarHBondContact O-N 3.46Å; A390-L393 PolarHBondContact O-N 3.12Å; A390-V394 WeakPolarHBondContact O-CB 3.46Å; A390-V394 WeakPolarHBondContact O-CG2 3.31Å; A390-V394 PolarHBondContact O-N 3.16Å |
| 391 | V | 84.8 | Confident | 85.1 | Confident | 34 Ų | 34 | 45 Ų | 45 | 21% | 0.206 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -58.7 | -44.5 | 173.7 | 171.9 | 0 | 0 | 0 | 0 | 110.8 | F375 L378 F387 L393 V394 T395 | F375-V391 HydrophobicContact CD1-CG2 4.11Å; F375-V391 HydrophobicContact CE1-CG1 4.14Å; F375-V391 HydrophobicContact CE1-CG2 4.23Å; L378-V391 HydrophobicContact CD2-CG2 3.72Å; F387-V391 HydrophobicContact CD1-CG2 4.24Å; F387-V391 HydrophobicContact CD2-CG2 4.19Å; F387-V391 HydrophobicContact CE1-CG2 3.8Å; F387-V391 HydrophobicContact CE2-CG2 3.74Å; F387-V391 HydrophobicContact CG-CG2 4.43Å; F387-V391 HydrophobicContact CZ-CG2 3.53Å; F387-V391 WeakPolarHBondContact O-CG2 3.45Å; F387-V391 PolarHBondContact O-N 3.14Å; V391-L393 PolarHBondContact O-N 3.19Å; V391-V394 PolarHBondContact O-N 3.24Å; V391-T395 HydrophobicContact CG1-CG2 4.19Å; V391-T395 WeakPolarHBondContact O-CB 3.42Å; V391-T395 VanDerWaalsContact O-CG2 3.27Å; V391-T395 WeakPolarHBondContact O-CG2 3.48Å; V391-T395 PolarHBondContact O-N 3.4Å; V391-T395 PolarHBondContact O-OG1 3.33Å |
| 392 | G | 83.6 | Confident | 85.4 | Confident | 15 Ų | 15 | 44.1 Ų | 44.1 | 16% | 0.155 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -58.6 | -47.5 | 177 | 0 | 0 | 0 | 0 | 0 | 112.8 | S388 S389 A390 T395 I396 | S388-G392 PolarHBondContact O-N 3.28Å; S389-G392 PolarHBondContact O-N 3.41Å; A390-G392 VanDerWaalsContact C-N 3.31Å; A390-G392 PolarHBondContact O-N 3.46Å; G392-T395 PolarHBondContact O-OG1 3.05Å; G392-I396 WeakPolarHBondContact O-CD1 3.35Å; G392-I396 VanDerWaalsContact O-CG1 3.24Å; G392-I396 WeakPolarHBondContact O-CG1 3.34Å; G392-I396 PolarHBondContact O-N 3.09Å |
| 393 | L | 87.3 | Confident | 85.8 | Confident | 9 Ų | 9 | 45.6 Ų | 45.6 | 5% | 0.047 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -63.7 | -46.3 | 177 | -77.9 | 171.9 | 0 | 0 | 0 | 112.6 | L253 L255 L257 F258 F263 S389 A390 V391 I396 V397 | L253-L393 HydrophobicContact CB-CD2 3.89Å; L253-L393 HydrophobicContact CB-CG 4.26Å; L253-L393 HydrophobicContact CD1-CD2 4.25Å; L253-L393 HydrophobicContact CD2-CD2 4.04Å; L253-L393 HydrophobicContact CD2-CG 4.05Å; L253-L393 HydrophobicContact CG-CD2 4.28Å; L255-L393 HydrophobicContact CD2-CD2 4.14Å; L257-L393 HydrophobicContact CB-CD1 4.06Å; L257-L393 HydrophobicContact CD1-CD1 3.88Å; F258-L393 HydrophobicContact CE2-CD1 4.12Å; F258-L393 HydrophobicContact CE2-CD2 3.85Å; F258-L393 HydrophobicContact CZ-CD2 4.2Å; F263-L393 HydrophobicContact CZ-CB 4.11Å; S389-L393 PolarHBondContact O-N 3.01Å; A390-L393 PolarHBondContact O-N 3.12Å; V391-L393 PolarHBondContact O-N 3.19Å; L393-I396 PolarHBondContact O-N 3.39Å; L393-V397 WeakPolarHBondContact O-CG2 3.33Å; L393-V397 PolarHBondContact O-N 3.24Å; L393-V397 VanDerWaalsContact O-N 3.17Å |
| 394 | V | 89.9 | Confident | 86.5 | Confident | 1 Ų | 1 | 48.4 Ų | 48.4 | 1% | 0.006 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -59.3 | -51.4 | 179.9 | 167.5 | 0 | 0 | 0 | 0 | 110.4 | F263 Y266 L267 L378 A390 V391 I396 V397 E398 | F263-V394 HydrophobicContact CE2-CG2 3.54Å; F263-V394 HydrophobicContact CZ-CG2 3.84Å; Y266-V394 HydrophobicContact CE1-CG1 4.38Å; Y266-V394 HydrophobicContact CE1-CG2 4.25Å; L267-V394 HydrophobicContact CD1-CB 4.45Å; L267-V394 HydrophobicContact CD1-CG2 4.05Å; L378-V394 HydrophobicContact CD1-CG2 4.47Å; L378-V394 HydrophobicContact CD2-CG2 4.29Å; A390-V394 WeakPolarHBondContact O-CB 3.46Å; A390-V394 WeakPolarHBondContact O-CG2 3.31Å; A390-V394 PolarHBondContact O-N 3.16Å; V391-V394 PolarHBondContact O-N 3.24Å; V394-I396 VanDerWaalsContact C-N 3.34Å; V394-I396 PolarHBondContact O-N 3.27Å; V394-V397 PolarHBondContact O-N 3.28Å; V394-V397 VanDerWaalsContact O-N 3.15Å; V394-E398 HydrophobicContact CG1-CG 4.04Å; V394-E398 WeakPolarHBondContact CG1-OE1 3.16Å; V394-E398 WeakPolarHBondContact O-CB 3.29Å; V394-E398 VanDerWaalsContact O-CG 3.26Å; V394-E398 WeakPolarHBondContact O-CG 3.47Å; V394-E398 PolarHBondContact O-N 3.48Å |
| 395 | T | 87.8 | Confident | 87.5 | Confident | 21 Ų | 21 | 43.6 Ų | 43.6 | 13% | 0.129 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -60.6 | -39.3 | -178.6 | 52.4 | 0 | 0 | 0 | 0 | 113.2 | V391 G392 E398 C399 | V391-T395 HydrophobicContact CG1-CG2 4.19Å; V391-T395 WeakPolarHBondContact O-CB 3.42Å; V391-T395 VanDerWaalsContact O-CG2 3.27Å; V391-T395 WeakPolarHBondContact O-CG2 3.48Å; V391-T395 PolarHBondContact O-N 3.4Å; V391-T395 PolarHBondContact O-OG1 3.33Å; G392-T395 PolarHBondContact O-OG1 3.05Å; T395-E398 PolarHBondContact O-N 2.9Å; T395-C399 PolarHBondContact O-N 3Å; T395-C399 PolarHBondContact O-SG 3.49Å |
| 396 | I | 89.1 | Confident | 88.5 | Confident | 61 Ų | 61 | 34.7 Ų | 34.7 | 31% | 0.313 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -62.1 | -46.8 | 175.6 | -66.1 | 164.8 | 0 | 0 | 0 | 110.7 | P74 L253 G392 L393 V394 C399 | P74-I396 HydrophobicContact CG-CD1 3.62Å; P74-I396 HydrophobicContact CG-CG1 3.83Å; L253-I396 HydrophobicContact CD1-CD1 3.69Å; L253-I396 HydrophobicContact CD2-CD1 3.94Å; L253-I396 HydrophobicContact CG-CD1 4.5Å; G392-I396 WeakPolarHBondContact O-CD1 3.35Å; G392-I396 VanDerWaalsContact O-CG1 3.24Å; G392-I396 WeakPolarHBondContact O-CG1 3.34Å; G392-I396 PolarHBondContact O-N 3.09Å; L393-I396 PolarHBondContact O-N 3.39Å; V394-I396 VanDerWaalsContact C-N 3.34Å; V394-I396 PolarHBondContact O-N 3.27Å; I396-C399 VanDerWaalsContact O-CB 3.27Å; I396-C399 WeakPolarHBondContact O-CB 3.18Å; I396-C399 PolarHBondContact O-N 3.33Å; I396-C399 PolarHBondContact O-SG 3.4Å |
| 397 | V | 91.4 | Very high | 89.3 | Confident | 50 Ų | 50 | 29.3 Ų | 29.3 | 30% | 0.303 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -70.1 | -36.3 | -178.3 | 176.4 | 0 | 0 | 0 | 0 | 111.2 | L267 V271 L393 V394 C399 C400 P401 | L267-V397 HydrophobicContact CD1-CB 3.98Å; L267-V397 HydrophobicContact CD1-CG1 3.94Å; L267-V397 HydrophobicContact CD1-CG2 4.46Å; L267-V397 HydrophobicContact CD2-CG1 4.48Å; L267-V397 HydrophobicContact CD2-CG2 4.48Å; L267-V397 HydrophobicContact CG-CG1 4.33Å; V271-V397 HydrophobicContact CG2-CG1 3.56Å; L393-V397 WeakPolarHBondContact O-CG2 3.33Å; L393-V397 PolarHBondContact O-N 3.24Å; L393-V397 VanDerWaalsContact O-N 3.17Å; V394-V397 PolarHBondContact O-N 3.28Å; V394-V397 VanDerWaalsContact O-N 3.15Å; V397-C399 PolarHBondContact O-N 3.44Å; V397-C400 PolarHBondContact O-N 3.07Å; V397-P401 VanDerWaalsContact O-CD 3.3Å; V397-P401 WeakPolarHBondContact O-CD 3.39Å |
| 398 | E | 90.7 | Very high | 90.1 | Very high | 4 Ų | 4 | 32 Ų | 32 | 2% | 0.019 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -66.8 | -15.4 | 175.5 | -73.3 | 174.6 | 175.1 | 0 | 0 | 113.2 | N270 F274 V394 T395 C400 P401 V402 | N270-E398 PolarHBondContact ND2-OE1 3.4Å; F274-E398 HydrophobicContact CD2-CB 4.33Å; F274-E398 HydrophobicContact CD2-CG 3.67Å; F274-E398 HydrophobicContact CE2-CG 3.84Å; F274-E398 WeakPolarHBondContact CE2-OE1 3.33Å; F274-E398 HydrophobicContact CG-CG 4.43Å; V394-E398 HydrophobicContact CG1-CG 4.04Å; V394-E398 WeakPolarHBondContact CG1-OE1 3.16Å; V394-E398 WeakPolarHBondContact O-CB 3.29Å; V394-E398 VanDerWaalsContact O-CG 3.26Å; V394-E398 WeakPolarHBondContact O-CG 3.47Å; V394-E398 PolarHBondContact O-N 3.48Å; T395-E398 PolarHBondContact O-N 2.9Å; E398-C400 VanDerWaalsContact C-N 3.31Å; E398-C400 PolarHBondContact O-N 3.28Å; E398-P401 VanDerWaalsContact O-CD 3.23Å; E398-P401 WeakPolarHBondContact O-CD 3.5Å; E398-P401 VanDerWaalsContact O-CG 3.26Å; E398-P401 WeakPolarHBondContact O-CG 3.49Å; E398-V402 WeakPolarHBondContact O-CB 3.31Å; E398-V402 WeakPolarHBondContact O-CG2 3.39Å; E398-V402 PolarHBondContact O-N 3.46Å |
| 399 | C | 92 | Very high | 90.9 | Very high | 18 Ų | 18 | 27.8 Ų | 27.8 | 12% | 0.122 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -61.3 | -39.5 | 175.9 | -65.6 | 0 | 0 | 0 | 0 | 112.5 | A67 G71 T395 I396 V397 V402 L403 | A67-C399 PolarHBondContact O-SG 3.38Å; A67-C399 VanDerWaalsContact O-SG 3.42Å; G71-C399 WeakPolarHBondContact CA-SG 3.41Å; G71-C399 PolarHBondContact N-SG 3.13Å; T395-C399 PolarHBondContact O-N 3Å; T395-C399 PolarHBondContact O-SG 3.49Å; I396-C399 VanDerWaalsContact O-CB 3.27Å; I396-C399 WeakPolarHBondContact O-CB 3.18Å; I396-C399 PolarHBondContact O-N 3.33Å; I396-C399 PolarHBondContact O-SG 3.4Å; V397-C399 PolarHBondContact O-N 3.44Å; C399-V402 PolarHBondContact O-N 3.4Å; C399-L403 WeakPolarHBondContact O-CB 3.18Å; C399-L403 PolarHBondContact O-N 3.02Å |
| 400 | C | 93.9 | Very high | 91.4 | Very high | 78 Ų | 78 | 26.4 Ų | 26.4 | 53% | 0.527 | 15% | 0.153 | S | C | . | . | H | α-helix | trans | -61.4 | -54.5 | -178.1 | -63.1 | 0 | 0 | 0 | 0 | 112.9 | V397 E398 V402 L403 L404 | V397-C400 PolarHBondContact O-N 3.07Å; E398-C400 VanDerWaalsContact C-N 3.31Å; E398-C400 PolarHBondContact O-N 3.28Å; C400-V402 VanDerWaalsContact C-N 3.33Å; C400-V402 PolarHBondContact O-N 3.38Å; C400-L403 PolarHBondContact O-N 2.93Å; C400-L404 WeakPolarHBondContact O-CB 3.38Å; C400-L404 WeakPolarHBondContact O-CG 3.29Å; C400-L404 PolarHBondContact O-N 3.49Å; C400-L404 VanDerWaalsContact O-N 3.09Å |
| 401 | P | 95.4 | Very high | 91.7 | Very high | 1 Ų | 1 | 34.1 Ų | 34.1 | 1% | 0.006 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -65.4 | -34.9 | 177.8 | 25.3 | -35.1 | 0 | 0 | 0 | 112.7 | V271 F274 F275 V397 E398 L403 L404 G405 | V271-P401 HydrophobicContact CG1-CG 4.3Å; V271-P401 WeakPolarHBondContact O-CB 3.49Å; F274-P401 HydrophobicContact CB-CB 3.95Å; F274-P401 HydrophobicContact CB-CG 3.78Å; F275-P401 HydrophobicContact CD1-CB 4.24Å; F275-P401 HydrophobicContact CD2-CB 3.51Å; F275-P401 HydrophobicContact CE1-CB 4.33Å; F275-P401 HydrophobicContact CE2-CB 3.61Å; F275-P401 HydrophobicContact CG-CB 3.83Å; F275-P401 HydrophobicContact CZ-CB 4.03Å; V397-P401 VanDerWaalsContact O-CD 3.3Å; V397-P401 WeakPolarHBondContact O-CD 3.39Å; E398-P401 VanDerWaalsContact O-CD 3.23Å; E398-P401 WeakPolarHBondContact O-CD 3.5Å; E398-P401 VanDerWaalsContact O-CG 3.26Å; E398-P401 WeakPolarHBondContact O-CG 3.49Å; P401-L403 VanDerWaalsContact C-N 3.35Å; P401-L404 PolarHBondContact O-N 2.94Å; P401-G405 WeakPolarHBondContact O-CA 3.36Å; P401-G405 PolarHBondContact O-N 3.39Å |
| 402 | V | 93.9 | Very high | 92.1 | Very high | 0 Ų | 0 | 35.1 Ų | 35.1 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -66.6 | -37.4 | 177 | 172.1 | 0 | 0 | 0 | 0 | 111.9 | L66 F274 F278 E398 C399 C400 P406 | L66-V402 HydrophobicContact CB-CG1 3.55Å; L66-V402 HydrophobicContact CD1-CG1 4.35Å; F274-V402 HydrophobicContact CB-CG2 4.23Å; F274-V402 HydrophobicContact CD1-CG2 3.82Å; F274-V402 HydrophobicContact CG-CG2 4.29Å; F278-V402 HydrophobicContact CD2-CG1 4.26Å; F278-V402 HydrophobicContact CD2-CG2 3.81Å; F278-V402 HydrophobicContact CE2-CG1 4.38Å; F278-V402 HydrophobicContact CE2-CG2 3.66Å; E398-V402 WeakPolarHBondContact O-CB 3.31Å; E398-V402 WeakPolarHBondContact O-CG2 3.39Å; E398-V402 PolarHBondContact O-N 3.46Å; C399-V402 PolarHBondContact O-N 3.4Å; C400-V402 VanDerWaalsContact C-N 3.33Å; C400-V402 PolarHBondContact O-N 3.38Å; V402-P406 WeakPolarHBondContact O-CD 3.38Å |
| 403 | L | 95.9 | Very high | 92.4 | Very high | 54 Ų | 54 | 34.7 Ų | 34.7 | 28% | 0.283 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -67.9 | -42.5 | 176.7 | -178.4 | 60.6 | 0 | 0 | 0 | 112.1 | W60 S63 I64 A67 C399 C400 P401 P407 | W60-L403 HydrophobicContact CE3-CD1 3.94Å; W60-L403 HydrophobicContact CE3-CG 4.48Å; W60-L403 HydrophobicContact CZ3-CD1 3.63Å; W60-L403 HydrophobicContact CZ3-CD2 4.37Å; W60-L403 HydrophobicContact CZ3-CG 3.72Å; S63-L403 WeakPolarHBondContact CB-O 3.3Å; I64-L403 HydrophobicContact CB-CD1 4.31Å; I64-L403 HydrophobicContact CG1-CD1 3.67Å; A67-L403 HydrophobicContact CB-CB 3.75Å; A67-L403 HydrophobicContact CB-CD1 3.97Å; A67-L403 HydrophobicContact CB-CG 4.34Å; C399-L403 WeakPolarHBondContact O-CB 3.18Å; C399-L403 PolarHBondContact O-N 3.02Å; C400-L403 PolarHBondContact O-N 2.93Å; P401-L403 VanDerWaalsContact C-N 3.35Å; L403-P407 WeakPolarHBondContact O-CD 3.34Å |
| 404 | L | 95.4 | Very high | 92.6 | Very high | 78 Ų | 78 | 37 Ų | 37 | 41% | 0.408 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -91.6 | -25.8 | -171.6 | -63.7 | 176.5 | 0 | 0 | 0 | 113.9 | W60 F275 C400 P401 P407 L408 | W60-L404 HydrophobicContact CH2-CD2 3.83Å; F275-L404 HydrophobicContact CE1-CB 3.96Å; C400-L404 WeakPolarHBondContact O-CB 3.38Å; C400-L404 WeakPolarHBondContact O-CG 3.29Å; C400-L404 PolarHBondContact O-N 3.49Å; C400-L404 VanDerWaalsContact O-N 3.09Å; P401-L404 PolarHBondContact O-N 2.94Å; L404-P407 WeakPolarHBondContact O-CD 3.41Å; L404-L408 WeakPolarHBondContact O-CB 3.36Å; L404-L408 PolarHBondContact O-N 2.67Å |
| 405 | G | 94.8 | Very high | 92.7 | Very high | 0 Ų | 0 | 43.1 Ų | 43.1 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -57.3 | -66.2 | -172.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | F275 P401 L408 L409 | F275-G405 WeakPolarHBondContact O-CA 3.47Å; P401-G405 WeakPolarHBondContact O-CA 3.36Å; P401-G405 PolarHBondContact O-N 3.39Å; G405-L408 PolarHBondContact O-N 2.75Å; G405-L409 WeakPolarHBondContact O-CB 3.49Å; G405-L409 WeakPolarHBondContact O-CD1 3.35Å; G405-L409 WeakPolarHBondContact O-CG 3.28Å; G405-L409 PolarHBondContact O-N 3.48Å |
| 406 | P | 95 | Very high | 92.8 | Very high | 2 Ų | 2 | 48.8 Ų | 48.8 | 1% | 0.013 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -59 | -42.1 | -178.5 | -21.1 | 31.9 | 0 | 0 | 0 | 114.1 | S63 A279 F283 V402 L409 G410 | S63-P406 WeakPolarHBondContact OG-CB 3.38Å; S63-P406 VanDerWaalsContact OG-CG 3.31Å; S63-P406 WeakPolarHBondContact OG-CG 3.17Å; A279-P406 HydrophobicContact CB-CB 4.31Å; A279-P406 HydrophobicContact CB-CG 4.37Å; F283-P406 HydrophobicContact CE2-CB 4.37Å; F283-P406 WeakPolarHBondContact CE2-O 3.26Å; F283-P406 HydrophobicContact CZ-CB 4.26Å; F283-P406 WeakPolarHBondContact CZ-O 3.24Å; V402-P406 WeakPolarHBondContact O-CD 3.38Å; P406-L409 PolarHBondContact O-N 2.97Å; P406-G410 WeakPolarHBondContact O-CA 3.1Å; P406-G410 PolarHBondContact O-N 3.15Å |
| 407 | P | 94.8 | Very high | 92.8 | Very high | 4 Ų | 4 | 49.2 Ų | 49.2 | 3% | 0.026 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -63.9 | -44 | 176.5 | -25.4 | 35.8 | 0 | 0 | 0 | 114.1 | S56 S59 W60 S63 L403 L404 L409 G410 R411 | S56-P407 PolarHBondContact OG-O 2.83Å; S59-P407 WeakPolarHBondContact OG-CA 3.44Å; W60-P407 HydrophobicContact CB-CG 4.48Å; W60-P407 HydrophobicContact CD2-CB 3.97Å; W60-P407 HydrophobicContact CD2-CG 3.53Å; W60-P407 VanDerWaalsContact CE2-CB 3.48Å; W60-P407 HydrophobicContact CE3-CG 4.04Å; W60-P407 HydrophobicContact CG-CB 4.13Å; W60-P407 HydrophobicContact CG-CG 3.72Å; W60-P407 HydrophobicContact CZ2-CB 3.91Å; W60-P407 HydrophobicContact CZ2-CG 4.12Å; S63-P407 WeakPolarHBondContact OG-CD 3.35Å; L403-P407 WeakPolarHBondContact O-CD 3.34Å; L404-P407 WeakPolarHBondContact O-CD 3.41Å; P407-L409 VanDerWaalsContact C-N 3.32Å; P407-L409 PolarHBondContact O-N 2.81Å; P407-G410 PolarHBondContact O-N 3.42Å; P407-R411 PolarHBondContact O-N 2.92Å |
| 408 | L | 94 | Very high | 92.8 | Very high | 111 Ų | 111 | 48.8 Ų | 48.8 | 58% | 0.581 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -62.2 | -43.1 | 178.2 | -171.5 | 78.3 | 0 | 0 | 0 | 111.2 | L404 G405 R411 | L404-L408 WeakPolarHBondContact O-CB 3.36Å; L404-L408 PolarHBondContact O-N 2.67Å; G405-L408 PolarHBondContact O-N 2.75Å; L408-R411 WeakPolarHBondContact O-CB 3.24Å |
| 409 | L | 92.3 | Very high | 92.8 | Very high | 13 Ų | 13 | 48.9 Ų | 48.9 | 7% | 0.068 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -79.8 | -27.7 | -177.9 | -71.3 | 164.8 | 0 | 0 | 0 | 113 | F275 A279 G405 P406 P407 R411 L412 T422 A425 C426 | F275-L409 WeakPolarHBondContact O-CD1 3.43Å; A279-L409 HydrophobicContact CB-CB 4.14Å; A279-L409 HydrophobicContact CB-CD1 3.63Å; G405-L409 WeakPolarHBondContact O-CB 3.49Å; G405-L409 WeakPolarHBondContact O-CD1 3.35Å; G405-L409 WeakPolarHBondContact O-CG 3.28Å; G405-L409 PolarHBondContact O-N 3.48Å; P406-L409 PolarHBondContact O-N 2.97Å; P407-L409 VanDerWaalsContact C-N 3.32Å; P407-L409 PolarHBondContact O-N 2.81Å; L409-R411 VanDerWaalsContact C-N 3.32Å; L409-L412 HydrophobicContact CD2-CD1 4Å; L409-L412 WeakPolarHBondContact O-CB 3.21Å; L409-L412 PolarHBondContact O-N 3.31Å; L409-T422 HydrophobicContact CB-CG2 4.02Å; L409-T422 PolarHBondContact O-OG1 3.34Å; L409-A425 HydrophobicContact CD2-CB 3.72Å; L409-C426 VanDerWaalsContact CD1-SG 3.55Å |
| 410 | G | 90.9 | Very high | 92.9 | Very high | 0 Ų | 0 | 50.8 Ų | 50.8 | 0% | 0 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -66.4 | -35.9 | 170.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | P406 P407 L412 S413 D414 | P406-G410 WeakPolarHBondContact O-CA 3.1Å; P406-G410 PolarHBondContact O-N 3.15Å; P407-G410 PolarHBondContact O-N 3.42Å; G410-L412 PolarHBondContact O-N 3.39Å; G410-S413 WeakPolarHBondContact O-CA 3.28Å; G410-S413 VanDerWaalsContact O-CB 3.3Å; G410-S413 WeakPolarHBondContact O-CB 3.2Å; G410-S413 PolarHBondContact O-N 3.5Å; G410-D414 PolarHBondContact O-N 3.12Å |
| 411 | R | 93 | Very high | 92.9 | Very high | 162 Ų | 162 | 51 Ų | 51 | 61% | 0.611 | 26% | 0.255 | S | S | * | . | H | α-helix | trans | -60.2 | -31.5 | 174.3 | -169.2 | 175.6 | -179.1 | 144.3 | 1.8 | 113.1 | P407 L408 L409 D414 M415 | P407-R411 PolarHBondContact O-N 2.92Å; L408-R411 WeakPolarHBondContact O-CB 3.24Å; L409-R411 VanDerWaalsContact C-N 3.32Å; R411-D414 PolarHBondContact O-N 3.26Å; R411-M415 HydrophobicContact CG-SD 4.44Å; R411-M415 VanDerWaalsContact O-CG 3.31Å; R411-M415 WeakPolarHBondContact O-CG 3.38Å; R411-M415 PolarHBondContact O-N 3.47Å |
| 412 | L | 92.4 | Very high | 92.9 | Very high | 55 Ų | 55 | 50.9 Ų | 50.9 | 29% | 0.288 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -63.4 | -42.6 | 171.8 | -68.1 | 171.8 | 0 | 0 | 0 | 111.2 | L409 G410 D414 M415 Y416 A425 | L409-L412 HydrophobicContact CD2-CD1 4Å; L409-L412 WeakPolarHBondContact O-CB 3.21Å; L409-L412 PolarHBondContact O-N 3.31Å; G410-L412 PolarHBondContact O-N 3.39Å; L412-D414 VanDerWaalsContact C-N 3.32Å; L412-D414 PolarHBondContact O-N 3.15Å; L412-M415 PolarHBondContact O-N 3.42Å; L412-Y416 HydrophobicContact CD2-CE2 4.3Å; L412-Y416 VanDerWaalsContact O-CD2 3.31Å; L412-Y416 WeakPolarHBondContact O-CD2 3.44Å; L412-Y416 PolarHBondContact O-N 3.48Å; L412-Y416 VanDerWaalsContact O-N 3.09Å; L412-A425 HydrophobicContact CD1-CB 3.78Å |
| 413 | S | 89.7 | Confident | 93 | Very high | 7 Ų | 7 | 50.9 Ų | 50.9 | 5% | 0.049 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -64.4 | -38.5 | 174.7 | -171.5 | 0 | 0 | 0 | 0 | 111.6 | G410 G417 Y419 | G410-S413 WeakPolarHBondContact O-CA 3.28Å; G410-S413 VanDerWaalsContact O-CB 3.3Å; G410-S413 WeakPolarHBondContact O-CB 3.2Å; G410-S413 PolarHBondContact O-N 3.5Å; S413-G417 VanDerWaalsContact O-CA 3.26Å; S413-G417 WeakPolarHBondContact O-CA 3.43Å; S413-G417 PolarHBondContact O-N 3.03Å; S413-Y419 WeakPolarHBondContact OG-CD1 3.25Å |
| 414 | D | 91.6 | Very high | 93 | Very high | 56 Ų | 56 | 53.4 Ų | 53.4 | 30% | 0.299 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -66.4 | -36.6 | 178.4 | -63.8 | -38.8 | 0 | 0 | 0 | 112.3 | T55 S56 G410 R411 L412 | T55-D414 WeakPolarHBondContact CA-OD1 3.43Å; T55-D414 WeakPolarHBondContact CB-OD1 3.35Å; T55-D414 PolarHBondContact N-OD1 3.18Å; T55-D414 PolarHBondContact N-OD2 2.8Å; T55-D414 PolarHBondContact OG1-OD1 3.45Å; S56-D414 VanDerWaalsContact CB-OD2 3.23Å; S56-D414 WeakPolarHBondContact CB-OD2 3.44Å; S56-D414 PolarHBondContact N-OD2 2.93Å; G410-D414 PolarHBondContact O-N 3.12Å; R411-D414 PolarHBondContact O-N 3.26Å; L412-D414 VanDerWaalsContact C-N 3.32Å; L412-D414 PolarHBondContact O-N 3.15Å |
| 415 | M | 91.6 | Very high | 93.1 | Very high | 131 Ų | 131 | 50.8 Ų | 50.8 | 65% | 0.645 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -75 | -41.3 | 179.7 | -73 | 178 | 62.7 | 0 | 0 | 113.4 | R411 L412 | R411-M415 HydrophobicContact CG-SD 4.44Å; R411-M415 VanDerWaalsContact O-CG 3.31Å; R411-M415 WeakPolarHBondContact O-CG 3.38Å; R411-M415 PolarHBondContact O-N 3.47Å; L412-M415 PolarHBondContact O-N 3.42Å |
| 416 | Y | 91.9 | Very high | 93.2 | Very high | 139 Ų | 139 | 50.8 Ų | 50.8 | 55% | 0.545 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -99.2 | -9.2 | -174.5 | -68.4 | -76 | 0 | 0 | 0 | 113.9 | L412 D418 Y421 | L412-Y416 HydrophobicContact CD2-CE2 4.3Å; L412-Y416 VanDerWaalsContact O-CD2 3.31Å; L412-Y416 WeakPolarHBondContact O-CD2 3.44Å; L412-Y416 PolarHBondContact O-N 3.48Å; L412-Y416 VanDerWaalsContact O-N 3.09Å; Y416-D418 VanDerWaalsContact C-N 3.28Å; Y416-D418 PolarHBondContact O-N 3.14Å; Y416-Y421 HydrophobicContact CD1-CE2 4.29Å; Y416-Y421 HydrophobicContact CD2-CD2 4.28Å; Y416-Y421 HydrophobicContact CD2-CG 4.28Å; Y416-Y421 AromaticContact CG-CD2 3.87Å; Y416-Y421 HydrophobicContact CG-CD2 3.87Å; Y416-Y421 AromaticContact CG-CE2 3.99Å; Y416-Y421 HydrophobicContact CG-CE2 3.99Å; Y416-Y421 HydrophobicContact CG-CG 4.27Å |
| 417 | G | 88.3 | Confident | 93.3 | Very high | 70 Ų | 70 | 50.7 Ų | 50.7 | 72% | 0.722 | 25% | 0.25 | S | S | * | . | S | Bend | trans | 72.7 | 12.4 | 179.6 | 0 | 0 | 0 | 0 | 0 | 115.1 | S413 | S413-G417 VanDerWaalsContact O-CA 3.26Å; S413-G417 WeakPolarHBondContact O-CA 3.43Å; S413-G417 PolarHBondContact O-N 3.03Å |
| 418 | D | 90.7 | Very high | 93.4 | Very high | 41 Ų | 41 | 54.6 Ų | 54.6 | 22% | 0.219 | 27% | 0.27 | C | S | . | . | trans | -147.5 | 130.5 | -175.1 | -167.2 | -28.6 | 0 | 0 | 0 | 111.6 | Y416 K420 Y421 | Y416-D418 VanDerWaalsContact C-N 3.28Å; Y416-D418 PolarHBondContact O-N 3.14Å; D418-K420 HydrophobicContact CB-CD 4.41Å; D418-K420 HydrophobicContact CB-CG 4.13Å; D418-K420 PolarHBondContact O-N 3.38Å; D418-K420 WeakPolarHBondContact OD1-CB 3.29Å; D418-K420 WeakPolarHBondContact OD1-CG 3.45Å; D418-K420 PolarHBondContact OD1-N 3.48Å; D418-K420 WeakPolarHBondContact OD2-CD 3.47Å; D418-K420 WeakPolarHBondContact OD2-CE 3.45Å; D418-K420 IonicContact OD2-NZ 3.42Å; D418-K420 PolarHBondContact OD2-NZ 3.32Å; D418-Y421 HydrophobicContact CB-CD2 4.2Å; D418-Y421 HydrophobicContact CB-CE2 4.2Å | ||
| 419 | Y | 92.3 | Very high | 93.6 | Very high | 7 Ų | 7 | 51.3 Ų | 51.3 | 3% | 0.027 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -67.6 | -15.8 | 178.5 | -74 | -78.3 | 0 | 0 | 0 | 113.4 | T55 F283 S286 Y287 S413 Y421 T422 Y423 | T55-Y419 HydrophobicContact CG2-CE1 3.85Å; T55-Y419 WeakPolarHBondContact CG2-OH 3.46Å; F283-Y419 HydrophobicContact CB-CD1 4Å; F283-Y419 HydrophobicContact CB-CE1 3.87Å; F283-Y419 HydrophobicContact CD1-CE1 4.03Å; F283-Y419 HydrophobicContact CG-CD1 4.3Å; F283-Y419 AromaticContact CG-CE1 3.91Å; F283-Y419 HydrophobicContact CG-CE1 3.91Å; S286-Y419 VanDerWaalsContact CB-OH 3.28Å; S286-Y419 WeakPolarHBondContact CB-OH 3.33Å; Y287-Y419 VanDerWaalsContact CD2-CB 3.49Å; Y287-Y419 AromaticContact CD2-CD2 3.97Å; Y287-Y419 HydrophobicContact CD2-CD2 3.97Å; Y287-Y419 HydrophobicContact CD2-CG 4.08Å; Y287-Y419 HydrophobicContact CG-CD2 4.4Å; Y287-Y419 HydrophobicContact CG-CG 4.25Å; S413-Y419 WeakPolarHBondContact OG-CD1 3.25Å; Y419-Y421 PolarHBondContact O-N 3.34Å; Y419-T422 WeakPolarHBondContact O-CB 3.46Å; Y419-T422 PolarHBondContact O-N 2.94Å; Y419-Y423 WeakPolarHBondContact O-CD2 3.49Å; Y419-Y423 PolarHBondContact O-N 2.9Å |
| 420 | K | 93.2 | Very high | 93.8 | Very high | 58 Ų | 58 | 50.7 Ų | 50.7 | 25% | 0.252 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -53.5 | -39 | 178.2 | 71.1 | -172.1 | 170.7 | -140.8 | 0 | 112.7 | P348 D418 Y423 W424 | P348-K420 HydrophobicContact CB-CB 3.78Å; P348-K420 HydrophobicContact CG-CB 3.96Å; D418-K420 HydrophobicContact CB-CD 4.41Å; D418-K420 HydrophobicContact CB-CG 4.13Å; D418-K420 PolarHBondContact O-N 3.38Å; D418-K420 WeakPolarHBondContact OD1-CB 3.29Å; D418-K420 WeakPolarHBondContact OD1-CG 3.45Å; D418-K420 PolarHBondContact OD1-N 3.48Å; D418-K420 WeakPolarHBondContact OD2-CD 3.47Å; D418-K420 WeakPolarHBondContact OD2-CE 3.45Å; D418-K420 IonicContact OD2-NZ 3.42Å; D418-K420 PolarHBondContact OD2-NZ 3.32Å; K420-Y423 PolarHBondContact O-N 2.8Å; K420-W424 HydrophobicContact CD-CH2 4.41Å; K420-W424 PolarHBondContact O-N 3.16Å |
| 421 | Y | 93.8 | Very high | 94.2 | Very high | 81 Ų | 81 | 52.3 Ų | 52.3 | 32% | 0.318 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -68.7 | -38 | -179.7 | -62.5 | -73.3 | 0 | 0 | 0 | 111.6 | Y416 D418 Y419 W424 A425 | Y416-Y421 HydrophobicContact CD1-CE2 4.29Å; Y416-Y421 HydrophobicContact CD2-CD2 4.28Å; Y416-Y421 HydrophobicContact CD2-CG 4.28Å; Y416-Y421 AromaticContact CG-CD2 3.87Å; Y416-Y421 HydrophobicContact CG-CD2 3.87Å; Y416-Y421 AromaticContact CG-CE2 3.99Å; Y416-Y421 HydrophobicContact CG-CE2 3.99Å; Y416-Y421 HydrophobicContact CG-CG 4.27Å; D418-Y421 HydrophobicContact CB-CD2 4.2Å; D418-Y421 HydrophobicContact CB-CE2 4.2Å; Y419-Y421 PolarHBondContact O-N 3.34Å; Y421-W424 HydrophobicContact CD1-CE3 4.07Å; Y421-W424 HydrophobicContact CD1-CZ3 4.15Å; Y421-W424 HydrophobicContact CE1-CE3 4.41Å; Y421-W424 HydrophobicContact CE1-CZ3 4.03Å; Y421-A425 WeakPolarHBondContact O-CB 3.33Å; Y421-A425 PolarHBondContact O-N 3.47Å |
| 422 | T | 95.3 | Very high | 94.4 | Very high | 0 Ų | 0 | 49.2 Ų | 49.2 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -60.6 | -47.1 | 172.8 | -61.5 | 0 | 0 | 0 | 0 | 110.8 | F283 L409 Y419 A425 C426 | F283-T422 HydrophobicContact CD2-CG2 3.9Å; F283-T422 HydrophobicContact CE2-CG2 4.24Å; L409-T422 HydrophobicContact CB-CG2 4.02Å; L409-T422 PolarHBondContact O-OG1 3.34Å; Y419-T422 WeakPolarHBondContact O-CB 3.46Å; Y419-T422 PolarHBondContact O-N 2.94Å; T422-A425 PolarHBondContact O-N 3.45Å; T422-C426 PolarHBondContact O-N 3.09Å; T422-C426 PolarHBondContact O-SG 3.24Å |
| 423 | Y | 96.1 | Very high | 94.7 | Very high | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -68.5 | -40 | -178.8 | -83 | -112.4 | 0 | 0 | 0 | 112.8 | P280 L284 Y287 A347 Y359 Y419 K420 C426 G427 | P280-Y423 HydrophobicContact CB-CD1 4.2Å; P280-Y423 HydrophobicContact CB-CE1 3.83Å; P280-Y423 PolarHBondContact O-OH 3.45Å; P280-Y423 VanDerWaalsContact O-OH 3.07Å; L284-Y423 WeakPolarHBondContact CA-OH 3.34Å; Y287-Y423 HydrophobicContact CD1-CD2 4.18Å; Y287-Y423 HydrophobicContact CD1-CE1 4.25Å; Y287-Y423 AromaticContact CD1-CE2 3.68Å; Y287-Y423 HydrophobicContact CD1-CE2 3.68Å; Y287-Y423 AromaticContact CD1-CZ 3.71Å; Y287-Y423 HydrophobicContact CE1-CD2 4.38Å; Y287-Y423 HydrophobicContact CE1-CE2 4.31Å; Y287-Y423 HydrophobicContact CG-CE2 4.24Å; A347-Y423 HydrophobicContact CB-CD1 3.52Å; A347-Y423 HydrophobicContact CB-CE1 4.02Å; A347-Y423 HydrophobicContact CB-CG 4.4Å; Y359-Y423 HydrophobicContact CE1-CE1 4.14Å; Y359-Y423 AromaticContact CZ-CE1 3.86Å; Y359-Y423 WeakPolarHBondContact OH-CE1 3.32Å; Y419-Y423 WeakPolarHBondContact O-CD2 3.49Å; Y419-Y423 PolarHBondContact O-N 2.9Å; K420-Y423 PolarHBondContact O-N 2.8Å; Y423-C426 PolarHBondContact O-N 3.1Å; Y423-G427 PolarHBondContact O-N 3.16Å |
| 424 | W | 96.3 | Very high | 95 | Very high | 106 Ų | 106 | 46.3 Ų | 46.3 | 40% | 0.402 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -60.9 | -45.7 | 171.9 | -72.7 | -19.1 | 0 | 0 | 0 | 112.1 | M345 K420 Y421 C426 G427 I428 | M345-W424 PolarHBondContact O-NE1 2.92Å; K420-W424 HydrophobicContact CD-CH2 4.41Å; K420-W424 PolarHBondContact O-N 3.16Å; Y421-W424 HydrophobicContact CD1-CE3 4.07Å; Y421-W424 HydrophobicContact CD1-CZ3 4.15Å; Y421-W424 HydrophobicContact CE1-CE3 4.41Å; Y421-W424 HydrophobicContact CE1-CZ3 4.03Å; W424-C426 PolarHBondContact O-N 3.16Å; W424-G427 PolarHBondContact O-N 3.2Å; W424-I428 VanDerWaalsContact O-CG1 3.29Å; W424-I428 WeakPolarHBondContact O-CG1 3.5Å; W424-I428 PolarHBondContact O-N 3.29Å |
| 425 | A | 96.6 | Very high | 95.3 | Very high | 24 Ų | 24 | 47.7 Ų | 47.7 | 20% | 0.198 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -61 | -45 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | L409 L412 Y421 T422 G427 I428 V429 | L409-A425 HydrophobicContact CD2-CB 3.72Å; L412-A425 HydrophobicContact CD1-CB 3.78Å; Y421-A425 WeakPolarHBondContact O-CB 3.33Å; Y421-A425 PolarHBondContact O-N 3.47Å; T422-A425 PolarHBondContact O-N 3.45Å; A425-G427 VanDerWaalsContact C-N 3.35Å; A425-G427 PolarHBondContact O-N 3.3Å; A425-I428 PolarHBondContact O-N 3.15Å; A425-V429 VanDerWaalsContact O-CG2 3.31Å; A425-V429 WeakPolarHBondContact O-CG2 3.28Å; A425-V429 PolarHBondContact O-N 2.96Å |
| 426 | C | 96.8 | Very high | 95.6 | Very high | 0 Ų | 0 | 45.7 Ų | 45.7 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -59.2 | -45.9 | 175.3 | -64.1 | 0 | 0 | 0 | 0 | 111.7 | P280 L409 T422 Y423 W424 I428 V429 L430 | P280-C426 HydrophobicContact CG-CB 3.57Å; P280-C426 VanDerWaalsContact CG-SG 3.59Å; L409-C426 VanDerWaalsContact CD1-SG 3.55Å; T422-C426 PolarHBondContact O-N 3.09Å; T422-C426 PolarHBondContact O-SG 3.24Å; Y423-C426 PolarHBondContact O-N 3.1Å; W424-C426 PolarHBondContact O-N 3.16Å; C426-I428 PolarHBondContact O-N 2.83Å; C426-V429 PolarHBondContact O-N 2.63Å; C426-L430 WeakPolarHBondContact O-CG 3.48Å; C426-L430 PolarHBondContact O-N 3.16Å |
| 427 | G | 97.3 | Very high | 95.8 | Very high | 0 Ų | 0 | 39.2 Ų | 39.2 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -60 | -45.7 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | G341 Y423 W424 A425 L430 I431 | G341-G427 VanDerWaalsContact O-CA 3.26Å; G341-G427 WeakPolarHBondContact O-CA 3.49Å; Y423-G427 PolarHBondContact O-N 3.16Å; W424-G427 PolarHBondContact O-N 3.2Å; A425-G427 VanDerWaalsContact C-N 3.35Å; A425-G427 PolarHBondContact O-N 3.3Å; G427-L430 PolarHBondContact O-N 3.48Å; G427-I431 VanDerWaalsContact O-CG1 3.28Å; G427-I431 WeakPolarHBondContact O-CG1 3.39Å; G427-I431 PolarHBondContact O-N 2.88Å |
| 428 | I | 97.5 | Very high | 96.1 | Very high | 86 Ų | 86 | 41.1 Ų | 41.1 | 44% | 0.441 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -61.2 | -47.6 | 176.5 | -67.8 | 165.5 | 0 | 0 | 0 | 110.9 | M345 W424 A425 C426 L430 I431 I432 | M345-I428 HydrophobicContact SD-CG1 4.47Å; W424-I428 VanDerWaalsContact O-CG1 3.29Å; W424-I428 WeakPolarHBondContact O-CG1 3.5Å; W424-I428 PolarHBondContact O-N 3.29Å; A425-I428 PolarHBondContact O-N 3.15Å; C426-I428 PolarHBondContact O-N 2.83Å; I428-L430 VanDerWaalsContact C-N 3.33Å; I428-L430 PolarHBondContact O-N 2.91Å; I428-I431 PolarHBondContact O-N 3.22Å; I428-I432 HydrophobicContact CG2-CD1 3.64Å; I428-I432 HydrophobicContact CG2-CG1 4.35Å; I428-I432 WeakPolarHBondContact O-CB 3.18Å; I428-I432 VanDerWaalsContact O-CG1 3.29Å; I428-I432 WeakPolarHBondContact O-CG1 3.34Å; I428-I432 PolarHBondContact O-N 3.44Å |
| 429 | V | 97.3 | Very high | 96.4 | Very high | 41 Ų | 41 | 43.8 Ų | 43.8 | 25% | 0.248 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -58.4 | -44.6 | 178.9 | 169.2 | 0 | 0 | 0 | 0 | 111.4 | I272 F275 A425 C426 S433 | I272-V429 HydrophobicContact CG2-CG1 4.24Å; I272-V429 WeakPolarHBondContact O-CG1 3.44Å; F275-V429 HydrophobicContact CB-CG1 4.28Å; A425-V429 VanDerWaalsContact O-CG2 3.31Å; A425-V429 WeakPolarHBondContact O-CG2 3.28Å; A425-V429 PolarHBondContact O-N 2.96Å; C426-V429 PolarHBondContact O-N 2.63Å; V429-S433 WeakPolarHBondContact O-CB 3.44Å; V429-S433 PolarHBondContact O-N 3.39Å |
| 430 | L | 97.9 | Very high | 96.4 | Very high | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -68 | -42.1 | 178.1 | -69.9 | -172.5 | 0 | 0 | 0 | 112.6 | M273 L277 I337 N340 H344 C426 G427 I428 I432 S433 G434 | M273-L430 HydrophobicContact CB-CD2 4.33Å; M273-L430 HydrophobicContact CG-CD2 3.58Å; M273-L430 VanDerWaalsContact O-CD2 3.29Å; M273-L430 WeakPolarHBondContact O-CD2 3.2Å; L277-L430 HydrophobicContact CB-CD2 4.36Å; I337-L430 HydrophobicContact CG2-CB 4.35Å; I337-L430 HydrophobicContact CG2-CD2 4.35Å; I337-L430 VanDerWaalsContact CG2-O 3.3Å; I337-L430 WeakPolarHBondContact CG2-O 3.33Å; N340-L430 HydrophobicContact CB-CD1 3.7Å; H344-L430 VanDerWaalsContact CD2-CD1 3.46Å; H344-L430 WeakPolarHBondContact CD2-CD1 3.48Å; C426-L430 WeakPolarHBondContact O-CG 3.48Å; C426-L430 PolarHBondContact O-N 3.16Å; G427-L430 PolarHBondContact O-N 3.48Å; I428-L430 VanDerWaalsContact C-N 3.33Å; I428-L430 PolarHBondContact O-N 2.91Å; L430-I432 VanDerWaalsContact C-N 3.35Å; L430-I432 PolarHBondContact O-N 3.12Å; L430-S433 PolarHBondContact O-N 3.42Å; L430-G434 PolarHBondContact O-N 2.93Å |
| 431 | I | 98.2 | Very high | 96.3 | Very high | 35 Ų | 35 | 41.3 Ų | 41.3 | 18% | 0.179 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -61.8 | -45.1 | 177.2 | -70.1 | 166.2 | 0 | 0 | 0 | 110.5 | V342 M345 G427 I428 S433 G434 I435 | V342-I431 HydrophobicContact CG2-CD1 4.16Å; V342-I431 HydrophobicContact CG2-CG1 4.42Å; M345-I431 HydrophobicContact CG-CD1 4.13Å; M345-I431 HydrophobicContact SD-CD1 3.41Å; M345-I431 WeakPolarHBondContact SD-CD1 3.34Å; G427-I431 VanDerWaalsContact O-CG1 3.28Å; G427-I431 WeakPolarHBondContact O-CG1 3.39Å; G427-I431 PolarHBondContact O-N 2.88Å; I428-I431 PolarHBondContact O-N 3.22Å; I431-S433 PolarHBondContact O-N 3.06Å; I431-G434 PolarHBondContact O-N 3.31Å; I431-I435 HydrophobicContact CG2-CD1 3.7Å; I431-I435 HydrophobicContact CG2-CG1 4.4Å; I431-I435 WeakPolarHBondContact O-CG1 3.17Å; I431-I435 PolarHBondContact O-N 3.19Å |
| 432 | I | 98.1 | Very high | 96.2 | Very high | 97 Ų | 97 | 38.5 Ų | 38.5 | 50% | 0.497 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -60.2 | -46.6 | 176.6 | -69.1 | 171 | 0 | 0 | 0 | 110.6 | I428 L430 I435 Y436 | I428-I432 HydrophobicContact CG2-CD1 3.64Å; I428-I432 HydrophobicContact CG2-CG1 4.35Å; I428-I432 WeakPolarHBondContact O-CB 3.18Å; I428-I432 VanDerWaalsContact O-CG1 3.29Å; I428-I432 WeakPolarHBondContact O-CG1 3.34Å; I428-I432 PolarHBondContact O-N 3.44Å; L430-I432 VanDerWaalsContact C-N 3.35Å; L430-I432 PolarHBondContact O-N 3.12Å; I432-I435 PolarHBondContact O-N 2.68Å; I432-Y436 VanDerWaalsContact O-CB 3.22Å; I432-Y436 WeakPolarHBondContact O-CB 3.36Å; I432-Y436 PolarHBondContact O-N 3Å |
| 433 | S | 97.5 | Very high | 96 | Very high | 0 Ų | 0 | 43.3 Ų | 43.3 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61.8 | -43.8 | 177.1 | 175.2 | 0 | 0 | 0 | 0 | 112.4 | G269 M273 V429 L430 I431 Y436 L437 | G269-S433 PolarHBondContact O-OG 3.21Å; M273-S433 WeakPolarHBondContact CB-OG 3.21Å; V429-S433 WeakPolarHBondContact O-CB 3.44Å; V429-S433 PolarHBondContact O-N 3.39Å; L430-S433 PolarHBondContact O-N 3.42Å; I431-S433 PolarHBondContact O-N 3.06Å; S433-Y436 WeakPolarHBondContact O-CB 3.3Å; S433-Y436 PolarHBondContact O-N 3.28Å; S433-L437 WeakPolarHBondContact O-CB 3.21Å; S433-L437 PolarHBondContact O-N 2.88Å |
| 434 | G | 97.3 | Very high | 95.8 | Very high | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -62.7 | -45.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | L430 I431 L437 F438 | L430-G434 PolarHBondContact O-N 2.93Å; I431-G434 PolarHBondContact O-N 3.31Å; G434-L437 PolarHBondContact O-N 2.93Å; G434-F438 VanDerWaalsContact O-CB 3.29Å; G434-F438 WeakPolarHBondContact O-CB 3.36Å; G434-F438 PolarHBondContact O-N 3.38Å |
| 435 | I | 97.4 | Very high | 95.5 | Very high | 85 Ų | 85 | 41.9 Ų | 41.9 | 44% | 0.436 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -64.7 | -43.2 | 175.4 | -67.4 | 170.2 | 0 | 0 | 0 | 110.7 | I431 I432 L437 F438 I439 | I431-I435 HydrophobicContact CG2-CD1 3.7Å; I431-I435 HydrophobicContact CG2-CG1 4.4Å; I431-I435 WeakPolarHBondContact O-CG1 3.17Å; I431-I435 PolarHBondContact O-N 3.19Å; I432-I435 PolarHBondContact O-N 2.68Å; I435-L437 PolarHBondContact O-N 3.05Å; I435-F438 PolarHBondContact O-N 3.17Å; I435-I439 HydrophobicContact CG2-CD1 3.66Å; I435-I439 HydrophobicContact CG2-CG1 4.32Å; I435-I439 WeakPolarHBondContact O-CG1 3.38Å; I435-I439 PolarHBondContact O-N 3.26Å |
| 436 | Y | 97.4 | Very high | 95.2 | Very high | 89 Ų | 89 | 49 Ų | 49 | 35% | 0.349 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -57.4 | -48.9 | 176.6 | 170.9 | -96.4 | 0 | 0 | 0 | 111.6 | S268 I432 S433 G440 | S268-Y436 VanDerWaalsContact OG-CE1 3.29Å; S268-Y436 WeakPolarHBondContact OG-CE1 3.45Å; S268-Y436 PolarHBondContact OG-OH 3.18Å; I432-Y436 VanDerWaalsContact O-CB 3.22Å; I432-Y436 WeakPolarHBondContact O-CB 3.36Å; I432-Y436 PolarHBondContact O-N 3Å; S433-Y436 WeakPolarHBondContact O-CB 3.3Å; S433-Y436 PolarHBondContact O-N 3.28Å; Y436-G440 WeakPolarHBondContact O-CA 3.29Å; Y436-G440 PolarHBondContact O-N 2.97Å |
| 437 | L | 95.9 | Very high | 94.9 | Very high | 4 Ų | 4 | 52 Ų | 52 | 2% | 0.021 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -65.8 | -39.6 | 176.9 | -78.6 | 171.5 | 0 | 0 | 0 | 111.9 | L265 F333 A334 I337 S433 G434 I435 M441 | L265-L437 VanDerWaalsContact O-CD2 3.29Å; L265-L437 WeakPolarHBondContact O-CD2 3.23Å; F333-L437 HydrophobicContact CD1-CD1 4.34Å; F333-L437 HydrophobicContact CE1-CD1 3.9Å; A334-L437 HydrophobicContact CB-CB 4.44Å; I337-L437 HydrophobicContact CD1-CD1 3.46Å; I337-L437 VanDerWaalsContact CD1-CD1 3.46Å; S433-L437 WeakPolarHBondContact O-CB 3.21Å; S433-L437 PolarHBondContact O-N 2.88Å; G434-L437 PolarHBondContact O-N 2.93Å; I435-L437 PolarHBondContact O-N 3.05Å; L437-M441 HydrophobicContact CD2-CE 4.04Å; L437-M441 VanDerWaalsContact O-CB 3.25Å; L437-M441 WeakPolarHBondContact O-CB 3.3Å; L437-M441 WeakPolarHBondContact O-CG 3.45Å; L437-M441 PolarHBondContact O-N 3.05Å |
| 438 | F | 96.3 | Very high | 94.5 | Very high | 110 Ų | 110 | 55.4 Ų | 55.4 | 48% | 0.482 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -60 | -51 | 177.8 | -170.5 | -86.7 | 0 | 0 | 0 | 111.7 | Y331 A334 G434 I435 G442 | Y331-F438 AromaticContact CD1-CD2 3.6Å; Y331-F438 HydrophobicContact CD1-CD2 3.6Å; Y331-F438 HydrophobicContact CD1-CE1 4.46Å; Y331-F438 AromaticContact CD1-CE2 3.47Å; Y331-F438 HydrophobicContact CD1-CE2 3.47Å; Y331-F438 VanDerWaalsContact CD1-CE2 3.47Å; Y331-F438 HydrophobicContact CD1-CG 4.14Å; Y331-F438 AromaticContact CD1-CZ 3.94Å; Y331-F438 HydrophobicContact CD1-CZ 3.94Å; Y331-F438 HydrophobicContact CE1-CD2 4.36Å; Y331-F438 HydrophobicContact CE1-CE1 4.43Å; Y331-F438 HydrophobicContact CE1-CE2 4.21Å; Y331-F438 HydrophobicContact CE1-CZ 4.24Å; Y331-F438 HydrophobicContact CG-CE2 4.19Å; A334-F438 HydrophobicContact CB-CB 3.95Å; A334-F438 HydrophobicContact CB-CD2 4.13Å; G434-F438 VanDerWaalsContact O-CB 3.29Å; G434-F438 WeakPolarHBondContact O-CB 3.36Å; G434-F438 PolarHBondContact O-N 3.38Å; I435-F438 PolarHBondContact O-N 3.17Å; F438-G442 PolarHBondContact O-N 3.35Å; F438-G442 VanDerWaalsContact O-N 3.14Å |
| 439 | I | 95.6 | Very high | 94 | Very high | 97 Ų | 97 | 53.3 Ų | 53.3 | 50% | 0.497 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -69.2 | -45.9 | 179.8 | -63.7 | 172.2 | 0 | 0 | 0 | 110.6 | I435 M441 G442 I443 | I435-I439 HydrophobicContact CG2-CD1 3.66Å; I435-I439 HydrophobicContact CG2-CG1 4.32Å; I435-I439 WeakPolarHBondContact O-CG1 3.38Å; I435-I439 PolarHBondContact O-N 3.26Å; I439-M441 VanDerWaalsContact C-N 3.34Å; I439-M441 PolarHBondContact O-N 3.36Å; I439-G442 WeakPolarHBondContact O-CA 3.25Å; I439-G442 PolarHBondContact O-N 3.26Å; I439-G442 VanDerWaalsContact O-N 3.1Å; I439-I443 HydrophobicContact CG2-CD1 4.12Å; I439-I443 WeakPolarHBondContact O-CG1 3.37Å; I439-I443 PolarHBondContact O-N 3.29Å |
| 440 | G | 93.5 | Very high | 93.7 | Very high | 8 Ų | 8 | 57.2 Ų | 57.2 | 8% | 0.082 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -59.1 | -44.3 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y436 G442 I443 N444 | Y436-G440 WeakPolarHBondContact O-CA 3.29Å; Y436-G440 PolarHBondContact O-N 2.97Å; G440-G442 VanDerWaalsContact C-N 3.35Å; G440-I443 PolarHBondContact O-N 3.23Å; G440-N444 PolarHBondContact O-N 2.87Å |
| 441 | M | 91.3 | Very high | 93.2 | Very high | 4 Ų | 4 | 61.1 Ų | 61.1 | 2% | 0.02 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -69.1 | -33.7 | 176.2 | -65.3 | -59.4 | 166.7 | 0 | 0 | 111.8 | L265 Q330 L437 I439 I443 N444 Y445 | L265-M441 HydrophobicContact CB-CE 3.8Å; Q330-M441 HydrophobicContact CB-CB 4.2Å; Q330-M441 HydrophobicContact CB-CG 4.07Å; Q330-M441 HydrophobicContact CG-CG 4.48Å; Q330-M441 HydrophobicContact CG-SD 4.43Å; Q330-M441 PolarHBondContact OE1-SD 2.73Å; L437-M441 HydrophobicContact CD2-CE 4.04Å; L437-M441 VanDerWaalsContact O-CB 3.25Å; L437-M441 WeakPolarHBondContact O-CB 3.3Å; L437-M441 WeakPolarHBondContact O-CG 3.45Å; L437-M441 PolarHBondContact O-N 3.05Å; I439-M441 VanDerWaalsContact C-N 3.34Å; I439-M441 PolarHBondContact O-N 3.36Å; M441-I443 PolarHBondContact O-N 3.05Å; M441-N444 WeakPolarHBondContact O-CB 3.37Å; M441-N444 PolarHBondContact O-N 2.76Å; M441-Y445 WeakPolarHBondContact O-CD2 3.39Å; M441-Y445 PolarHBondContact O-N 3.45Å |
| 442 | G | 90.3 | Very high | 92.6 | Very high | 23 Ų | 23 | 65.1 Ų | 65.1 | 24% | 0.237 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -60.2 | -41.7 | 172.1 | 0 | 0 | 0 | 0 | 0 | 114 | Y331 F438 I439 G440 R446 | Y331-G442 WeakPolarHBondContact OH-CA 3.43Å; F438-G442 PolarHBondContact O-N 3.35Å; F438-G442 VanDerWaalsContact O-N 3.14Å; I439-G442 WeakPolarHBondContact O-CA 3.25Å; I439-G442 PolarHBondContact O-N 3.26Å; I439-G442 VanDerWaalsContact O-N 3.1Å; G440-G442 VanDerWaalsContact C-N 3.35Å; G442-R446 PolarHBondContact O-N 3.47Å; G442-R446 VanDerWaalsContact O-N 3.13Å |
| 443 | I | 91.3 | Very high | 92.2 | Very high | 100 Ų | 100 | 67 Ų | 67 | 51% | 0.513 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -65.1 | -43.1 | 173.6 | -61.4 | 165.6 | 0 | 0 | 0 | 110.2 | I439 G440 M441 R446 L447 | I439-I443 HydrophobicContact CG2-CD1 4.12Å; I439-I443 WeakPolarHBondContact O-CG1 3.37Å; I439-I443 PolarHBondContact O-N 3.29Å; G440-I443 PolarHBondContact O-N 3.23Å; M441-I443 PolarHBondContact O-N 3.05Å; I443-R446 PolarHBondContact O-N 3.43Å; I443-L447 HydrophobicContact CG2-CD1 4.13Å; I443-L447 WeakPolarHBondContact O-CG 3.48Å; I443-L447 PolarHBondContact O-N 3.41Å |
| 444 | N | 91.8 | Very high | 91.7 | Very high | 12 Ų | 12 | 69 Ų | 69 | 6% | 0.064 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -61.1 | -45.3 | 178.5 | -170.2 | 47.9 | 0 | 0 | 0 | 112.3 | L265 G440 M441 R446 L447 L448 | L265-N444 HydrophobicContact CD1-CB 4.03Å; G440-N444 PolarHBondContact O-N 2.87Å; M441-N444 WeakPolarHBondContact O-CB 3.37Å; M441-N444 PolarHBondContact O-N 2.76Å; N444-R446 VanDerWaalsContact C-N 3.32Å; N444-R446 PolarHBondContact O-N 2.72Å; N444-L447 PolarHBondContact O-N 3Å; N444-L448 WeakPolarHBondContact O-CG 3.43Å; N444-L448 PolarHBondContact O-N 3.44Å |
| 445 | Y | 90.8 | Very high | 91.1 | Very high | 64 Ų | 64 | 73.4 Ų | 73.4 | 25% | 0.251 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -59.4 | -41.6 | 174.1 | -86.9 | -70.6 | 0 | 0 | 0 | 112.3 | P327 Q330 Y331 M441 L447 L448 A449 | P327-Y445 PolarHBondContact O-OH 3.48Å; Q330-Y445 HydrophobicContact CB-CE2 4.25Å; Y331-Y445 HydrophobicContact CD2-CE2 4.34Å; Y331-Y445 AromaticContact CE2-CD2 3.83Å; Y331-Y445 HydrophobicContact CE2-CD2 3.83Å; Y331-Y445 AromaticContact CE2-CE2 3.75Å; Y331-Y445 HydrophobicContact CE2-CE2 3.75Å; Y331-Y445 AromaticContact CZ-CD2 3.95Å; M441-Y445 WeakPolarHBondContact O-CD2 3.39Å; M441-Y445 PolarHBondContact O-N 3.45Å; Y445-L447 VanDerWaalsContact C-N 3.34Å; Y445-L447 PolarHBondContact O-N 3.19Å; Y445-L448 PolarHBondContact O-N 2.97Å; Y445-A449 WeakPolarHBondContact O-CB 3.13Å; Y445-A449 PolarHBondContact O-N 3.46Å |
| 446 | R | 90.9 | Very high | 90.5 | Very high | 174 Ų | 174 | 74.9 Ų | 74.9 | 66% | 0.657 | 37% | 0.365 | S | S | * | . | H | α-helix | trans | -64.9 | -38.9 | 178 | -171 | 179.8 | -178.2 | -169 | 1.6 | 111.9 | G442 I443 N444 K450 | G442-R446 PolarHBondContact O-N 3.47Å; G442-R446 VanDerWaalsContact O-N 3.13Å; I443-R446 PolarHBondContact O-N 3.43Å; N444-R446 VanDerWaalsContact C-N 3.32Å; N444-R446 PolarHBondContact O-N 2.72Å; R446-K450 WeakPolarHBondContact O-CG 3.36Å; R446-K450 PolarHBondContact O-N 2.93Å; R446-K450 VanDerWaalsContact O-N 3.1Å |
| 447 | L | 89.5 | Confident | 89.8 | Confident | 63 Ų | 63 | 76.8 Ų | 76.8 | 33% | 0.33 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -67.8 | -45 | 176.5 | -72.1 | 171.2 | 0 | 0 | 0 | 111.5 | I443 N444 Y445 A449 K450 E451 | I443-L447 HydrophobicContact CG2-CD1 4.13Å; I443-L447 WeakPolarHBondContact O-CG 3.48Å; I443-L447 PolarHBondContact O-N 3.41Å; N444-L447 PolarHBondContact O-N 3Å; Y445-L447 VanDerWaalsContact C-N 3.34Å; Y445-L447 PolarHBondContact O-N 3.19Å; L447-A449 VanDerWaalsContact C-N 3.3Å; L447-A449 PolarHBondContact O-N 3.34Å; L447-K450 WeakPolarHBondContact O-CB 3.26Å; L447-K450 PolarHBondContact O-N 2.9Å; L447-K450 VanDerWaalsContact O-N 3.09Å; L447-E451 WeakPolarHBondContact O-CG 3.48Å; L447-E451 PolarHBondContact O-N 3.28Å |
| 448 | L | 88.4 | Confident | 89.2 | Confident | 72 Ų | 72 | 83 Ų | 83 | 38% | 0.377 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -58.3 | -42.9 | 175.2 | -74 | 166.7 | 0 | 0 | 0 | 111.7 | N444 Y445 K450 E451 Q452 | N444-L448 WeakPolarHBondContact O-CG 3.43Å; N444-L448 PolarHBondContact O-N 3.44Å; Y445-L448 PolarHBondContact O-N 2.97Å; L448-K450 VanDerWaalsContact C-N 3.33Å; L448-K450 PolarHBondContact O-N 3.11Å; L448-E451 PolarHBondContact O-N 3.32Å; L448-Q452 WeakPolarHBondContact O-CB 3.4Å; L448-Q452 VanDerWaalsContact O-CG 3.3Å; L448-Q452 WeakPolarHBondContact O-CG 3.14Å; L448-Q452 PolarHBondContact O-N 3.38Å |
| 449 | A | 88.5 | Confident | 88.5 | Confident | 42 Ų | 42 | 84.7 Ų | 84.7 | 35% | 0.347 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -64.2 | -36.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y445 L447 K453 | Y445-A449 WeakPolarHBondContact O-CB 3.13Å; Y445-A449 PolarHBondContact O-N 3.46Å; L447-A449 VanDerWaalsContact C-N 3.3Å; L447-A449 PolarHBondContact O-N 3.34Å; A449-K453 WeakPolarHBondContact O-CG 3.43Å; A449-K453 PolarHBondContact O-N 3.02Å; A449-K453 VanDerWaalsContact O-N 3.15Å |
| 450 | K | 89.8 | Confident | 87.6 | Confident | 122 Ų | 122 | 85.7 Ų | 85.7 | 53% | 0.53 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -68 | -42.4 | 174.3 | -76.6 | -177.6 | 175.5 | -169.6 | 0 | 112 | R446 L447 L448 K453 A454 | R446-K450 WeakPolarHBondContact O-CG 3.36Å; R446-K450 PolarHBondContact O-N 2.93Å; R446-K450 VanDerWaalsContact O-N 3.1Å; L447-K450 WeakPolarHBondContact O-CB 3.26Å; L447-K450 PolarHBondContact O-N 2.9Å; L447-K450 VanDerWaalsContact O-N 3.09Å; L448-K450 VanDerWaalsContact C-N 3.33Å; L448-K450 PolarHBondContact O-N 3.11Å; K450-K453 PolarHBondContact O-N 2.79Å; K450-A454 WeakPolarHBondContact O-CB 3.3Å; K450-A454 PolarHBondContact O-N 2.84Å |
| 451 | E | 88.3 | Confident | 86.7 | Confident | 82 Ų | 82 | 87.8 Ų | 87.8 | 38% | 0.383 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -66.3 | -38.1 | 178.5 | -72.3 | 173.9 | 180 | 0 | 0 | 111.7 | R261 L447 L448 A454 N455 | R261-E451 IonicContact CZ-OE1 2.74Å; R261-E451 IonicContact NH1-OE1 2.67Å; R261-E451 PolarHBondContact NH1-OE1 3.15Å; R261-E451 IonicContact NH2-OE1 2.78Å; L447-E451 WeakPolarHBondContact O-CG 3.48Å; L447-E451 PolarHBondContact O-N 3.28Å; L448-E451 PolarHBondContact O-N 3.32Å; E451-A454 PolarHBondContact O-N 3.24Å; E451-N455 WeakPolarHBondContact O-CB 3.21Å; E451-N455 VanDerWaalsContact O-CG 3.27Å; E451-N455 PolarHBondContact O-N 3.01Å; E451-N455 PolarHBondContact O-ND2 2.83Å |
| 452 | Q | 85.8 | Confident | 85.9 | Confident | 119 Ų | 119 | 94.4 Ų | 94.4 | 56% | 0.556 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -61.8 | -51 | 173.3 | -75.6 | 173.1 | -14.5 | 0 | 0 | 111.5 | L448 A454 N455 E456 | L448-Q452 WeakPolarHBondContact O-CB 3.4Å; L448-Q452 VanDerWaalsContact O-CG 3.3Å; L448-Q452 WeakPolarHBondContact O-CG 3.14Å; L448-Q452 PolarHBondContact O-N 3.38Å; Q452-A454 VanDerWaalsContact C-N 3.33Å; Q452-A454 PolarHBondContact O-N 3.5Å; Q452-N455 PolarHBondContact O-N 2.99Å; Q452-N455 VanDerWaalsContact O-N 3.11Å; Q452-E456 WeakPolarHBondContact O-CG 3Å; Q452-E456 PolarHBondContact O-N 3.14Å |
| 453 | K | 88.5 | Confident | 85.1 | Confident | 137 Ų | 137 | 99.8 Ų | 99.8 | 60% | 0.596 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -59.1 | -41.6 | 176.7 | -72.4 | -179.4 | 178.7 | -165.4 | 0 | 112.9 | A449 K450 N455 E456 Q457 | A449-K453 WeakPolarHBondContact O-CG 3.43Å; A449-K453 PolarHBondContact O-N 3.02Å; A449-K453 VanDerWaalsContact O-N 3.15Å; K450-K453 PolarHBondContact O-N 2.79Å; K453-N455 VanDerWaalsContact C-N 3.31Å; K453-N455 PolarHBondContact O-N 3.32Å; K453-E456 PolarHBondContact O-N 3.48Å; K453-Q457 WeakPolarHBondContact O-CG 3.17Å; K453-Q457 PolarHBondContact O-N 3.27Å |
| 454 | A | 87.3 | Confident | 83.9 | Confident | 41 Ų | 41 | 101.2 Ų | 101.2 | 34% | 0.339 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -66.6 | -33.1 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | K450 E451 Q452 K458 | K450-A454 WeakPolarHBondContact O-CB 3.3Å; K450-A454 PolarHBondContact O-N 2.84Å; E451-A454 PolarHBondContact O-N 3.24Å; Q452-A454 VanDerWaalsContact C-N 3.33Å; Q452-A454 PolarHBondContact O-N 3.5Å; A454-K458 WeakPolarHBondContact O-CB 3.43Å; A454-K458 WeakPolarHBondContact O-CG 3.31Å; A454-K458 PolarHBondContact O-N 3.13Å |
| 455 | N | 85.6 | Confident | 82.7 | Confident | 94 Ų | 94 | 106.7 Ų | 106.7 | 50% | 0.503 | 51% | 0.505 | S | S | . | . | H | α-helix | trans | -75.6 | -34.4 | 175.7 | -75.4 | -21.5 | 0 | 0 | 0 | 112.5 | E451 Q452 K453 K458 K459 | E451-N455 WeakPolarHBondContact O-CB 3.21Å; E451-N455 VanDerWaalsContact O-CG 3.27Å; E451-N455 PolarHBondContact O-N 3.01Å; E451-N455 PolarHBondContact O-ND2 2.83Å; Q452-N455 PolarHBondContact O-N 2.99Å; Q452-N455 VanDerWaalsContact O-N 3.11Å; K453-N455 VanDerWaalsContact C-N 3.31Å; K453-N455 PolarHBondContact O-N 3.32Å; N455-K458 PolarHBondContact O-N 2.9Å; N455-K459 WeakPolarHBondContact O-CG 3.22Å; N455-K459 PolarHBondContact O-N 3.38Å |
| 456 | E | 83.8 | Confident | 81.4 | Confident | 115 Ų | 115 | 107.7 Ų | 107.7 | 54% | 0.537 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -62.8 | -49.9 | 171.2 | -73.3 | 169.3 | 174.6 | 0 | 0 | 110.2 | Q452 K453 K458 K459 E460 | Q452-E456 WeakPolarHBondContact O-CG 3Å; Q452-E456 PolarHBondContact O-N 3.14Å; K453-E456 PolarHBondContact O-N 3.48Å; E456-K458 VanDerWaalsContact C-N 3.3Å; E456-K458 PolarHBondContact O-N 3.17Å; E456-K459 WeakPolarHBondContact O-CA 3.25Å; E456-K459 WeakPolarHBondContact O-CB 3.23Å; E456-K459 PolarHBondContact O-N 3.47Å; E456-E460 PolarHBondContact O-N 3.43Å |
| 457 | Q | 83.7 | Confident | 79.9 | Confident | 129 Ų | 129 | 102.6 Ų | 102.6 | 60% | 0.603 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -57.9 | -40 | 175 | -73.8 | 177.6 | -20.5 | 0 | 0 | 112.8 | K453 K459 S461 | K453-Q457 WeakPolarHBondContact O-CG 3.17Å; K453-Q457 PolarHBondContact O-N 3.27Å; Q457-K459 VanDerWaalsContact C-N 3.3Å; Q457-K459 PolarHBondContact O-N 3.27Å; Q457-S461 WeakPolarHBondContact O-CB 3.48Å; Q457-S461 PolarHBondContact O-N 2.95Å; Q457-S461 PolarHBondContact O-OG 2.74Å |
| 458 | K | 83.3 | Confident | 78.4 | Confident | 136 Ų | 136 | 104.9 Ų | 104.9 | 59% | 0.591 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -68 | -25.6 | 175 | -81.6 | -179.3 | 179.7 | -179.3 | 0 | 114 | A454 N455 E456 S461 K462 | A454-K458 WeakPolarHBondContact O-CB 3.43Å; A454-K458 WeakPolarHBondContact O-CG 3.31Å; A454-K458 PolarHBondContact O-N 3.13Å; N455-K458 PolarHBondContact O-N 2.9Å; E456-K458 VanDerWaalsContact C-N 3.3Å; E456-K458 PolarHBondContact O-N 3.17Å; K458-S461 WeakPolarHBondContact CA-OG 3.47Å; K458-S461 PolarHBondContact O-OG 3.39Å; K458-S461 VanDerWaalsContact O-OG 3.13Å; K458-K462 WeakPolarHBondContact O-CG 3.5Å; K458-K462 PolarHBondContact O-N 3.26Å |
| 459 | K | 80.1 | Confident | 76.9 | Confident | 144 Ų | 144 | 107.1 Ų | 107.1 | 63% | 0.626 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -79.6 | -46.4 | 175.4 | -79.8 | -179.5 | 175.6 | -174.2 | 0 | 110.3 | N455 E456 Q457 S461 K462 E463 | N455-K459 WeakPolarHBondContact O-CG 3.22Å; N455-K459 PolarHBondContact O-N 3.38Å; E456-K459 WeakPolarHBondContact O-CA 3.25Å; E456-K459 WeakPolarHBondContact O-CB 3.23Å; E456-K459 PolarHBondContact O-N 3.47Å; Q457-K459 VanDerWaalsContact C-N 3.3Å; Q457-K459 PolarHBondContact O-N 3.27Å; K459-S461 VanDerWaalsContact C-N 3.32Å; K459-S461 PolarHBondContact O-N 2.96Å; K459-K462 PolarHBondContact O-N 2.78Å; K459-K462 VanDerWaalsContact O-N 3.1Å; K459-E463 PolarHBondContact O-N 2.99Å |
| 460 | E | 77.8 | Confident | 75.3 | Confident | 118 Ų | 118 | 110.7 Ų | 110.7 | 55% | 0.551 | 55% | 0.55 | S | S | * | . | H | α-helix | trans | -56.7 | -46.3 | 174.7 | -71 | 173.8 | 171.2 | 0 | 0 | 110.8 | E456 K462 E463 E464 | E456-E460 PolarHBondContact O-N 3.43Å; E460-K462 VanDerWaalsContact C-N 3.29Å; E460-K462 PolarHBondContact O-N 2.69Å; E460-E463 PolarHBondContact O-N 3.5Å; E460-E464 PolarHBondContact O-N 3.32Å |
| 461 | S | 74.8 | Confident | 73.6 | Confident | 52 Ų | 52 | 109 Ų | 109 | 36% | 0.364 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -63.2 | -33.3 | 177.1 | 64.9 | 0 | 0 | 0 | 0 | 113.4 | Q457 K458 K459 E465 | Q457-S461 WeakPolarHBondContact O-CB 3.48Å; Q457-S461 PolarHBondContact O-N 2.95Å; Q457-S461 PolarHBondContact O-OG 2.74Å; K458-S461 WeakPolarHBondContact CA-OG 3.47Å; K458-S461 PolarHBondContact O-OG 3.39Å; K458-S461 VanDerWaalsContact O-OG 3.13Å; K459-S461 VanDerWaalsContact C-N 3.32Å; K459-S461 PolarHBondContact O-N 2.96Å; S461-E465 WeakPolarHBondContact O-CG 3.44Å; S461-E465 PolarHBondContact O-N 3.38Å |
| 462 | K | 74.6 | Confident | 71.5 | Confident | 144 Ų | 144 | 107.9 Ų | 107.9 | 63% | 0.626 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -74.9 | -35 | 176 | -81.7 | -176.4 | 175.4 | -168.1 | 0 | 112.6 | K458 K459 E460 T466 | K458-K462 WeakPolarHBondContact O-CG 3.5Å; K458-K462 PolarHBondContact O-N 3.26Å; K459-K462 PolarHBondContact O-N 2.78Å; K459-K462 VanDerWaalsContact O-N 3.1Å; E460-K462 VanDerWaalsContact C-N 3.29Å; E460-K462 PolarHBondContact O-N 2.69Å; K462-T466 PolarHBondContact O-N 3.22Å; K462-T466 PolarHBondContact O-OG1 2.86Å |
| 463 | E | 72 | Confident | 69.3 | Low | 135 Ų | 135 | 110.4 Ų | 110.4 | 63% | 0.631 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -69.5 | -38.3 | 174.3 | -75.2 | 177.5 | -172.8 | 0 | 0 | 110.9 | K459 E460 T466 S467 | K459-E463 PolarHBondContact O-N 2.99Å; E460-E463 PolarHBondContact O-N 3.5Å; E463-T466 WeakPolarHBondContact CA-OG1 3.44Å; E463-T466 PolarHBondContact O-OG1 3.38Å; E463-S467 VanDerWaalsContact O-CB 3.31Å; E463-S467 WeakPolarHBondContact O-CB 3.44Å; E463-S467 PolarHBondContact O-N 2.87Å; E463-S467 PolarHBondContact O-OG 3.17Å |
| 464 | E | 67.1 | Low | 66.9 | Low | 131 Ų | 131 | 109.5 Ų | 109.5 | 61% | 0.612 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -64.1 | -49 | 171.8 | -76.8 | -176.6 | 167.6 | 0 | 0 | 111.9 | E460 T466 S467 I468 | E460-E464 PolarHBondContact O-N 3.32Å; E464-T466 PolarHBondContact O-N 3.08Å; E464-S467 WeakPolarHBondContact CA-OG 3.21Å; E464-S467 PolarHBondContact O-N 3.35Å; E464-S467 VanDerWaalsContact O-N 3.16Å; E464-S467 PolarHBondContact O-OG 3.09Å; E464-I468 VanDerWaalsContact O-CG1 3.27Å; E464-I468 WeakPolarHBondContact O-CG1 3.26Å; E464-I468 PolarHBondContact O-N 2.81Å |
| 465 | E | 65.5 | Low | 64.6 | Low | 127 Ų | 127 | 117 Ų | 117 | 59% | 0.593 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -58.4 | -44.3 | 176 | -80.8 | 178.5 | 169.2 | 0 | 0 | 112.4 | S461 S467 I468 D469 | S461-E465 WeakPolarHBondContact O-CG 3.44Å; S461-E465 PolarHBondContact O-N 3.38Å; E465-S467 VanDerWaalsContact C-N 3.34Å; E465-S467 PolarHBondContact O-N 2.81Å; E465-I468 PolarHBondContact O-N 3.07Å; E465-D469 PolarHBondContact O-N 2.96Å |
| 466 | T | 64.7 | Low | 62.2 | Low | 84 Ų | 84 | 121.3 Ų | 121.3 | 52% | 0.515 | 63% | 0.628 | S | S | . | * | H | α-helix | trans | -68.2 | -32.1 | 177 | 38.3 | 0 | 0 | 0 | 0 | 113 | K462 E463 E464 V470 | K462-T466 PolarHBondContact O-N 3.22Å; K462-T466 PolarHBondContact O-OG1 2.86Å; E463-T466 WeakPolarHBondContact CA-OG1 3.44Å; E463-T466 PolarHBondContact O-OG1 3.38Å; E464-T466 PolarHBondContact O-N 3.08Å; T466-V470 VanDerWaalsContact O-CG2 3.23Å; T466-V470 WeakPolarHBondContact O-CG2 3.27Å; T466-V470 PolarHBondContact O-N 3.01Å |
| 467 | S | 58.7 | Low | 60 | Low | 67 Ų | 67 | 121.6 Ų | 121.6 | 47% | 0.469 | 64% | 0.637 | S | S | . | * | H | α-helix | trans | -70.5 | -35 | 174.8 | 71.1 | 0 | 0 | 0 | 0 | 112.9 | E463 E464 E465 V470 A471 | E463-S467 VanDerWaalsContact O-CB 3.31Å; E463-S467 WeakPolarHBondContact O-CB 3.44Å; E463-S467 PolarHBondContact O-N 2.87Å; E463-S467 PolarHBondContact O-OG 3.17Å; E464-S467 WeakPolarHBondContact CA-OG 3.21Å; E464-S467 PolarHBondContact O-N 3.35Å; E464-S467 VanDerWaalsContact O-N 3.16Å; E464-S467 PolarHBondContact O-OG 3.09Å; E465-S467 VanDerWaalsContact C-N 3.34Å; E465-S467 PolarHBondContact O-N 2.81Å; S467-V470 PolarHBondContact O-N 3.32Å; S467-A471 PolarHBondContact O-N 3.31Å; S467-A471 VanDerWaalsContact O-N 3.1Å |
| 468 | I | 58.9 | Low | 57.6 | Low | 112 Ų | 112 | 122 Ų | 122 | 57% | 0.574 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -70.2 | -41.3 | 175.4 | -64.7 | 163.3 | 0 | 0 | 0 | 110.7 | E464 E465 V470 A471 G472 | E464-I468 VanDerWaalsContact O-CG1 3.27Å; E464-I468 WeakPolarHBondContact O-CG1 3.26Å; E464-I468 PolarHBondContact O-N 2.81Å; E465-I468 PolarHBondContact O-N 3.07Å; I468-V470 VanDerWaalsContact C-N 3.29Å; I468-V470 PolarHBondContact O-N 3.25Å; I468-A471 PolarHBondContact O-N 2.84Å; I468-G472 PolarHBondContact O-N 3.45Å |
| 469 | D | 55.8 | Low | 55.1 | Low | 119 Ų | 119 | 124.7 Ų | 124.7 | 64% | 0.636 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -65.2 | -30.1 | 176 | -81.7 | -18.5 | 0 | 0 | 0 | 113.1 | E465 | E465-D469 PolarHBondContact O-N 2.96Å |
| 470 | V | 56.1 | Low | 52.8 | Low | 116 Ų | 116 | 122.5 Ų | 122.5 | 70% | 0.703 | 67% | 0.67 | S | S | * | * | H | α-helix | trans | -75.4 | -35.4 | 173.7 | 173.8 | 0 | 0 | 0 | 0 | 111.5 | T466 S467 I468 G472 | T466-V470 VanDerWaalsContact O-CG2 3.23Å; T466-V470 WeakPolarHBondContact O-CG2 3.27Å; T466-V470 PolarHBondContact O-N 3.01Å; S467-V470 PolarHBondContact O-N 3.32Å; I468-V470 VanDerWaalsContact C-N 3.29Å; I468-V470 PolarHBondContact O-N 3.25Å; V470-G472 VanDerWaalsContact C-N 3.32Å |
| 471 | A | 52.4 | Low | 50.6 | Low | 86 Ų | 86 | 121.8 Ų | 121.8 | 71% | 0.711 | 68% | 0.683 | S | S | * | * | H | α-helix | trans | -73.3 | -23.2 | 174 | 0 | 0 | 0 | 0 | 0 | 113.3 | S467 I468 | S467-A471 PolarHBondContact O-N 3.31Å; S467-A471 VanDerWaalsContact O-N 3.1Å; I468-A471 PolarHBondContact O-N 2.84Å |
| 472 | G | 44.3 | Very low | 48.6 | Very low | 59 Ų | 59 | 128.2 Ų | 128.2 | 61% | 0.608 | 71% | 0.708 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.2 | -4.9 | -178.9 | 0 | 0 | 0 | 0 | 0 | 116.1 | I468 V470 P474 | I468-G472 PolarHBondContact O-N 3.45Å; V470-G472 VanDerWaalsContact C-N 3.32Å; G472-P474 WeakPolarHBondContact O-CD 3.31Å |
| 473 | K | 41.1 | Very low | 46.3 | Very low | 173 Ų | 173 | 127 Ų | 127 | 75% | 0.752 | 72% | 0.718 | S | S | * | * | S | Bend | trans | -76.2 | 121.7 | 173.3 | -83.3 | -173.8 | 177.1 | -179.8 | 0 | 110.4 | K475 | K473-K475 PolarHBondContact O-N 3.33Š|
| 474 | P | 36.8 | Very low | 44.9 | Very low | 117 Ų | 117 | 126 Ų | 126 | 76% | 0.76 | 72% | 0.722 | S | S | * | * | trans | -59.8 | 132.9 | 175 | -17 | 29.1 | 0 | 0 | 0 | 109.6 | G472 E476 | G472-P474 WeakPolarHBondContact O-CD 3.31Å; P474-E476 PolarHBondContact O-N 3.39Å | ||
| 475 | K | 39.6 | Very low | 43 | Very low | 199 Ų | 199 | 126.4 Ų | 126.4 | 87% | 0.865 | 73% | 0.729 | S | S | * | * | trans | -58.4 | 103 | 161.6 | -74.9 | -179 | 176.2 | 179 | 0 | 107.2 | K473 V477 | K473-K475 PolarHBondContact O-N 3.33Å; K475-V477 PolarHBondContact O-N 3.37Å | ||
| 476 | E | 34.3 | Very low | 41.3 | Very low | 185 Ų | 185 | 128.3 Ų | 128.3 | 86% | 0.864 | 74% | 0.738 | S | S | * | * | trans | -58.2 | 108.7 | 165.5 | -94.6 | -177.1 | 154.2 | 0 | 0 | 107.7 | P474 T478 | P474-E476 PolarHBondContact O-N 3.39Å; E476-T478 PolarHBondContact O-N 3.31Å | ||
| 477 | V | 37.6 | Very low | 39.6 | Very low | 120 Ų | 120 | 133 Ų | 133 | 73% | 0.727 | 75% | 0.751 | S | S | * | * | trans | -66.8 | 101.3 | 171.5 | 176.9 | 0 | 0 | 0 | 0 | 106.9 | K475 K479 | K475-V477 PolarHBondContact O-N 3.37Å; V477-K479 VanDerWaalsContact C-N 3.28Å; V477-K479 HydrophobicContact CG1-CG 4.13Å; V477-K479 PolarHBondContact O-N 3.09Å | ||
| 478 | T | 33.5 | Very low | 38.3 | Very low | 139 Ų | 139 | 136 Ų | 136 | 85% | 0.853 | 76% | 0.762 | S | S | * | * | trans | -71.9 | 89.5 | 165.8 | -22.9 | 0 | 0 | 0 | 0 | 107.6 | E476 A480 | E476-T478 PolarHBondContact O-N 3.31Å; T478-A480 PolarHBondContact O-N 2.84Å | ||
| 479 | K | 30.9 | Very low | 37 | Very low | 192 Ų | 192 | 136.4 Ų | 136.4 | 84% | 0.835 | 77% | 0.77 | S | S | * | * | trans | -71.7 | 101.3 | 163.8 | -94.9 | -177 | 174.9 | -178.5 | 0 | 107.7 | V477 A481 | V477-K479 VanDerWaalsContact C-N 3.28Å; V477-K479 HydrophobicContact CG1-CG 4.13Å; V477-K479 PolarHBondContact O-N 3.09Å; K479-A481 PolarHBondContact O-N 3.26Å | ||
| 480 | A | 31.5 | Very low | 35.8 | Very low | 98 Ų | 98 | 138.9 Ų | 138.9 | 81% | 0.81 | 78% | 0.777 | S | S | * | * | P | Polyproline II helix | trans | -70.9 | 119.7 | 161.3 | 0 | 0 | 0 | 0 | 0 | 108.3 | T478 | T478-A480 PolarHBondContact O-N 2.84Š|
| 481 | A | 32.7 | Very low | 34.6 | Very low | 102 Ų | 102 | 142.1 Ų | 142.1 | 84% | 0.843 | 79% | 0.785 | S | S | * | * | P | Polyproline II helix | trans | -88.2 | 139.1 | 166.3 | 0 | 0 | 0 | 0 | 0 | 108.9 | K479 | K479-A481 PolarHBondContact O-N 3.26Š|
| 482 | E | 32 | Very low | 33.4 | Very low | 188 Ų | 188 | 141.5 Ų | 141.5 | 88% | 0.879 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -66.7 | 155 | -167.6 | -62.3 | 165.3 | 143.4 | 0 | 0 | 114.9 | ||
| 483 | S | 28 | Very low | 33.3 | Very low | 119 Ų | 119 | 144.9 Ų | 144.9 | 83% | 0.832 | 80% | 0.798 | S | S | * | * | -151.9 | 145.5 | 125.1 | -11.4 | 0 | 0 | 0 | 0 | 110.5 | |||||
| 484 | P | 40.8 | Very low | 33.1 | Very low | 112 Ų | 112 | 145.9 Ų | 145.9 | 73% | 0.727 | 80% | 0.802 | S | S | * | * | trans | -97.5 | 150.2 | -170.6 | 37.5 | -30.4 | 0 | 0 | 0 | 111.8 | ||||
| 485 | D | 28.9 | Very low | 32.9 | Very low | 141 Ų | 141 | 148.8 Ų | 148.8 | 75% | 0.754 | 81% | 0.806 | S | S | * | * | trans | -169.3 | 132.7 | 132.6 | -103.8 | -32.3 | 0 | 0 | 0 | 114 | ||||
| 486 | Q | 28.8 | Very low | 32.6 | Very low | 167 Ų | 167 | 147.2 Ų | 147.2 | 78% | 0.78 | 80% | 0.802 | S | S | * | * | trans | 66.7 | 99.7 | 144.5 | -67.6 | 174.1 | 2.8 | 0 | 0 | 121.7 | ||||
| 487 | K | 30 | Very low | 32.6 | Very low | 183 Ų | 183 | 145.4 Ų | 145.4 | 80% | 0.796 | 80% | 0.798 | S | S | * | * | 29.2 | 117.2 | 112.6 | -95.3 | -171.2 | 175.7 | -173.8 | 0 | 117.5 | |||||
| 488 | D | 30.2 | Very low | 32.4 | Very low | 128 Ų | 128 | 144.6 Ų | 144.6 | 68% | 0.684 | 80% | 0.798 | S | S | * | * | 162.6 | 141.2 | 93.2 | -91.1 | -27 | 0 | 0 | 0 | 110.6 | |||||
| 489 | T | 30.9 | Very low | 33.3 | Very low | 121 Ų | 121 | 143.5 Ų | 143.5 | 74% | 0.742 | 79% | 0.793 | S | S | * | * | trans | 32.6 | 131.5 | 150.2 | 40.9 | 0 | 0 | 0 | 0 | 120 | ||||
| 490 | E | 31.3 | Very low | 33.9 | Very low | 171 Ų | 171 | 144.8 Ų | 144.8 | 80% | 0.799 | 82% | 0.816 | S | S | * | * | -175.2 | 143.7 | 73.2 | -127.4 | 159.9 | -156 | 0 | 0 | 112.3 | |||||
| 491 | E | 30.8 | Very low | 34 | Very low | 185 Ų | 185 | 147.2 Ų | 147.2 | 86% | 0.864 | 82% | 0.817 | S | S | * | * | trans | 26 | 137 | 149.6 | -61.3 | 179.7 | 155.1 | 0 | 0 | 123.3 | ||||
| 492 | G | 27.3 | Very low | 34 | Very low | 72 Ų | 72 | 149.5 Ų | 149.5 | 74% | 0.742 | 82% | 0.815 | S | S | * | * | trans | -73.7 | -154 | 164.6 | 0 | 0 | 0 | 0 | 0 | 113 | ||||
| 493 | P | 42.8 | Very low | 34.2 | Very low | 131 Ų | 131 | 147.4 Ų | 147.4 | 85% | 0.851 | 81% | 0.812 | S | S | * | * | cis | -137.4 | -171.7 | 12.7 | 39.1 | -17.8 | 0 | 0 | 0 | 115.5 | ||||
| 494 | K | 36 | Very low | 34.5 | Very low | 193 Ų | 193 | 149.1 Ų | 149.1 | 84% | 0.839 | 81% | 0.811 | S | S | * | * | trans | -55.1 | 155.1 | 172.2 | -59.6 | 168.1 | 173.2 | 177.6 | 0 | 114.9 | ||||
| 495 | E | 33 | Very low | 34.1 | Very low | 179 Ų | 179 | 151.4 Ų | 151.4 | 84% | 0.836 | 82% | 0.816 | S | S | * | * | 172.9 | 123 | 125.1 | -95.9 | 172.2 | -175.3 | 0 | 0 | 107.5 | |||||
| 496 | E | 34.4 | Very low | 34.5 | Very low | 166 Ų | 166 | 152.1 Ų | 152.1 | 78% | 0.776 | 82% | 0.82 | S | S | * | * | 87.7 | 127.3 | 71.3 | -142.9 | 173.5 | -131.5 | 0 | 0 | 113.5 | |||||
| 497 | D | 33.6 | Very low | 34.9 | Very low | 146 Ų | 146 | 151 Ų | 151 | 78% | 0.781 | 82% | 0.823 | S | S | * | * | trans | 72.3 | 147.9 | 155.6 | -82 | -16.6 | 0 | 0 | 0 | 125.8 | ||||
| 498 | S | 33.8 | Very low | 35.3 | Very low | 104 Ų | 104 | 148.5 Ų | 148.5 | 73% | 0.727 | 83% | 0.825 | S | S | * | * | trans | -82.3 | -152.5 | -170.2 | -47.3 | 0 | 0 | 0 | 0 | 111 | ||||
| 499 | P | 52.7 | Low | 35.7 | Very low | 116 Ų | 116 | 150.3 Ų | 150.3 | 75% | 0.753 | 84% | 0.837 | S | S | * | * | cis | -131.8 | 173.1 | -27 | 30.4 | -10.6 | 0 | 0 | 0 | 112.9 | ||||
| 500 | V | 41.7 | Very low | 36.1 | Very low | 219 Ų | 219 | 152.9 Ų | 152.9 | 100% | 1.327 | 85% | 0.845 | S | S | * | * | -152.3 | 0 | 122.6 | 176.9 | 0 | 0 | 0 | 0 | 108.2 |
Retrieved 500 of 500 residues in 268.7 ms
(Link to these results)