| 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 | T | 53.3 | Low | 61.1 | Low | 145 Ų | 145 | 138.8 Ų | 138.8 | 89% | 0.89 | 71% | 0.709 | S | S | * | * | 0 | 150.3 | 0 | 29 | 0 | 0 | 0 | 0 | 107.8 | T3 S4 | T1-T3 PolarHBondContact O-N 3.22Å; T1-S4 WeakPolarHBondContact O-CB 3.49Å; T1-S4 PolarHBondContact O-N 3.27Å; T1-S4 PolarHBondContact O-OG 3.01Å | |||
| 2 | L | 57.5 | Low | 60.9 | Low | 156 Ų | 156 | 136.6 Ų | 136.6 | 82% | 0.817 | 70% | 0.698 | S | S | * | * | G | 310 helix | trans | -44.2 | -22.9 | -165.3 | -82.2 | 146.6 | 0 | 0 | 0 | 117.5 | S4 | L2-S4 VanDerWaalsContact C-N 3.28Å; L2-S4 PolarHBondContact O-N 2.91Å |
| 3 | T | 65.3 | Low | 60.4 | Low | 130 Ų | 130 | 131.4 Ų | 131.4 | 80% | 0.798 | 68% | 0.681 | S | S | * | * | G | 310 helix | trans | -67.6 | -17.4 | 170.5 | 36.1 | 0 | 0 | 0 | 0 | 115.2 | T1 | T1-T3 PolarHBondContact O-N 3.22Š|
| 4 | S | 68.3 | Low | 60.1 | Low | 100 Ų | 100 | 125.9 Ų | 125.9 | 70% | 0.699 | 67% | 0.673 | S | S | * | * | G | 310 helix | trans | -80.4 | -14.8 | -177.1 | 63 | 0 | 0 | 0 | 0 | 114.2 | T1 L2 | T1-S4 WeakPolarHBondContact O-CB 3.49Å; T1-S4 PolarHBondContact O-N 3.27Å; T1-S4 PolarHBondContact O-OG 3.01Å; L2-S4 VanDerWaalsContact C-N 3.28Å; L2-S4 PolarHBondContact O-N 2.91Å |
| 5 | D | 66.2 | Low | 60.1 | Low | 70 Ų | 70 | 125.3 Ų | 125.3 | 37% | 0.374 | 67% | 0.67 | S | S | . | * | trans | -142.9 | 86 | 176.6 | -170.9 | -4.7 | 0 | 0 | 0 | 111.5 | R7 L8 | D5-R7 PolarHBondContact O-N 3.23Å; D5-R7 WeakPolarHBondContact OD1-CB 3.47Å; D5-R7 PolarHBondContact OD1-N 2.96Å; D5-L8 HydrophobicContact CB-CD1 4.06Å; D5-L8 PolarHBondContact O-N 3.37Å; D5-L8 WeakPolarHBondContact OD2-CD1 3.38Å | ||
| 6 | P | 65.2 | Low | 60.1 | Low | 95 Ų | 95 | 119.9 Ų | 119.9 | 62% | 0.617 | 65% | 0.648 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -66.8 | -16.1 | -177 | 23.7 | -31.1 | 0 | 0 | 0 | 113.8 | L8 Y9 M10 | P6-L8 VanDerWaalsContact C-N 3.27Å; P6-L8 PolarHBondContact O-N 3.27Å; P6-Y9 PolarHBondContact O-N 3.15Å; P6-M10 PolarHBondContact O-N 2.92Å |
| 7 | R | 61.6 | Low | 60.2 | Low | 204 Ų | 204 | 122.7 Ų | 122.7 | 77% | 0.77 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -68.1 | -27.4 | 179.5 | -64.8 | -178 | 174.4 | -173 | -0.6 | 112.4 | D5 K11 | D5-R7 PolarHBondContact O-N 3.23Å; D5-R7 WeakPolarHBondContact OD1-CB 3.47Å; D5-R7 PolarHBondContact OD1-N 2.96Å; R7-K11 PolarHBondContact O-N 2.85Å |
| 8 | L | 61.7 | Low | 60.4 | Low | 109 Ų | 109 | 123.8 Ų | 123.8 | 57% | 0.571 | 66% | 0.663 | S | S | * | * | H | α-helix | trans | -67.2 | -34.4 | 174.4 | -88.8 | 148.8 | 0 | 0 | 0 | 112.7 | D5 P6 | D5-L8 HydrophobicContact CB-CD1 4.06Å; D5-L8 PolarHBondContact O-N 3.37Å; D5-L8 WeakPolarHBondContact OD2-CD1 3.38Å; P6-L8 VanDerWaalsContact C-N 3.27Å; P6-L8 PolarHBondContact O-N 3.27Å |
| 9 | Y | 58.8 | Low | 61.3 | Low | 176 Ų | 176 | 123.1 Ų | 123.1 | 69% | 0.69 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -76.1 | -40.4 | 177 | -174.2 | -96.7 | 0 | 0 | 0 | 111.7 | P6 K11 I12 S13 | P6-Y9 PolarHBondContact O-N 3.15Å; Y9-K11 VanDerWaalsContact C-N 3.27Å; Y9-K11 PolarHBondContact O-N 3.34Å; Y9-I12 WeakPolarHBondContact O-CA 3.43Å; Y9-I12 PolarHBondContact O-N 3.37Å; Y9-S13 PolarHBondContact O-N 3.38Å |
| 10 | M | 59.7 | Low | 62.2 | Low | 149 Ų | 149 | 123 Ų | 123 | 73% | 0.734 | 65% | 0.654 | S | S | * | * | H | α-helix | trans | -63.6 | -33.8 | -175.8 | -144.8 | 149.5 | 102.3 | 0 | 0 | 112.4 | P6 I12 S13 | P6-M10 PolarHBondContact O-N 2.92Å; M10-I12 VanDerWaalsContact C-N 3.27Å; M10-I12 PolarHBondContact O-N 2.76Å; M10-S13 PolarHBondContact O-N 2.77Å; M10-S13 PolarHBondContact O-OG 3.37Å |
| 11 | K | 54.5 | Low | 63.2 | Low | 193 Ų | 193 | 119.4 Ų | 119.4 | 84% | 0.839 | 65% | 0.647 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -67.2 | -20.5 | 171.8 | -102.2 | -177.7 | 177.9 | 177.7 | 0 | 114.7 | R7 Y9 | R7-K11 PolarHBondContact O-N 2.85Å; Y9-K11 VanDerWaalsContact C-N 3.27Å; Y9-K11 PolarHBondContact O-N 3.34Å |
| 12 | I | 58.4 | Low | 64.5 | Low | 112 Ų | 112 | 114.6 Ų | 114.6 | 57% | 0.574 | 62% | 0.618 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -96.3 | -21.4 | 178.6 | -61.8 | 171.9 | 0 | 0 | 0 | 110.9 | Y9 M10 G14 | Y9-I12 WeakPolarHBondContact O-CA 3.43Å; Y9-I12 PolarHBondContact O-N 3.37Å; M10-I12 VanDerWaalsContact C-N 3.27Å; M10-I12 PolarHBondContact O-N 2.76Å; I12-G14 VanDerWaalsContact C-N 3.29Å; I12-G14 PolarHBondContact O-N 3.2Å; I12-G14 VanDerWaalsContact O-N 3.15Å |
| 13 | S | 54.3 | Low | 65.8 | Low | 69 Ų | 69 | 113.2 Ų | 113.2 | 48% | 0.483 | 61% | 0.606 | S | S | . | * | trans | -73.9 | 1.1 | -170.6 | 75.9 | 0 | 0 | 0 | 0 | 117.2 | Y9 M10 N15 | Y9-S13 PolarHBondContact O-N 3.38Å; M10-S13 PolarHBondContact O-N 2.77Å; M10-S13 PolarHBondContact O-OG 3.37Å; S13-N15 PolarHBondContact O-N 3.45Å | ||
| 14 | G | 56.8 | Low | 66.8 | Low | 55 Ų | 55 | 110.6 Ų | 110.6 | 57% | 0.567 | 59% | 0.586 | S | S | * | * | S | Bend | trans | -94.3 | 41.2 | -173.5 | 0 | 0 | 0 | 0 | 0 | 116.1 | I12 A16 | I12-G14 VanDerWaalsContact C-N 3.29Å; I12-G14 PolarHBondContact O-N 3.2Å; I12-G14 VanDerWaalsContact O-N 3.15Å; G14-A16 PolarHBondContact O-N 3.13Å |
| 15 | N | 60.2 | Low | 67.7 | Low | 117 Ų | 117 | 109.6 Ų | 109.6 | 63% | 0.626 | 57% | 0.568 | S | S | * | * | S | Bend | trans | 55.2 | 15.2 | -175.9 | -142.1 | 22.9 | 0 | 0 | 0 | 114.8 | S13 M17 L18 Q19 | S13-N15 PolarHBondContact O-N 3.45Å; N15-M17 PolarHBondContact O-N 3.45Å; N15-M17 VanDerWaalsContact O-N 3.13Å; N15-L18 PolarHBondContact O-N 3.33Å; N15-L18 VanDerWaalsContact O-N 3.16Å; N15-Q19 PolarHBondContact O-N 3.16Å |
| 16 | A | 60.2 | Low | 68.6 | Low | 39 Ų | 39 | 111.5 Ų | 111.5 | 32% | 0.322 | 57% | 0.57 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -64.9 | -21.2 | -172.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | G14 P22 | G14-A16 PolarHBondContact O-N 3.13Å; A16-P22 WeakPolarHBondContact O-CG 3.48Å |
| 17 | M | 60.6 | Low | 69.8 | Low | 167 Ų | 167 | 110.1 Ų | 110.1 | 82% | 0.823 | 56% | 0.559 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -77.8 | -22.5 | -179.5 | -148 | 168.9 | 176.9 | 0 | 0 | 112.9 | N15 | N15-M17 PolarHBondContact O-N 3.45Å; N15-M17 VanDerWaalsContact O-N 3.13Å |
| 18 | L | 63.8 | Low | 71.1 | Confident | 142 Ų | 142 | 107.6 Ų | 107.6 | 74% | 0.743 | 55% | 0.554 | S | S | * | * | S | Bend | trans | -113.2 | 9.4 | 179.9 | -71.1 | 169.4 | 0 | 0 | 0 | 113 | N15 | N15-L18 PolarHBondContact O-N 3.33Å; N15-L18 VanDerWaalsContact O-N 3.16Å |
| 19 | Q | 77.7 | Confident | 72.4 | Confident | 111 Ų | 111 | 103 Ų | 103 | 52% | 0.519 | 53% | 0.53 | S | S | . | . | S | Bend | trans | -60.9 | 150.9 | 171.5 | -81.1 | 178.4 | -37.1 | 0 | 0 | 110.7 | N15 G21 P22 F23 | N15-Q19 PolarHBondContact O-N 3.16Å; Q19-G21 PolarHBondContact O-N 3.21Å; Q19-G21 VanDerWaalsContact O-N 3.11Å; Q19-P22 VanDerWaalsContact O-CD 3.26Å; Q19-P22 WeakPolarHBondContact O-CD 3.32Å; Q19-F23 PolarHBondContact O-N 3.24Å |
| 20 | L | 80.1 | Confident | 73.9 | Confident | 121 Ų | 121 | 97.2 Ų | 97.2 | 63% | 0.634 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -56.5 | -30.7 | 179.9 | -169.2 | 70.5 | 0 | 0 | 0 | 112.4 | F23 L24 | L20-F23 HydrophobicContact CD1-CD1 4.24Å; L20-F23 PolarHBondContact O-N 3.23Å; L20-L24 HydrophobicContact CD1-CG 4.4Å; L20-L24 HydrophobicContact CD2-CD1 4.2Å; L20-L24 HydrophobicContact CG-CD1 3.85Å; L20-L24 HydrophobicContact CG-CG 4.15Å; L20-L24 WeakPolarHBondContact O-CB 3.26Å; L20-L24 VanDerWaalsContact O-CG 3.3Å; L20-L24 WeakPolarHBondContact O-CG 3.3Å; L20-L24 PolarHBondContact O-N 2.84Å |
| 21 | G | 82.2 | Confident | 75.4 | Confident | 48 Ų | 48 | 92.7 Ų | 92.7 | 50% | 0.495 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -59.4 | -63.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | Q19 F23 L24 Y25 | Q19-G21 PolarHBondContact O-N 3.21Å; Q19-G21 VanDerWaalsContact O-N 3.11Å; G21-F23 VanDerWaalsContact C-N 3.27Å; G21-F23 PolarHBondContact O-N 3.09Å; G21-L24 PolarHBondContact O-N 2.95Å; G21-Y25 WeakPolarHBondContact O-CB 3.36Å; G21-Y25 PolarHBondContact O-N 3.48Å |
| 22 | P | 81.6 | Confident | 77.1 | Confident | 44 Ų | 44 | 88.3 Ų | 88.3 | 29% | 0.286 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -55.2 | -40.9 | 174.1 | -29.3 | 35.7 | 0 | 0 | 0 | 113.3 | A16 Q19 Y25 W26 | A16-P22 WeakPolarHBondContact O-CG 3.48Å; Q19-P22 VanDerWaalsContact O-CD 3.26Å; Q19-P22 WeakPolarHBondContact O-CD 3.32Å; P22-Y25 WeakPolarHBondContact O-CB 3.48Å; P22-Y25 PolarHBondContact O-N 3.04Å; P22-W26 PolarHBondContact O-N 3.18Å |
| 23 | F | 83.6 | Confident | 78.6 | Confident | 127 Ų | 127 | 83.6 Ų | 83.6 | 56% | 0.557 | 46% | 0.462 | S | S | * | . | H | α-helix | trans | -59.4 | -49.7 | 177.9 | 174.2 | -97.9 | 0 | 0 | 0 | 112.7 | Q19 L20 G21 Y25 W26 T27 | Q19-F23 PolarHBondContact O-N 3.24Å; L20-F23 HydrophobicContact CD1-CD1 4.24Å; L20-F23 PolarHBondContact O-N 3.23Å; G21-F23 VanDerWaalsContact C-N 3.27Å; G21-F23 PolarHBondContact O-N 3.09Å; F23-Y25 VanDerWaalsContact C-N 3.3Å; F23-Y25 PolarHBondContact O-N 3.2Å; F23-W26 PolarHBondContact O-N 3.47Å; F23-T27 WeakPolarHBondContact O-CB 3.49Å; F23-T27 PolarHBondContact O-N 3.36Å; F23-T27 PolarHBondContact O-OG1 3.36Å |
| 24 | L | 88.1 | Confident | 80.4 | Confident | 75 Ų | 75 | 82 Ų | 82 | 39% | 0.393 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -61.6 | -41.9 | 176.8 | -76.7 | 170.9 | 0 | 0 | 0 | 110.8 | L20 G21 T27 F28 | L20-L24 HydrophobicContact CD1-CG 4.4Å; L20-L24 HydrophobicContact CD2-CD1 4.2Å; L20-L24 HydrophobicContact CG-CD1 3.85Å; L20-L24 HydrophobicContact CG-CG 4.15Å; L20-L24 WeakPolarHBondContact O-CB 3.26Å; L20-L24 VanDerWaalsContact O-CG 3.3Å; L20-L24 WeakPolarHBondContact O-CG 3.3Å; L20-L24 PolarHBondContact O-N 2.84Å; G21-L24 PolarHBondContact O-N 2.95Å; L24-T27 WeakPolarHBondContact O-CB 3.33Å; L24-T27 PolarHBondContact O-N 3.47Å; L24-F28 WeakPolarHBondContact O-CD2 3.22Å; L24-F28 PolarHBondContact O-N 2.87Å |
| 25 | Y | 85.3 | Confident | 82.1 | Confident | 79 Ų | 79 | 82.8 Ų | 82.8 | 31% | 0.31 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -60.3 | -46.8 | 177.3 | 166.8 | -94.2 | 0 | 0 | 0 | 112.7 | G21 P22 F23 T27 F28 L29 L151 | G21-Y25 WeakPolarHBondContact O-CB 3.36Å; G21-Y25 PolarHBondContact O-N 3.48Å; P22-Y25 WeakPolarHBondContact O-CB 3.48Å; P22-Y25 PolarHBondContact O-N 3.04Å; F23-Y25 VanDerWaalsContact C-N 3.3Å; F23-Y25 PolarHBondContact O-N 3.2Å; Y25-T27 VanDerWaalsContact C-N 3.28Å; Y25-T27 PolarHBondContact O-N 2.93Å; Y25-F28 PolarHBondContact O-N 3.34Å; Y25-L29 WeakPolarHBondContact O-CB 3.46Å; Y25-L29 PolarHBondContact O-N 3.43Å; Y25-L151 HydrophobicContact CE2-CD1 4.11Å; Y25-L151 HydrophobicContact CE2-CD2 4.39Å; Y25-L151 WeakPolarHBondContact OH-CD1 3.22Å; Y25-L151 VanDerWaalsContact OH-CD2 3.28Å; Y25-L151 WeakPolarHBondContact OH-CD2 3.4Å; Y25-L151 VanDerWaalsContact OH-CG 3.32Å; Y25-L151 WeakPolarHBondContact OH-CG 3.42Å |
| 26 | W | 86.1 | Confident | 83.6 | Confident | 110 Ų | 110 | 78.2 Ų | 78.2 | 42% | 0.417 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -64 | -35.5 | 175.3 | -72.1 | 114 | 0 | 0 | 0 | 111.9 | P22 F23 L29 A30 | P22-W26 PolarHBondContact O-N 3.18Å; F23-W26 PolarHBondContact O-N 3.47Å; W26-L29 HydrophobicContact CE3-CD2 4.02Å; W26-L29 HydrophobicContact CZ3-CD2 4.08Å; W26-L29 PolarHBondContact O-N 3.24Å; W26-A30 WeakPolarHBondContact O-CB 3.44Å; W26-A30 PolarHBondContact O-N 3.35Å |
| 27 | T | 90.2 | Very high | 85 | Confident | 65 Ų | 65 | 76.9 Ų | 76.9 | 40% | 0.399 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -65.3 | -46.1 | 175.6 | -56.8 | 0 | 0 | 0 | 0 | 111.9 | F23 L24 Y25 L29 A30 A31 | F23-T27 WeakPolarHBondContact O-CB 3.49Å; F23-T27 PolarHBondContact O-N 3.36Å; F23-T27 PolarHBondContact O-OG1 3.36Å; L24-T27 WeakPolarHBondContact O-CB 3.33Å; L24-T27 PolarHBondContact O-N 3.47Å; Y25-T27 VanDerWaalsContact C-N 3.28Å; Y25-T27 PolarHBondContact O-N 2.93Å; T27-L29 VanDerWaalsContact C-N 3.32Å; T27-L29 PolarHBondContact O-N 3.28Å; T27-A30 PolarHBondContact O-N 3.11Å; T27-A31 WeakPolarHBondContact O-CB 3.48Å; T27-A31 PolarHBondContact O-N 3.32Å |
| 28 | F | 90.1 | Very high | 86.4 | Confident | 151 Ų | 151 | 74.1 Ų | 74.1 | 66% | 0.662 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -63.3 | -38.9 | 175.5 | -84.3 | -69.4 | 0 | 0 | 0 | 111.9 | L24 Y25 A31 F32 | L24-F28 WeakPolarHBondContact O-CD2 3.22Å; L24-F28 PolarHBondContact O-N 2.87Å; Y25-F28 PolarHBondContact O-N 3.34Å; F28-A31 PolarHBondContact O-N 2.96Å; F28-F32 WeakPolarHBondContact O-CB 3.42Å; F28-F32 PolarHBondContact O-N 3.25Å |
| 29 | L | 88.2 | Confident | 87.6 | Confident | 13 Ų | 13 | 72.2 Ų | 72.2 | 7% | 0.068 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -62.3 | -48.1 | 175 | -174.2 | 65.1 | 0 | 0 | 0 | 110.8 | Y25 W26 T27 A31 F32 E33 P147 | Y25-L29 WeakPolarHBondContact O-CB 3.46Å; Y25-L29 PolarHBondContact O-N 3.43Å; W26-L29 HydrophobicContact CE3-CD2 4.02Å; W26-L29 HydrophobicContact CZ3-CD2 4.08Å; W26-L29 PolarHBondContact O-N 3.24Å; T27-L29 VanDerWaalsContact C-N 3.32Å; T27-L29 PolarHBondContact O-N 3.28Å; L29-A31 VanDerWaalsContact C-N 3.31Å; L29-A31 PolarHBondContact O-N 3.33Å; L29-F32 WeakPolarHBondContact O-CB 3.41Å; L29-F32 PolarHBondContact O-N 3.4Å; L29-F32 VanDerWaalsContact O-N 3.16Å; L29-E33 VanDerWaalsContact O-CG 3.31Å; L29-E33 WeakPolarHBondContact O-CG 3.38Å; L29-E33 PolarHBondContact O-N 3.02Å; L29-P147 HydrophobicContact CD1-CB 4.15Å; L29-P147 HydrophobicContact CD1-CG 4.02Å |
| 30 | A | 89.4 | Confident | 88.1 | Confident | 55 Ų | 55 | 67.9 Ų | 67.9 | 46% | 0.455 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -61.3 | -38.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | W26 T27 E33 G34 | W26-A30 WeakPolarHBondContact O-CB 3.44Å; W26-A30 PolarHBondContact O-N 3.35Å; T27-A30 PolarHBondContact O-N 3.11Å; A30-E33 PolarHBondContact O-N 3.41Å; A30-G34 PolarHBondContact O-N 2.95Å |
| 31 | A | 92.2 | Very high | 88.3 | Confident | 54 Ų | 54 | 62.1 Ų | 62.1 | 45% | 0.446 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -65 | -39.7 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112 | T27 F28 L29 T35 | T27-A31 WeakPolarHBondContact O-CB 3.48Å; T27-A31 PolarHBondContact O-N 3.32Å; F28-A31 PolarHBondContact O-N 2.96Å; L29-A31 VanDerWaalsContact C-N 3.31Å; L29-A31 PolarHBondContact O-N 3.33Å; A31-T35 WeakPolarHBondContact O-CB 3.5Å; A31-T35 PolarHBondContact O-N 3.19Å; A31-T35 PolarHBondContact O-OG1 3.48Å |
| 32 | F | 90.6 | Very high | 88.5 | Confident | 100 Ų | 100 | 65 Ų | 65 | 44% | 0.439 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -63.5 | -49.6 | 173.9 | 174.8 | -97.1 | 0 | 0 | 0 | 111.4 | F28 L29 G34 T35 V36 P147 | F28-F32 WeakPolarHBondContact O-CB 3.42Å; F28-F32 PolarHBondContact O-N 3.25Å; L29-F32 WeakPolarHBondContact O-CB 3.41Å; L29-F32 PolarHBondContact O-N 3.4Å; L29-F32 VanDerWaalsContact O-N 3.16Å; F32-G34 PolarHBondContact O-N 3.06Å; F32-T35 WeakPolarHBondContact O-CB 3.33Å; F32-T35 PolarHBondContact O-N 3.25Å; F32-T35 VanDerWaalsContact O-N 3.15Å; F32-V36 HydrophobicContact CD1-CG2 4.24Å; F32-V36 HydrophobicContact CE1-CG2 3.78Å; F32-V36 HydrophobicContact CE2-CG2 4.08Å; F32-V36 HydrophobicContact CZ-CG2 3.7Å; F32-V36 WeakPolarHBondContact O-CG2 3.49Å; F32-V36 PolarHBondContact O-N 3.16Å; F32-P147 HydrophobicContact CD1-CG 4.19Å; F32-P147 HydrophobicContact CE1-CG 3.91Å |
| 33 | E | 90.4 | Very high | 88.7 | Confident | 13 Ų | 13 | 69.5 Ų | 69.5 | 6% | 0.061 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -57.8 | -47.1 | 177.2 | -66.2 | 174.5 | 176.7 | 0 | 0 | 111.1 | L29 A30 T35 V36 F37 K77 S144 | L29-E33 VanDerWaalsContact O-CG 3.31Å; L29-E33 WeakPolarHBondContact O-CG 3.38Å; L29-E33 PolarHBondContact O-N 3.02Å; A30-E33 PolarHBondContact O-N 3.41Å; E33-T35 VanDerWaalsContact C-N 3.32Å; E33-T35 PolarHBondContact O-N 3.3Å; E33-V36 PolarHBondContact O-N 3.31Å; E33-V36 VanDerWaalsContact O-N 3.16Å; E33-F37 HydrophobicContact CB-CE2 4.06Å; E33-F37 HydrophobicContact CB-CZ 3.98Å; E33-F37 WeakPolarHBondContact O-CD1 3.35Å; E33-F37 VanDerWaalsContact O-CD2 3.27Å; E33-F37 WeakPolarHBondContact O-CD2 3.43Å; E33-F37 WeakPolarHBondContact O-CG 3.18Å; E33-F37 PolarHBondContact O-N 2.96Å; E33-K77 IonicContact OE1-NZ 2.69Å; E33-K77 PolarHBondContact OE1-NZ 3.01Å; E33-K77 IonicContact OE2-NZ 3.8Å; E33-S144 WeakPolarHBondContact CG-OG 3.34Å |
| 34 | G | 91.3 | Very high | 88.5 | Confident | 36 Ų | 36 | 64.3 Ų | 64.3 | 37% | 0.371 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -59.9 | -39.6 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | A30 F32 F37 F38 | A30-G34 PolarHBondContact O-N 2.95Å; F32-G34 PolarHBondContact O-N 3.06Å; G34-F37 PolarHBondContact O-N 3Å; G34-F38 PolarHBondContact O-N 3.18Å; G34-F38 VanDerWaalsContact O-N 3.08Å |
| 35 | T | 91.9 | Very high | 88 | Confident | 71 Ų | 71 | 63.2 Ų | 63.2 | 44% | 0.436 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -63.6 | -45.7 | 174.7 | -58.4 | 0 | 0 | 0 | 0 | 110.6 | A31 F32 E33 F37 F38 F39 | A31-T35 WeakPolarHBondContact O-CB 3.5Å; A31-T35 PolarHBondContact O-N 3.19Å; A31-T35 PolarHBondContact O-OG1 3.48Å; F32-T35 WeakPolarHBondContact O-CB 3.33Å; F32-T35 PolarHBondContact O-N 3.25Å; F32-T35 VanDerWaalsContact O-N 3.15Å; E33-T35 VanDerWaalsContact C-N 3.32Å; E33-T35 PolarHBondContact O-N 3.3Å; T35-F37 PolarHBondContact O-N 2.76Å; T35-F38 PolarHBondContact O-N 3.48Å; T35-F39 HydrophobicContact CG2-CD2 3.48Å; T35-F39 VanDerWaalsContact CG2-CD2 3.48Å; T35-F39 HydrophobicContact CG2-CE2 3.75Å; T35-F39 WeakPolarHBondContact O-CB 3.23Å; T35-F39 WeakPolarHBondContact O-CD2 3.29Å; T35-F39 PolarHBondContact O-N 3.06Å |
| 36 | V | 91.1 | Very high | 87.6 | Confident | 22 Ų | 22 | 65 Ų | 65 | 13% | 0.133 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -61.6 | -42.7 | 177.4 | 170.7 | 0 | 0 | 0 | 0 | 111.3 | F32 E33 G40 L140 I143 | F32-V36 HydrophobicContact CD1-CG2 4.24Å; F32-V36 HydrophobicContact CE1-CG2 3.78Å; F32-V36 HydrophobicContact CE2-CG2 4.08Å; F32-V36 HydrophobicContact CZ-CG2 3.7Å; F32-V36 WeakPolarHBondContact O-CG2 3.49Å; F32-V36 PolarHBondContact O-N 3.16Å; E33-V36 PolarHBondContact O-N 3.31Å; E33-V36 VanDerWaalsContact O-N 3.16Å; V36-G40 VanDerWaalsContact O-CA 3.26Å; V36-G40 WeakPolarHBondContact O-CA 3.44Å; V36-G40 PolarHBondContact O-N 3.08Å; V36-L140 HydrophobicContact CG1-CD2 4.28Å; V36-I143 HydrophobicContact CG1-CG2 3.97Å |
| 37 | F | 90.8 | Very high | 86.7 | Confident | 10 Ų | 10 | 63.7 Ų | 63.7 | 4% | 0.044 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -62 | -46.4 | 177.7 | -56.8 | -29.3 | 0 | 0 | 0 | 111.8 | E33 G34 T35 T41 V66 V69 L70 T73 S144 | E33-F37 HydrophobicContact CB-CE2 4.06Å; E33-F37 HydrophobicContact CB-CZ 3.98Å; E33-F37 WeakPolarHBondContact O-CD1 3.35Å; E33-F37 VanDerWaalsContact O-CD2 3.27Å; E33-F37 WeakPolarHBondContact O-CD2 3.43Å; E33-F37 WeakPolarHBondContact O-CG 3.18Å; E33-F37 PolarHBondContact O-N 2.96Å; G34-F37 PolarHBondContact O-N 3Å; T35-F37 PolarHBondContact O-N 2.76Å; F37-T41 WeakPolarHBondContact O-CB 3.46Å; F37-T41 VanDerWaalsContact O-CG2 3.28Å; F37-T41 WeakPolarHBondContact O-CG2 3.49Å; F37-T41 PolarHBondContact O-N 2.96Å; F37-T41 VanDerWaalsContact O-N 3.15Å; F37-T41 PolarHBondContact O-OG1 2.97Å; F37-V66 HydrophobicContact CB-CG1 4.35Å; F37-V69 HydrophobicContact CD1-CB 4.44Å; F37-V69 HydrophobicContact CD1-CG1 3.41Å; F37-V69 VanDerWaalsContact CD1-CG1 3.41Å; F37-V69 HydrophobicContact CE1-CG1 3.63Å; F37-V69 HydrophobicContact CG-CG1 4.23Å; F37-L70 HydrophobicContact CD2-CB 4.41Å; F37-L70 HydrophobicContact CE2-CB 4.37Å; F37-L70 HydrophobicContact CE2-CG 4.41Å; F37-T73 HydrophobicContact CE1-CG2 4.11Å; F37-T73 HydrophobicContact CZ-CG2 3.69Å; F37-S144 VanDerWaalsContact CE1-OG 3.25Å; F37-S144 WeakPolarHBondContact CE1-OG 3.36Å; F37-S144 WeakPolarHBondContact CZ-OG 3.43Å |
| 38 | F | 89.2 | Confident | 84.9 | Confident | 109 Ų | 109 | 65.2 Ų | 65.2 | 48% | 0.478 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -69.4 | -53.1 | -178.3 | -176.3 | -97.2 | 0 | 0 | 0 | 112.4 | G34 T35 T41 Y42 F62 | G34-F38 PolarHBondContact O-N 3.18Å; G34-F38 VanDerWaalsContact O-N 3.08Å; T35-F38 PolarHBondContact O-N 3.48Å; F38-T41 PolarHBondContact O-OG1 2.99Å; F38-Y42 VanDerWaalsContact O-CB 3.32Å; F38-Y42 WeakPolarHBondContact O-CB 3.42Å; F38-Y42 PolarHBondContact O-N 3.36Å; F38-F62 HydrophobicContact CD2-CE1 4.19Å; F38-F62 HydrophobicContact CD2-CZ 4.1Å; F38-F62 HydrophobicContact CE2-CE1 4.01Å; F38-F62 HydrophobicContact CE2-CZ 4.03Å |
| 39 | F | 89.9 | Confident | 83.3 | Confident | 103 Ų | 103 | 62.5 Ų | 62.5 | 45% | 0.452 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -69.3 | -36.3 | -179.1 | -78.8 | -80 | 0 | 0 | 0 | 111.9 | T35 Y42 F43 | T35-F39 HydrophobicContact CG2-CD2 3.48Å; T35-F39 VanDerWaalsContact CG2-CD2 3.48Å; T35-F39 HydrophobicContact CG2-CE2 3.75Å; T35-F39 WeakPolarHBondContact O-CB 3.23Å; T35-F39 WeakPolarHBondContact O-CD2 3.29Å; T35-F39 PolarHBondContact O-N 3.06Å; F39-Y42 WeakPolarHBondContact O-CB 3.22Å; F39-Y42 PolarHBondContact O-N 3.48Å; F39-F43 HydrophobicContact CB-CE2 4.25Å; F39-F43 WeakPolarHBondContact O-CD2 3.4Å; F39-F43 PolarHBondContact O-N 3.08Å |
| 40 | G | 87.1 | Confident | 81.8 | Confident | 19 Ų | 19 | 62.8 Ų | 62.8 | 20% | 0.196 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -62 | -45.5 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | V36 L44 | V36-G40 VanDerWaalsContact O-CA 3.26Å; V36-G40 WeakPolarHBondContact O-CA 3.44Å; V36-G40 PolarHBondContact O-N 3.08Å; G40-L44 PolarHBondContact O-N 3.49Å |
| 41 | T | 86.1 | Confident | 80.2 | Confident | 0 Ų | 0 | 61 Ų | 61 | 0% | 0 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -70.1 | -32.9 | 173.3 | 53.5 | 0 | 0 | 0 | 0 | 112.3 | F37 F38 L44 F45 F62 I65 V66 L140 | F37-T41 WeakPolarHBondContact O-CB 3.46Å; F37-T41 VanDerWaalsContact O-CG2 3.28Å; F37-T41 WeakPolarHBondContact O-CG2 3.49Å; F37-T41 PolarHBondContact O-N 2.96Å; F37-T41 VanDerWaalsContact O-N 3.15Å; F37-T41 PolarHBondContact O-OG1 2.97Å; F38-T41 PolarHBondContact O-OG1 2.99Å; T41-L44 WeakPolarHBondContact O-CB 2.99Å; T41-L44 PolarHBondContact O-N 3.12Å; T41-F45 VanDerWaalsContact O-CD2 3.28Å; T41-F45 WeakPolarHBondContact O-CD2 3.16Å; T41-F45 PolarHBondContact O-N 3.39Å; T41-F45 VanDerWaalsContact O-N 3.09Å; T41-F62 WeakPolarHBondContact OG1-CE2 3.16Å; T41-F62 VanDerWaalsContact OG1-CZ 3.31Å; T41-F62 WeakPolarHBondContact OG1-CZ 3.17Å; T41-I65 HydrophobicContact CG2-CB 4.42Å; T41-I65 HydrophobicContact CG2-CG2 3.59Å; T41-V66 HydrophobicContact CG2-CG2 3.69Å; T41-V66 WeakPolarHBondContact OG1-CG2 3.3Å; T41-L140 HydrophobicContact CG2-CD1 3.93Å |
| 42 | Y | 85.9 | Confident | 78.3 | Confident | 108 Ų | 108 | 68.3 Ų | 68.3 | 42% | 0.424 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -62 | -46.4 | 174.3 | 177.9 | -97.8 | 0 | 0 | 0 | 112 | F38 F39 L44 F45 Q46 | F38-Y42 VanDerWaalsContact O-CB 3.32Å; F38-Y42 WeakPolarHBondContact O-CB 3.42Å; F38-Y42 PolarHBondContact O-N 3.36Å; F39-Y42 WeakPolarHBondContact O-CB 3.22Å; F39-Y42 PolarHBondContact O-N 3.48Å; Y42-L44 VanDerWaalsContact C-N 3.28Å; Y42-L44 PolarHBondContact O-N 2.95Å; Y42-F45 PolarHBondContact O-N 3.4Å; Y42-F45 VanDerWaalsContact O-N 3.14Å; Y42-Q46 HydrophobicContact CE1-CG 4.18Å; Y42-Q46 VanDerWaalsContact CZ-NE2 3.28Å; Y42-Q46 PolarHBondContact O-N 3.45Å; Y42-Q46 PolarHBondContact OH-NE2 3.39Å; Y42-Q46 VanDerWaalsContact OH-NE2 3.1Å |
| 43 | F | 85.1 | Confident | 76.7 | Confident | 139 Ų | 139 | 69.3 Ų | 69.3 | 61% | 0.61 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -62.1 | -37.2 | 175.2 | -73.2 | -58.8 | 0 | 0 | 0 | 112.2 | F39 F45 Q46 | F39-F43 HydrophobicContact CB-CE2 4.25Å; F39-F43 WeakPolarHBondContact O-CD2 3.4Å; F39-F43 PolarHBondContact O-N 3.08Å; F43-F45 VanDerWaalsContact C-N 3.27Å; F43-F45 PolarHBondContact O-N 3.45Å; F43-Q46 WeakPolarHBondContact O-CB 3.47Å; F43-Q46 PolarHBondContact O-N 3.25Å |
| 44 | L | 80.1 | Confident | 75.1 | Confident | 19 Ų | 19 | 71.4 Ų | 71.4 | 10% | 0.099 | 40% | 0.399 | C | S | . | . | H | α-helix | trans | -60.6 | -36.6 | 174.9 | -174.1 | 65.1 | 0 | 0 | 0 | 112.1 | G40 T41 Y42 T47 L50 A136 | G40-L44 PolarHBondContact O-N 3.49Å; T41-L44 WeakPolarHBondContact O-CB 2.99Å; T41-L44 PolarHBondContact O-N 3.12Å; Y42-L44 VanDerWaalsContact C-N 3.28Å; Y42-L44 PolarHBondContact O-N 2.95Å; L44-T47 PolarHBondContact O-N 3.28Å; L44-T47 PolarHBondContact O-OG1 3.2Å; L44-L50 HydrophobicContact CD1-CD1 3.89Å; L44-L50 HydrophobicContact CD1-CD2 3.64Å; L44-L50 HydrophobicContact CD1-CG 4.41Å; L44-L50 HydrophobicContact CD2-CD1 4.22Å; L44-L50 HydrophobicContact CG-CD1 3.6Å; L44-L50 HydrophobicContact CG-CD2 4.29Å; L44-L50 WeakPolarHBondContact O-CD1 3.37Å; L44-A136 HydrophobicContact CD1-CB 3.46Å; L44-A136 VanDerWaalsContact CD1-CB 3.46Å; L44-A136 HydrophobicContact CD2-CB 3.58Å; L44-A136 HydrophobicContact CG-CB 4.09Å |
| 45 | F | 77.9 | Confident | 73.7 | Confident | 52 Ų | 52 | 75.5 Ų | 75.5 | 23% | 0.228 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -76.7 | -21.9 | 178.3 | -88.4 | -117.2 | 0 | 0 | 0 | 113.8 | T41 Y42 F43 T47 Y57 F62 I65 | T41-F45 VanDerWaalsContact O-CD2 3.28Å; T41-F45 WeakPolarHBondContact O-CD2 3.16Å; T41-F45 PolarHBondContact O-N 3.39Å; T41-F45 VanDerWaalsContact O-N 3.09Å; Y42-F45 PolarHBondContact O-N 3.4Å; Y42-F45 VanDerWaalsContact O-N 3.14Å; F43-F45 VanDerWaalsContact C-N 3.27Å; F43-F45 PolarHBondContact O-N 3.45Å; F45-T47 VanDerWaalsContact C-N 3.27Å; F45-T47 PolarHBondContact O-N 3.37Å; F45-Y57 HydrophobicContact CE1-CG 4.3Å; F45-Y57 HydrophobicContact CZ-CG 4.24Å; F45-F62 HydrophobicContact CD1-CD2 4.23Å; F45-F62 AromaticContact CD2-CD2 3.72Å; F45-F62 HydrophobicContact CD2-CD2 3.72Å; F45-F62 HydrophobicContact CD2-CE2 4.41Å; F45-F62 HydrophobicContact CE1-CB 3.8Å; F45-F62 HydrophobicContact CE1-CD2 4.23Å; F45-F62 HydrophobicContact CE2-CB 4.09Å; F45-F62 AromaticContact CE2-CD2 3.72Å; F45-F62 HydrophobicContact CE2-CD2 3.72Å; F45-F62 HydrophobicContact CE2-CG 4.39Å; F45-F62 AromaticContact CG-CD2 3.98Å; F45-F62 HydrophobicContact CG-CD2 3.98Å; F45-F62 VanDerWaalsContact CZ-CA 3.41Å; F45-F62 HydrophobicContact CZ-CB 3.57Å; F45-F62 HydrophobicContact CZ-CD2 4Å; F45-F62 HydrophobicContact CZ-CG 4.3Å; F45-I65 HydrophobicContact CE2-CD1 3.65Å; F45-I65 HydrophobicContact CZ-CD1 4.04Å |
| 46 | Q | 76.4 | Confident | 72.4 | Confident | 115 Ų | 115 | 78.8 Ų | 78.8 | 54% | 0.537 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -68.9 | -28.4 | 174.3 | -68.4 | -65.9 | -24.8 | 0 | 0 | 112 | Y42 F43 A48 | Y42-Q46 HydrophobicContact CE1-CG 4.18Å; Y42-Q46 VanDerWaalsContact CZ-NE2 3.28Å; Y42-Q46 PolarHBondContact O-N 3.45Å; Y42-Q46 PolarHBondContact OH-NE2 3.39Å; Y42-Q46 VanDerWaalsContact OH-NE2 3.1Å; F43-Q46 WeakPolarHBondContact O-CB 3.47Å; F43-Q46 PolarHBondContact O-N 3.25Å; Q46-A48 VanDerWaalsContact C-N 3.33Å; Q46-A48 PolarHBondContact O-N 3.11Å |
| 47 | T | 67.3 | Low | 71.3 | Confident | 83 Ų | 83 | 78.9 Ų | 78.9 | 51% | 0.509 | 42% | 0.424 | S | S | . | . | S | Bend | trans | -76.4 | 85 | 168.8 | 36.5 | 0 | 0 | 0 | 0 | 109.9 | L44 F45 S49 | L44-T47 PolarHBondContact O-N 3.28Å; L44-T47 PolarHBondContact O-OG1 3.2Å; F45-T47 VanDerWaalsContact C-N 3.27Å; F45-T47 PolarHBondContact O-N 3.37Å; T47-S49 PolarHBondContact O-N 3.14Å |
| 48 | A | 52.5 | Low | 70.5 | Confident | 97 Ų | 97 | 80.1 Ų | 80.1 | 80% | 0.802 | 44% | 0.439 | S | S | * | . | S | Bend | trans | -60.7 | 16.1 | -167 | 0 | 0 | 0 | 0 | 0 | 118 | Q46 | Q46-A48 VanDerWaalsContact C-N 3.33Å; Q46-A48 PolarHBondContact O-N 3.11Å |
| 49 | S | 55.9 | Low | 70 | Confident | 95 Ų | 95 | 81.9 Ų | 81.9 | 66% | 0.664 | 45% | 0.454 | S | S | * | . | trans | -149.1 | 51.9 | -175.2 | 69 | 0 | 0 | 0 | 0 | 113.7 | T47 E51 | T47-S49 PolarHBondContact O-N 3.14Å; S49-E51 PolarHBondContact O-N 3.37Å | ||
| 50 | L | 55.8 | Low | 69.6 | Low | 18 Ų | 18 | 82.4 Ų | 82.4 | 9% | 0.094 | 45% | 0.453 | C | S | . | . | S | Bend | trans | -77 | -8.7 | 177.7 | -42.2 | 160.4 | 0 | 0 | 0 | 113.1 | L44 Y57 S130 S132 | L44-L50 HydrophobicContact CD1-CD1 3.89Å; L44-L50 HydrophobicContact CD1-CD2 3.64Å; L44-L50 HydrophobicContact CD1-CG 4.41Å; L44-L50 HydrophobicContact CD2-CD1 4.22Å; L44-L50 HydrophobicContact CG-CD1 3.6Å; L44-L50 HydrophobicContact CG-CD2 4.29Å; L44-L50 WeakPolarHBondContact O-CD1 3.37Å; L50-Y57 HydrophobicContact CB-CE2 3.73Å; L50-Y57 HydrophobicContact CD1-CD2 4.27Å; L50-Y57 HydrophobicContact CD1-CE2 3.93Å; L50-Y57 HydrophobicContact CG-CE2 4.25Å; L50-S130 WeakPolarHBondContact O-CB 3.39Å; L50-S130 PolarHBondContact O-OG 3.2Å; L50-S132 WeakPolarHBondContact CD2-OG 3.41Å |
| 51 | E | 56.6 | Low | 69.2 | Low | 19 Ų | 19 | 81.8 Ų | 81.8 | 9% | 0.089 | 45% | 0.445 | C | S | . | . | S | Bend | trans | -110.2 | 131.7 | 172.7 | -119.9 | -175.8 | 161.9 | 0 | 0 | 109.5 | S49 N53 G54 K55 Q126 | S49-E51 PolarHBondContact O-N 3.37Å; E51-N53 PolarHBondContact O-N 3.23Å; E51-G54 PolarHBondContact O-N 3.42Å; E51-K55 WeakPolarHBondContact OE2-CB 3.45Å; E51-Q126 VanDerWaalsContact CD-NE2 3.34Å; E51-Q126 WeakPolarHBondContact OE1-CG 3.41Å; E51-Q126 PolarHBondContact OE1-NE2 3.16Å; E51-Q126 PolarHBondContact OE2-NE2 2.89Å |
| 52 | E | 52.1 | Low | 69.1 | Low | 206 Ų | 206 | 83.8 Ų | 83.8 | 96% | 0.963 | 45% | 0.454 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.2 | -18.7 | 175.2 | -67.6 | -175.6 | 161.9 | 0 | 0 | 112.6 | ||
| 53 | N | 56.7 | Low | 69 | Low | 121 Ų | 121 | 80.4 Ų | 80.4 | 65% | 0.647 | 45% | 0.452 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.9 | 0.9 | -179.3 | -65.2 | -29.5 | 0 | 0 | 0 | 114.5 | E51 K55 | E51-N53 PolarHBondContact O-N 3.23Å; N53-K55 HydrophobicContact CB-CG 4.44Å; N53-K55 PolarHBondContact O-N 3.09Å |
| 54 | G | 57.3 | Low | 69.1 | Low | 58 Ų | 58 | 75 Ų | 75 | 60% | 0.598 | 43% | 0.43 | S | S | * | . | trans | 65.3 | 17.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | E51 | E51-G54 PolarHBondContact O-N 3.42Š| ||
| 55 | K | 62.4 | Low | 69.4 | Low | 122 Ų | 122 | 74 Ų | 74 | 53% | 0.53 | 43% | 0.425 | S | S | . | . | P | Polyproline II helix | trans | -77.1 | 140.1 | 177 | -58.9 | 176.5 | 177 | 173 | 0 | 110.2 | E51 N53 | E51-K55 WeakPolarHBondContact OE2-CB 3.45Å; N53-K55 HydrophobicContact CB-CG 4.44Å; N53-K55 PolarHBondContact O-N 3.09Å |
| 56 | V | 63.7 | Low | 70 | Confident | 139 Ų | 139 | 73 Ų | 73 | 84% | 0.842 | 42% | 0.423 | S | S | * | . | P | Polyproline II helix | trans | -79.8 | 126.3 | 179.3 | -173.1 | 0 | 0 | 0 | 0 | 109.2 | G58 | V56-G58 PolarHBondContact O-N 2.89Š|
| 57 | Y | 69.2 | Low | 70.6 | Confident | 24 Ų | 24 | 72.9 Ų | 72.9 | 9% | 0.094 | 42% | 0.421 | C | S | . | . | P | Polyproline II helix | trans | -68.9 | 128.6 | 172.5 | -71.1 | -72.2 | 0 | 0 | 0 | 110.7 | F45 L50 T61 S130 | F45-Y57 HydrophobicContact CE1-CG 4.3Å; F45-Y57 HydrophobicContact CZ-CG 4.24Å; L50-Y57 HydrophobicContact CB-CE2 3.73Å; L50-Y57 HydrophobicContact CD1-CD2 4.27Å; L50-Y57 HydrophobicContact CD1-CE2 3.93Å; L50-Y57 HydrophobicContact CG-CE2 4.25Å; Y57-T61 HydrophobicContact CD1-CG2 3.27Å; Y57-T61 HydrophobicContact CE1-CG2 3.82Å; Y57-T61 HydrophobicContact CG-CG2 4.18Å; Y57-S130 WeakPolarHBondContact OH-CB 3.39Å |
| 58 | G | 72.9 | Confident | 71.7 | Confident | 36 Ų | 36 | 69.1 Ų | 69.1 | 37% | 0.371 | 40% | 0.398 | S | S | . | . | P | Polyproline II helix | trans | -80.2 | 167.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | V56 W60 T61 F62 | V56-G58 PolarHBondContact O-N 2.89Å; G58-W60 PolarHBondContact O-N 3.19Å; G58-W60 VanDerWaalsContact O-N 3.11Å; G58-T61 WeakPolarHBondContact O-CB 3.41Å; G58-T61 PolarHBondContact O-N 2.95Å; G58-F62 PolarHBondContact O-N 2.83Å |
| 59 | N | 79.3 | Confident | 73.6 | Confident | 146 Ų | 146 | 64.5 Ų | 64.5 | 78% | 0.781 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -56.1 | -29.5 | 177.3 | -62.4 | -13.9 | 0 | 0 | 0 | 113.3 | F62 G63 | N59-F62 WeakPolarHBondContact O-CB 3.27Å; N59-F62 PolarHBondContact O-N 3.32Å; N59-G63 PolarHBondContact O-N 3.47Å; N59-G63 VanDerWaalsContact O-N 3.15Å |
| 60 | W | 80.6 | Confident | 75.3 | Confident | 115 Ų | 115 | 63.1 Ų | 63.1 | 44% | 0.436 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -71.4 | -34.1 | 176.3 | -65.4 | 109.8 | 0 | 0 | 0 | 112.9 | G58 G63 T64 R119 M120 | G58-W60 PolarHBondContact O-N 3.19Å; G58-W60 VanDerWaalsContact O-N 3.11Å; W60-G63 PolarHBondContact O-N 3.43Å; W60-T64 WeakPolarHBondContact O-CB 3.46Å; W60-T64 PolarHBondContact O-N 2.92Å; W60-T64 PolarHBondContact O-OG1 3.41Å; W60-R119 HydrophobicContact CZ2-CB 4.48Å; W60-M120 HydrophobicContact CB-CG 4.22Å; W60-M120 HydrophobicContact CD2-CE 4.08Å; W60-M120 HydrophobicContact CD2-CG 4.16Å; W60-M120 HydrophobicContact CE3-CE 3.17Å; W60-M120 HydrophobicContact CE3-CG 4.16Å; W60-M120 HydrophobicContact CE3-SD 4.48Å; W60-M120 HydrophobicContact CG-CG 4.23Å; W60-M120 HydrophobicContact CH2-CE 4.19Å; W60-M120 HydrophobicContact CZ3-CE 3.23Å |
| 61 | T | 79.6 | Confident | 77 | Confident | 6 Ų | 6 | 63.3 Ų | 63.3 | 4% | 0.037 | 35% | 0.347 | C | S | . | . | H | α-helix | trans | -67.1 | -41.4 | 173.9 | -42.2 | 0 | 0 | 0 | 0 | 110.7 | Y57 G58 G63 T64 I65 V123 M127 | Y57-T61 HydrophobicContact CD1-CG2 3.27Å; Y57-T61 HydrophobicContact CE1-CG2 3.82Å; Y57-T61 HydrophobicContact CG-CG2 4.18Å; G58-T61 WeakPolarHBondContact O-CB 3.41Å; G58-T61 PolarHBondContact O-N 2.95Å; T61-G63 PolarHBondContact O-N 3.37Å; T61-T64 PolarHBondContact O-N 3.45Å; T61-I65 HydrophobicContact CG2-CD1 4.04Å; T61-I65 WeakPolarHBondContact O-CG1 3.33Å; T61-I65 PolarHBondContact O-N 3.48Å; T61-V123 HydrophobicContact CG2-CG1 3.99Å; T61-V123 WeakPolarHBondContact OG1-CG1 3.33Å; T61-M127 HydrophobicContact CG2-CB 4.37Å |
| 62 | F | 83.9 | Confident | 78.7 | Confident | 42 Ų | 42 | 64.7 Ų | 64.7 | 18% | 0.184 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -54.8 | -51.8 | 173.5 | -179.5 | -91.2 | 0 | 0 | 0 | 111.4 | F38 T41 F45 G58 N59 T64 I65 V66 | F38-F62 HydrophobicContact CD2-CE1 4.19Å; F38-F62 HydrophobicContact CD2-CZ 4.1Å; F38-F62 HydrophobicContact CE2-CE1 4.01Å; F38-F62 HydrophobicContact CE2-CZ 4.03Å; T41-F62 WeakPolarHBondContact OG1-CE2 3.16Å; T41-F62 VanDerWaalsContact OG1-CZ 3.31Å; T41-F62 WeakPolarHBondContact OG1-CZ 3.17Å; F45-F62 HydrophobicContact CD1-CD2 4.23Å; F45-F62 AromaticContact CD2-CD2 3.72Å; F45-F62 HydrophobicContact CD2-CD2 3.72Å; F45-F62 HydrophobicContact CD2-CE2 4.41Å; F45-F62 HydrophobicContact CE1-CB 3.8Å; F45-F62 HydrophobicContact CE1-CD2 4.23Å; F45-F62 HydrophobicContact CE2-CB 4.09Å; F45-F62 AromaticContact CE2-CD2 3.72Å; F45-F62 HydrophobicContact CE2-CD2 3.72Å; F45-F62 HydrophobicContact CE2-CG 4.39Å; F45-F62 AromaticContact CG-CD2 3.98Å; F45-F62 HydrophobicContact CG-CD2 3.98Å; F45-F62 VanDerWaalsContact CZ-CA 3.41Å; F45-F62 HydrophobicContact CZ-CB 3.57Å; F45-F62 HydrophobicContact CZ-CD2 4Å; F45-F62 HydrophobicContact CZ-CG 4.3Å; G58-F62 PolarHBondContact O-N 2.83Å; N59-F62 WeakPolarHBondContact O-CB 3.27Å; N59-F62 PolarHBondContact O-N 3.32Å; F62-T64 VanDerWaalsContact C-N 3.28Å; F62-T64 PolarHBondContact O-N 2.83Å; F62-I65 PolarHBondContact O-N 2.8Å; F62-V66 HydrophobicContact CD1-CG2 4.27Å; F62-V66 HydrophobicContact CE1-CG2 3.87Å; F62-V66 HydrophobicContact CZ-CG2 4.07Å; F62-V66 WeakPolarHBondContact O-CG2 3.37Å; F62-V66 PolarHBondContact O-N 2.92Å |
| 63 | G | 84.7 | Confident | 80.6 | Confident | 36 Ų | 36 | 54.9 Ų | 54.9 | 37% | 0.371 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -59.7 | -38.2 | 178 | 0 | 0 | 0 | 0 | 0 | 113.1 | N59 W60 T61 F67 | N59-G63 PolarHBondContact O-N 3.47Å; N59-G63 VanDerWaalsContact O-N 3.15Å; W60-G63 PolarHBondContact O-N 3.43Å; T61-G63 PolarHBondContact O-N 3.37Å; G63-F67 VanDerWaalsContact O-CB 3.27Å; G63-F67 WeakPolarHBondContact O-CB 3.47Å; G63-F67 PolarHBondContact O-N 3.49Å |
| 64 | T | 85.6 | Confident | 82.2 | Confident | 25 Ų | 25 | 52.2 Ų | 52.2 | 15% | 0.153 | 30% | 0.295 | C | S | . | . | H | α-helix | trans | -70.1 | -36.6 | -179.9 | -55.2 | 0 | 0 | 0 | 0 | 112 | W60 T61 F62 F67 T68 F124 M127 | W60-T64 WeakPolarHBondContact O-CB 3.46Å; W60-T64 PolarHBondContact O-N 2.92Å; W60-T64 PolarHBondContact O-OG1 3.41Å; T61-T64 PolarHBondContact O-N 3.45Å; F62-T64 VanDerWaalsContact C-N 3.28Å; F62-T64 PolarHBondContact O-N 2.83Å; T64-F67 PolarHBondContact O-N 3.36Å; T64-T68 WeakPolarHBondContact O-CB 3.36Å; T64-T68 PolarHBondContact O-N 2.92Å; T64-T68 PolarHBondContact O-OG1 2.89Å; T64-F124 HydrophobicContact CG2-CD2 3.73Å; T64-F124 HydrophobicContact CG2-CE2 4.44Å; T64-M127 HydrophobicContact CG2-SD 3.97Å |
| 65 | I | 87.1 | Confident | 83.9 | Confident | 0 Ų | 0 | 50.3 Ų | 50.3 | 0% | 0 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -66 | -50.3 | 174.8 | -67.3 | 163.7 | 0 | 0 | 0 | 109.8 | T41 F45 T61 F62 F67 T68 V69 M127 T133 I137 | T41-I65 HydrophobicContact CG2-CB 4.42Å; T41-I65 HydrophobicContact CG2-CG2 3.59Å; F45-I65 HydrophobicContact CE2-CD1 3.65Å; F45-I65 HydrophobicContact CZ-CD1 4.04Å; T61-I65 HydrophobicContact CG2-CD1 4.04Å; T61-I65 WeakPolarHBondContact O-CG1 3.33Å; T61-I65 PolarHBondContact O-N 3.48Å; F62-I65 PolarHBondContact O-N 2.8Å; I65-F67 VanDerWaalsContact C-N 3.27Å; I65-F67 PolarHBondContact O-N 3.03Å; I65-T68 PolarHBondContact O-N 3.49Å; I65-T68 VanDerWaalsContact O-N 3.16Å; I65-V69 HydrophobicContact CG2-CG2 4.48Å; I65-V69 WeakPolarHBondContact O-CG2 3.17Å; I65-V69 PolarHBondContact O-N 2.68Å; I65-M127 HydrophobicContact CB-SD 4.29Å; I65-M127 HydrophobicContact CD1-CG 4.21Å; I65-M127 HydrophobicContact CG1-CG 3.63Å; I65-M127 HydrophobicContact CG1-SD 3.41Å; I65-M127 WeakPolarHBondContact CG1-SD 3.24Å; I65-T133 HydrophobicContact CD1-CG2 3.87Å; I65-T133 HydrophobicContact CG1-CG2 4.02Å; I65-I137 HydrophobicContact CG2-CG1 4.31Å |
| 66 | V | 90.1 | Very high | 85.2 | Confident | 31 Ų | 31 | 47 Ų | 47 | 19% | 0.188 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -56 | -45.3 | 176.8 | 174.9 | 0 | 0 | 0 | 0 | 110.7 | F37 T41 F62 T68 V69 L70 | F37-V66 HydrophobicContact CB-CG1 4.35Å; T41-V66 HydrophobicContact CG2-CG2 3.69Å; T41-V66 WeakPolarHBondContact OG1-CG2 3.3Å; F62-V66 HydrophobicContact CD1-CG2 4.27Å; F62-V66 HydrophobicContact CE1-CG2 3.87Å; F62-V66 HydrophobicContact CZ-CG2 4.07Å; F62-V66 WeakPolarHBondContact O-CG2 3.37Å; F62-V66 PolarHBondContact O-N 2.92Å; V66-T68 PolarHBondContact O-N 3.43Å; V66-V69 PolarHBondContact O-N 3.4Å; V66-L70 WeakPolarHBondContact O-CB 3.23Å; V66-L70 PolarHBondContact O-N 3.03Å |
| 67 | F | 89.9 | Confident | 86.4 | Confident | 111 Ų | 111 | 41.9 Ų | 41.9 | 49% | 0.487 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -64.7 | -40.4 | 179.5 | -165.1 | -96 | 0 | 0 | 0 | 112.3 | G63 T64 I65 L70 V71 Y100 | G63-F67 VanDerWaalsContact O-CB 3.27Å; G63-F67 WeakPolarHBondContact O-CB 3.47Å; G63-F67 PolarHBondContact O-N 3.49Å; T64-F67 PolarHBondContact O-N 3.36Å; I65-F67 VanDerWaalsContact C-N 3.27Å; I65-F67 PolarHBondContact O-N 3.03Å; F67-L70 PolarHBondContact O-N 3.28Å; F67-V71 HydrophobicContact CD1-CG2 3.9Å; F67-V71 HydrophobicContact CE1-CG2 3.57Å; F67-V71 HydrophobicContact CZ-CG2 4.05Å; F67-V71 WeakPolarHBondContact O-CG2 3.38Å; F67-V71 PolarHBondContact O-N 3.3Å; F67-Y100 AromaticContact CD1-CE2 3.57Å; F67-Y100 HydrophobicContact CD1-CE2 3.57Å; F67-Y100 AromaticContact CD1-CZ 3.93Å; F67-Y100 HydrophobicContact CE1-CD2 4.13Å; F67-Y100 AromaticContact CE1-CE2 3.49Å; F67-Y100 HydrophobicContact CE1-CE2 3.49Å; F67-Y100 VanDerWaalsContact CE1-CE2 3.49Å |
| 68 | T | 89.9 | Confident | 87.3 | Confident | 4 Ų | 4 | 45.6 Ų | 45.6 | 3% | 0.025 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -63.1 | -48.7 | 176.5 | -59.9 | 0 | 0 | 0 | 0 | 111.2 | T64 I65 V66 L70 V71 F72 Y100 M127 I137 | T64-T68 WeakPolarHBondContact O-CB 3.36Å; T64-T68 PolarHBondContact O-N 2.92Å; T64-T68 PolarHBondContact O-OG1 2.89Å; I65-T68 PolarHBondContact O-N 3.49Å; I65-T68 VanDerWaalsContact O-N 3.16Å; V66-T68 PolarHBondContact O-N 3.43Å; T68-L70 VanDerWaalsContact C-N 3.27Å; T68-L70 PolarHBondContact O-N 3.37Å; T68-V71 PolarHBondContact O-N 3.35Å; T68-F72 HydrophobicContact CG2-CD2 3.94Å; T68-F72 HydrophobicContact CG2-CE2 3.96Å; T68-F72 VanDerWaalsContact O-CD2 3.27Å; T68-F72 WeakPolarHBondContact O-CD2 3.04Å; T68-F72 PolarHBondContact O-N 3.37Å; T68-Y100 WeakPolarHBondContact CA-OH 3.38Å; T68-Y100 HydrophobicContact CG2-CE1 4.25Å; T68-Y100 PolarHBondContact OG1-OH 3.46Å; T68-M127 HydrophobicContact CG2-CE 4.36Å; T68-I137 HydrophobicContact CG2-CD1 4.33Å |
| 69 | V | 91.5 | Very high | 88 | Confident | 0 Ų | 0 | 44.6 Ų | 44.6 | 0% | 0 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -58.6 | -42.4 | 176.7 | 177.3 | 0 | 0 | 0 | 0 | 110.6 | F37 I65 V66 T73 I137 L140 I141 | F37-V69 HydrophobicContact CD1-CB 4.44Å; F37-V69 HydrophobicContact CD1-CG1 3.41Å; F37-V69 VanDerWaalsContact CD1-CG1 3.41Å; F37-V69 HydrophobicContact CE1-CG1 3.63Å; F37-V69 HydrophobicContact CG-CG1 4.23Å; I65-V69 HydrophobicContact CG2-CG2 4.48Å; I65-V69 WeakPolarHBondContact O-CG2 3.17Å; I65-V69 PolarHBondContact O-N 2.68Å; V66-V69 PolarHBondContact O-N 3.4Å; V69-T73 VanDerWaalsContact O-CB 3.27Å; V69-T73 WeakPolarHBondContact O-CB 3.47Å; V69-T73 PolarHBondContact O-N 3.19Å; V69-T73 PolarHBondContact O-OG1 2.88Å; V69-I137 HydrophobicContact CG2-CB 4.21Å; V69-I137 HydrophobicContact CG2-CG1 3.86Å; V69-I137 HydrophobicContact CG2-CG2 4.07Å; V69-L140 HydrophobicContact CG1-CB 3.88Å; V69-L140 HydrophobicContact CG2-CB 4.42Å; V69-L140 HydrophobicContact CG2-CD1 4.14Å; V69-I141 HydrophobicContact CG1-CG1 4.3Å |
| 70 | L | 92.3 | Very high | 88.3 | Confident | 67 Ų | 67 | 41.7 Ų | 41.7 | 35% | 0.351 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -60.5 | -55.4 | 177.7 | -174.9 | 162.4 | 0 | 0 | 0 | 111.3 | F37 V66 F67 T68 F72 T73 V74 | F37-L70 HydrophobicContact CD2-CB 4.41Å; F37-L70 HydrophobicContact CE2-CB 4.37Å; F37-L70 HydrophobicContact CE2-CG 4.41Å; V66-L70 WeakPolarHBondContact O-CB 3.23Å; V66-L70 PolarHBondContact O-N 3.03Å; F67-L70 PolarHBondContact O-N 3.28Å; T68-L70 VanDerWaalsContact C-N 3.27Å; T68-L70 PolarHBondContact O-N 3.37Å; L70-F72 VanDerWaalsContact C-N 3.3Å; L70-F72 PolarHBondContact O-N 2.86Å; L70-T73 PolarHBondContact O-N 2.92Å; L70-T73 VanDerWaalsContact O-N 3.13Å; L70-V74 HydrophobicContact CD2-CG1 4.04Å; L70-V74 HydrophobicContact CD2-CG2 4.27Å; L70-V74 HydrophobicContact CG-CG1 4.46Å; L70-V74 WeakPolarHBondContact O-CG1 3.31Å; L70-V74 WeakPolarHBondContact O-CG2 3.34Å; L70-V74 PolarHBondContact O-N 3.13Å |
| 71 | V | 92.3 | Very high | 88.4 | Confident | 22 Ų | 22 | 39.8 Ų | 39.8 | 13% | 0.133 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -57.9 | -43.8 | -177.3 | 170.6 | 0 | 0 | 0 | 0 | 111.3 | F67 T68 V74 T75 Y100 | F67-V71 HydrophobicContact CD1-CG2 3.9Å; F67-V71 HydrophobicContact CE1-CG2 3.57Å; F67-V71 HydrophobicContact CZ-CG2 4.05Å; F67-V71 WeakPolarHBondContact O-CG2 3.38Å; F67-V71 PolarHBondContact O-N 3.3Å; T68-V71 PolarHBondContact O-N 3.35Å; V71-V74 WeakPolarHBondContact O-CG2 3.46Å; V71-T75 VanDerWaalsContact O-CB 3.27Å; V71-T75 WeakPolarHBondContact O-CB 3.44Å; V71-T75 PolarHBondContact O-N 3.37Å; V71-T75 PolarHBondContact O-OG1 2.91Å; V71-Y100 HydrophobicContact CB-CD1 4.46Å; V71-Y100 HydrophobicContact CB-CE1 4.49Å; V71-Y100 HydrophobicContact CG1-CD1 3.96Å; V71-Y100 HydrophobicContact CG1-CD2 4.34Å; V71-Y100 HydrophobicContact CG1-CE1 4.47Å; V71-Y100 HydrophobicContact CG1-CG 3.88Å; V71-Y100 HydrophobicContact CG2-CD2 4.27Å; V71-Y100 HydrophobicContact CG2-CE2 4.22Å |
| 72 | F | 91.5 | Very high | 88.8 | Confident | 47 Ų | 47 | 41 Ų | 41 | 21% | 0.206 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -65.1 | -46.2 | 176.4 | -86.2 | -104 | 0 | 0 | 0 | 111.7 | T68 L70 T75 L76 L97 Y100 I141 | T68-F72 HydrophobicContact CG2-CD2 3.94Å; T68-F72 HydrophobicContact CG2-CE2 3.96Å; T68-F72 VanDerWaalsContact O-CD2 3.27Å; T68-F72 WeakPolarHBondContact O-CD2 3.04Å; T68-F72 PolarHBondContact O-N 3.37Å; L70-F72 VanDerWaalsContact C-N 3.3Å; L70-F72 PolarHBondContact O-N 2.86Å; F72-T75 PolarHBondContact O-N 3.4Å; F72-L76 WeakPolarHBondContact O-CB 3.28Å; F72-L76 VanDerWaalsContact O-CG 3.24Å; F72-L76 WeakPolarHBondContact O-CG 3.32Å; F72-L76 PolarHBondContact O-N 2.82Å; F72-L97 HydrophobicContact CD1-CD2 3.57Å; F72-L97 HydrophobicContact CD2-CD2 3.97Å; F72-L97 HydrophobicContact CE1-CD2 3.47Å; F72-L97 VanDerWaalsContact CE1-CD2 3.47Å; F72-L97 HydrophobicContact CE2-CD2 3.9Å; F72-L97 HydrophobicContact CG-CD2 3.83Å; F72-L97 HydrophobicContact CZ-CD2 3.65Å; F72-Y100 HydrophobicContact CE2-CD1 4.39Å; F72-Y100 HydrophobicContact CE2-CE1 4.37Å; F72-I141 HydrophobicContact CB-CD1 3.59Å; F72-I141 HydrophobicContact CB-CG1 4.22Å; F72-I141 HydrophobicContact CD1-CD1 4.31Å; F72-I141 HydrophobicContact CG-CD1 4.18Å |
| 73 | T | 91.6 | Very high | 88.5 | Confident | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -64.1 | -47.8 | -177.1 | -55.5 | 0 | 0 | 0 | 0 | 111.9 | F37 V69 L70 T75 L76 K77 L145 | F37-T73 HydrophobicContact CE1-CG2 4.11Å; F37-T73 HydrophobicContact CZ-CG2 3.69Å; V69-T73 VanDerWaalsContact O-CB 3.27Å; V69-T73 WeakPolarHBondContact O-CB 3.47Å; V69-T73 PolarHBondContact O-N 3.19Å; V69-T73 PolarHBondContact O-OG1 2.88Å; L70-T73 PolarHBondContact O-N 2.92Å; L70-T73 VanDerWaalsContact O-N 3.13Å; T73-T75 VanDerWaalsContact C-N 3.28Å; T73-T75 PolarHBondContact O-N 3.47Å; T73-L76 PolarHBondContact O-N 3.29Å; T73-K77 WeakPolarHBondContact O-CB 3.38Å; T73-K77 PolarHBondContact O-N 3.22Å; T73-L145 HydrophobicContact CG2-CD2 3.89Å; T73-L145 HydrophobicContact CG2-CG 4.16Å |
| 74 | V | 91.6 | Very high | 88.5 | Confident | 66 Ų | 66 | 53.6 Ų | 53.6 | 40% | 0.4 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -65.7 | -33.8 | -179.8 | -59 | 0 | 0 | 0 | 0 | 112.1 | L70 V71 L78 | L70-V74 HydrophobicContact CD2-CG1 4.04Å; L70-V74 HydrophobicContact CD2-CG2 4.27Å; L70-V74 HydrophobicContact CG-CG1 4.46Å; L70-V74 WeakPolarHBondContact O-CG1 3.31Å; L70-V74 WeakPolarHBondContact O-CG2 3.34Å; L70-V74 PolarHBondContact O-N 3.13Å; V71-V74 WeakPolarHBondContact O-CG2 3.46Å; V74-L78 WeakPolarHBondContact O-CB 3.36Å; V74-L78 PolarHBondContact O-N 2.69Å |
| 75 | T | 92.5 | Very high | 88.4 | Confident | 17 Ų | 17 | 58.8 Ų | 58.8 | 10% | 0.104 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -73.7 | -42.2 | 178.5 | -53.8 | 0 | 0 | 0 | 0 | 111.3 | V71 F72 T73 L78 A79 I93 L97 | V71-T75 VanDerWaalsContact O-CB 3.27Å; V71-T75 WeakPolarHBondContact O-CB 3.44Å; V71-T75 PolarHBondContact O-N 3.37Å; V71-T75 PolarHBondContact O-OG1 2.91Å; F72-T75 PolarHBondContact O-N 3.4Å; T73-T75 VanDerWaalsContact C-N 3.28Å; T73-T75 PolarHBondContact O-N 3.47Å; T75-L78 PolarHBondContact O-N 3.07Å; T75-A79 WeakPolarHBondContact O-CB 3.43Å; T75-A79 PolarHBondContact O-N 2.97Å; T75-I93 HydrophobicContact CG2-CG2 3.73Å; T75-L97 HydrophobicContact CG2-CD1 3.47Å; T75-L97 VanDerWaalsContact CG2-CD1 3.47Å; T75-L97 HydrophobicContact CG2-CG 3.91Å |
| 76 | L | 89.8 | Confident | 88.7 | Confident | 54 Ų | 54 | 61.8 Ų | 61.8 | 28% | 0.283 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -67 | -38.9 | 174.9 | -71.8 | 171.1 | 0 | 0 | 0 | 111.8 | F72 T73 L78 A79 L80 I141 L145 | F72-L76 WeakPolarHBondContact O-CB 3.28Å; F72-L76 VanDerWaalsContact O-CG 3.24Å; F72-L76 WeakPolarHBondContact O-CG 3.32Å; F72-L76 PolarHBondContact O-N 2.82Å; T73-L76 PolarHBondContact O-N 3.29Å; L76-L78 VanDerWaalsContact C-N 3.34Å; L76-L78 PolarHBondContact O-N 2.7Å; L76-A79 WeakPolarHBondContact O-CB 3.31Å; L76-A79 PolarHBondContact O-N 2.85Å; L76-A79 VanDerWaalsContact O-N 3.13Å; L76-L80 WeakPolarHBondContact O-CG 2.77Å; L76-L80 PolarHBondContact O-N 2.98Å; L76-I141 HydrophobicContact CD1-CG2 3.57Å; L76-L145 HydrophobicContact CB-CD1 3.93Å; L76-L145 HydrophobicContact CD1-CD1 4.28Å |
| 77 | K | 88.1 | Confident | 88.7 | Confident | 30 Ų | 30 | 70.4 Ų | 70.4 | 13% | 0.13 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -54.6 | -50 | 171 | 173.2 | 174.6 | -157.4 | 97.2 | 0 | 111.1 | E33 T73 A79 L80 D81 L145 E148 | E33-K77 IonicContact OE1-NZ 2.69Å; E33-K77 PolarHBondContact OE1-NZ 3.01Å; E33-K77 IonicContact OE2-NZ 3.8Å; T73-K77 WeakPolarHBondContact O-CB 3.38Å; T73-K77 PolarHBondContact O-N 3.22Å; K77-A79 VanDerWaalsContact C-N 3.32Å; K77-A79 PolarHBondContact O-N 3.42Å; K77-L80 PolarHBondContact O-N 3.39Å; K77-D81 PolarHBondContact O-N 2.86Å; K77-L145 HydrophobicContact CB-CD2 4.08Å; K77-E148 WeakPolarHBondContact CE-OE1 3.46Å; K77-E148 WeakPolarHBondContact CE-OE2 3.27Å; K77-E148 VanDerWaalsContact CG-OE2 3.23Å; K77-E148 WeakPolarHBondContact CG-OE2 3.09Å; K77-E148 IonicContact NZ-OE1 2.81Å; K77-E148 PolarHBondContact NZ-OE1 3.34Å; K77-E148 IonicContact NZ-OE2 2.7Å; K77-E148 PolarHBondContact NZ-OE2 3.25Å |
| 78 | L | 88.8 | Confident | 88.7 | Confident | 102 Ų | 102 | 70.7 Ų | 70.7 | 53% | 0.534 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -61.5 | -39.8 | 175.3 | -175.9 | 66.8 | 0 | 0 | 0 | 112.4 | V74 T75 L76 L80 D81 T82 | V74-L78 WeakPolarHBondContact O-CB 3.36Å; V74-L78 PolarHBondContact O-N 2.69Å; T75-L78 PolarHBondContact O-N 3.07Å; L76-L78 VanDerWaalsContact C-N 3.34Å; L76-L78 PolarHBondContact O-N 2.7Å; L78-L80 VanDerWaalsContact C-N 3.33Å; L78-L80 PolarHBondContact O-N 2.81Å; L78-D81 PolarHBondContact O-N 3.15Å; L78-T82 PolarHBondContact O-N 3.4Å; L78-T82 PolarHBondContact O-OG1 2.91Å |
| 79 | A | 87.9 | Confident | 88.7 | Confident | 15 Ų | 15 | 73.5 Ų | 73.5 | 12% | 0.124 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -64.4 | -36.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | T75 L76 K77 W85 I93 | T75-A79 WeakPolarHBondContact O-CB 3.43Å; T75-A79 PolarHBondContact O-N 2.97Å; L76-A79 WeakPolarHBondContact O-CB 3.31Å; L76-A79 PolarHBondContact O-N 2.85Å; L76-A79 VanDerWaalsContact O-N 3.13Å; K77-A79 VanDerWaalsContact C-N 3.32Å; K77-A79 PolarHBondContact O-N 3.42Å; A79-W85 HydrophobicContact CB-CZ2 4.21Å; A79-I93 HydrophobicContact CB-CD1 4.24Å; A79-I93 HydrophobicContact CB-CG2 4.15Å |
| 80 | L | 85.1 | Confident | 88.6 | Confident | 86 Ų | 86 | 77 Ų | 77 | 45% | 0.45 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -71.7 | -36.8 | 175.3 | -70.9 | 172.8 | 0 | 0 | 0 | 112.5 | L76 K77 L78 T82 L145 I149 | L76-L80 WeakPolarHBondContact O-CG 2.77Å; L76-L80 PolarHBondContact O-N 2.98Å; K77-L80 PolarHBondContact O-N 3.39Å; L78-L80 VanDerWaalsContact C-N 3.33Å; L78-L80 PolarHBondContact O-N 2.81Å; L80-T82 VanDerWaalsContact C-N 3.29Å; L80-T82 PolarHBondContact O-N 3.35Å; L80-L145 HydrophobicContact CD1-CD1 4.32Å; L80-L145 HydrophobicContact CD1-CD2 4.34Å; L80-I149 HydrophobicContact CD1-CD1 4.45Å; L80-I149 HydrophobicContact CD1-CG1 4.17Å |
| 81 | D | 83.1 | Confident | 88.6 | Confident | 74 Ų | 74 | 80.6 Ų | 80.6 | 40% | 0.396 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -73.7 | -21.6 | 177.5 | -88.3 | -18.1 | 0 | 0 | 0 | 113.2 | K77 L78 R83 | K77-D81 PolarHBondContact O-N 2.86Å; L78-D81 PolarHBondContact O-N 3.15Å; D81-R83 PolarHBondContact O-N 2.92Å; D81-R83 VanDerWaalsContact O-N 3.08Å |
| 82 | T | 86.4 | Confident | 88.5 | Confident | 33 Ų | 33 | 83.8 Ų | 83.8 | 20% | 0.202 | 40% | 0.398 | C | S | . | . | trans | -70.2 | 104.9 | -179.9 | -62.5 | 0 | 0 | 0 | 0 | 111.2 | L78 L80 F84 | L78-T82 PolarHBondContact O-N 3.4Å; L78-T82 PolarHBondContact O-OG1 2.91Å; L80-T82 VanDerWaalsContact C-N 3.29Å; L80-T82 PolarHBondContact O-N 3.35Å; T82-F84 WeakPolarHBondContact CG2-O 3.37Å | ||
| 83 | R | 79.6 | Confident | 88.5 | Confident | 187 Ų | 187 | 82.2 Ų | 82.2 | 71% | 0.706 | 39% | 0.392 | S | S | * | . | S | Bend | trans | -74.1 | -25.5 | 178.5 | -64.8 | -179.7 | -176.8 | -93.5 | -11 | 114.3 | D81 | D81-R83 PolarHBondContact O-N 2.92Å; D81-R83 VanDerWaalsContact O-N 3.08Å |
| 84 | F | 82.6 | Confident | 88.5 | Confident | 155 Ų | 155 | 88.4 Ų | 88.4 | 68% | 0.68 | 42% | 0.415 | S | S | * | . | S | Bend | trans | -120 | 104.3 | -176.8 | -66.1 | -74.9 | 0 | 0 | 0 | 110.2 | T82 T86 N89 | T82-F84 WeakPolarHBondContact CG2-O 3.37Å; F84-T86 PolarHBondContact O-N 3.25Å; F84-T86 VanDerWaalsContact O-N 3.16Å; F84-N89 PolarHBondContact O-ND2 2.91Å |
| 85 | W | 85.5 | Confident | 88.5 | Confident | 133 Ų | 133 | 86.7 Ų | 86.7 | 50% | 0.504 | 41% | 0.411 | S | S | . | . | trans | -81.5 | 92.7 | 175.4 | -86.7 | 66.3 | 0 | 0 | 0 | 110.1 | A79 H90 W94 | A79-W85 HydrophobicContact CB-CZ2 4.21Å; W85-H90 AromaticContact CE3-ND1 3.48Å; W85-H90 AromaticContact CZ3-CE1 3.67Å; W85-H90 AromaticContact CZ3-ND1 2.99Å; W85-H90 WeakPolarHBondContact CZ3-ND1 3.44Å; W85-W94 AromaticContact CH2-NE1 3.95Å; W85-W94 AromaticContact CZ3-NE1 4Å | ||
| 86 | T | 91.8 | Very high | 88.5 | Confident | 64 Ų | 64 | 88.4 Ų | 88.4 | 39% | 0.393 | 42% | 0.424 | S | S | . | . | trans | -91.1 | 157.7 | 168.3 | 67.8 | 0 | 0 | 0 | 0 | 109.7 | F84 I88 N89 H90 | F84-T86 PolarHBondContact O-N 3.25Å; F84-T86 VanDerWaalsContact O-N 3.16Å; T86-I88 PolarHBondContact O-N 3.49Å; T86-N89 PolarHBondContact O-N 2.89Å; T86-N89 WeakPolarHBondContact OG1-CB 3.48Å; T86-N89 PolarHBondContact OG1-N 3.45Å; T86-N89 PolarHBondContact OG1-ND2 2.92Å; T86-H90 PolarHBondContact O-N 3.38Å | ||
| 87 | W | 90.7 | Very high | 88.5 | Confident | 211 Ų | 211 | 86.5 Ų | 86.5 | 80% | 0.799 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -55.1 | -37.8 | 174.8 | 178.8 | -97.9 | 0 | 0 | 0 | 112.5 | H90 F91 | W87-H90 WeakPolarHBondContact O-CB 3.29Å; W87-H90 PolarHBondContact O-N 3.47Å; W87-F91 WeakPolarHBondContact O-CB 3.27Å; W87-F91 PolarHBondContact O-N 2.85Å |
| 88 | I | 90.8 | Very high | 88.6 | Confident | 118 Ų | 118 | 87.9 Ų | 87.9 | 61% | 0.605 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -66.8 | -46.3 | 179.1 | -61.7 | 151.4 | 0 | 0 | 0 | 110.7 | T86 H90 F91 V92 | T86-I88 PolarHBondContact O-N 3.49Å; I88-H90 VanDerWaalsContact C-N 3.29Å; I88-H90 PolarHBondContact O-N 3.12Å; I88-F91 PolarHBondContact O-N 2.9Å; I88-V92 HydrophobicContact CG2-CG2 4.41Å; I88-V92 WeakPolarHBondContact O-CG2 3.32Å; I88-V92 PolarHBondContact O-N 2.91Å |
| 89 | N | 88.9 | Confident | 88.8 | Confident | 62 Ų | 62 | 89.5 Ų | 89.5 | 33% | 0.332 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -61.4 | -41 | 177.4 | -70.4 | -13.5 | 0 | 0 | 0 | 111 | F84 T86 V92 I93 | F84-N89 PolarHBondContact O-ND2 2.91Å; T86-N89 PolarHBondContact O-N 2.89Å; T86-N89 WeakPolarHBondContact OG1-CB 3.48Å; T86-N89 PolarHBondContact OG1-N 3.45Å; T86-N89 PolarHBondContact OG1-ND2 2.92Å; N89-V92 PolarHBondContact O-N 3.3Å; N89-I93 WeakPolarHBondContact O-CB 3.49Å; N89-I93 WeakPolarHBondContact O-CD1 3.45Å; N89-I93 WeakPolarHBondContact O-CG1 3.36Å; N89-I93 PolarHBondContact O-N 3.16Å |
| 90 | H | 88.7 | Confident | 88.9 | Confident | 73 Ų | 73 | 89.9 Ų | 89.9 | 34% | 0.338 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -58.5 | -53.6 | 174.4 | -166.5 | 83.8 | 0 | 0 | 0 | 111.1 | W85 T86 W87 I88 V92 I93 W94 | W85-H90 AromaticContact CE3-ND1 3.48Å; W85-H90 AromaticContact CZ3-CE1 3.67Å; W85-H90 AromaticContact CZ3-ND1 2.99Å; W85-H90 WeakPolarHBondContact CZ3-ND1 3.44Å; T86-H90 PolarHBondContact O-N 3.38Å; W87-H90 WeakPolarHBondContact O-CB 3.29Å; W87-H90 PolarHBondContact O-N 3.47Å; I88-H90 VanDerWaalsContact C-N 3.29Å; I88-H90 PolarHBondContact O-N 3.12Å; H90-V92 VanDerWaalsContact C-N 3.32Å; H90-V92 PolarHBondContact O-N 2.97Å; H90-I93 PolarHBondContact O-N 3.36Å; H90-W94 AromaticContact CD2-CD1 3.53Å; H90-W94 AromaticContact CE1-CD1 3.32Å; H90-W94 AromaticContact CE1-NE1 3.03Å; H90-W94 PolarHBondContact CE1-NE1 3.43Å; H90-W94 AromaticContact CG-CD1 3.6Å; H90-W94 AromaticContact CG-NE1 3.92Å; H90-W94 AromaticContact ND1-CD1 3.46Å; H90-W94 AromaticContact ND1-NE1 3.28Å; H90-W94 PolarHBondContact ND1-NE1 3.28Å; H90-W94 AromaticContact NE2-CD1 3.35Å; H90-W94 AromaticContact NE2-NE1 3.55Å; H90-W94 PolarHBondContact O-N 2.96Å |
| 91 | F | 92.8 | Very high | 89 | Confident | 143 Ų | 143 | 88.1 Ų | 88.1 | 63% | 0.627 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -58.7 | -41.9 | -178.7 | -179.9 | -99.9 | 0 | 0 | 0 | 112.7 | W87 I88 G95 | W87-F91 WeakPolarHBondContact O-CB 3.27Å; W87-F91 PolarHBondContact O-N 2.85Å; I88-F91 PolarHBondContact O-N 2.9Å; F91-G95 WeakPolarHBondContact O-CA 3.36Å; F91-G95 PolarHBondContact O-N 2.92Å |
| 92 | V | 91.5 | Very high | 89.2 | Confident | 90 Ų | 90 | 91.1 Ų | 91.1 | 55% | 0.545 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -70.4 | -42.9 | -178.7 | 174.2 | 0 | 0 | 0 | 0 | 112 | I88 N89 H90 S96 | I88-V92 HydrophobicContact CG2-CG2 4.41Å; I88-V92 WeakPolarHBondContact O-CG2 3.32Å; I88-V92 PolarHBondContact O-N 2.91Å; N89-V92 PolarHBondContact O-N 3.3Å; H90-V92 VanDerWaalsContact C-N 3.32Å; H90-V92 PolarHBondContact O-N 2.97Å; V92-S96 WeakPolarHBondContact O-CB 3.24Å; V92-S96 PolarHBondContact O-N 3.5Å; V92-S96 PolarHBondContact O-OG 3.29Å |
| 93 | I | 90.9 | Very high | 89.2 | Confident | 14 Ų | 14 | 94.1 Ų | 94.1 | 7% | 0.072 | 45% | 0.445 | C | S | . | . | H | α-helix | trans | -66.5 | -49.9 | -179.3 | -68.8 | 170.1 | 0 | 0 | 0 | 110.7 | T75 A79 N89 H90 S96 L97 | T75-I93 HydrophobicContact CG2-CG2 3.73Å; A79-I93 HydrophobicContact CB-CD1 4.24Å; A79-I93 HydrophobicContact CB-CG2 4.15Å; N89-I93 WeakPolarHBondContact O-CB 3.49Å; N89-I93 WeakPolarHBondContact O-CD1 3.45Å; N89-I93 WeakPolarHBondContact O-CG1 3.36Å; N89-I93 PolarHBondContact O-N 3.16Å; H90-I93 PolarHBondContact O-N 3.36Å; I93-S96 PolarHBondContact O-OG 3.34Å; I93-L97 PolarHBondContact O-N 3.49Å |
| 94 | W | 91.1 | Very high | 89.4 | Confident | 129 Ų | 129 | 86.1 Ų | 86.1 | 49% | 0.489 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -73.6 | -33.5 | 179.5 | -64.7 | 106.6 | 0 | 0 | 0 | 111.9 | W85 H90 L97 A98 | W85-W94 AromaticContact CH2-NE1 3.95Å; W85-W94 AromaticContact CZ3-NE1 4Å; H90-W94 AromaticContact CD2-CD1 3.53Å; H90-W94 AromaticContact CE1-CD1 3.32Å; H90-W94 AromaticContact CE1-NE1 3.03Å; H90-W94 PolarHBondContact CE1-NE1 3.43Å; H90-W94 AromaticContact CG-CD1 3.6Å; H90-W94 AromaticContact CG-NE1 3.92Å; H90-W94 AromaticContact ND1-CD1 3.46Å; H90-W94 AromaticContact ND1-NE1 3.28Å; H90-W94 PolarHBondContact ND1-NE1 3.28Å; H90-W94 AromaticContact NE2-CD1 3.35Å; H90-W94 AromaticContact NE2-NE1 3.55Å; H90-W94 PolarHBondContact O-N 2.96Å; W94-L97 HydrophobicContact CE3-CD1 4.29Å; W94-L97 PolarHBondContact O-N 3.48Å; W94-A98 WeakPolarHBondContact O-CB 3.27Å; W94-A98 PolarHBondContact O-N 2.84Å |
| 95 | G | 91.3 | Very high | 89.4 | Confident | 31 Ų | 31 | 83.4 Ų | 83.4 | 32% | 0.32 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -63.5 | -38.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | F91 A98 F99 | F91-G95 WeakPolarHBondContact O-CA 3.36Å; F91-G95 PolarHBondContact O-N 2.92Å; G95-A98 PolarHBondContact O-N 3.42Å; G95-F99 WeakPolarHBondContact O-CB 3.31Å; G95-F99 PolarHBondContact O-N 3.16Å |
| 96 | S | 93 | Very high | 89.2 | Confident | 53 Ų | 53 | 81.1 Ų | 81.1 | 37% | 0.371 | 40% | 0.4 | S | S | . | . | H | α-helix | trans | -68.7 | -39.9 | 176.4 | 66.8 | 0 | 0 | 0 | 0 | 112.4 | V92 I93 F99 Y100 | V92-S96 WeakPolarHBondContact O-CB 3.24Å; V92-S96 PolarHBondContact O-N 3.5Å; V92-S96 PolarHBondContact O-OG 3.29Å; I93-S96 PolarHBondContact O-OG 3.34Å; S96-F99 PolarHBondContact O-N 2.92Å; S96-Y100 WeakPolarHBondContact O-CB 3.27Å; S96-Y100 PolarHBondContact O-N 2.9Å |
| 97 | L | 90.6 | Very high | 88.5 | Confident | 13 Ų | 13 | 82.5 Ų | 82.5 | 7% | 0.068 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -61.1 | -48.4 | 172 | -88.7 | 147 | 0 | 0 | 0 | 111.7 | F72 T75 I93 W94 F99 Y100 V101 | F72-L97 HydrophobicContact CD1-CD2 3.57Å; F72-L97 HydrophobicContact CD2-CD2 3.97Å; F72-L97 HydrophobicContact CE1-CD2 3.47Å; F72-L97 VanDerWaalsContact CE1-CD2 3.47Å; F72-L97 HydrophobicContact CE2-CD2 3.9Å; F72-L97 HydrophobicContact CG-CD2 3.83Å; F72-L97 HydrophobicContact CZ-CD2 3.65Å; T75-L97 HydrophobicContact CG2-CD1 3.47Å; T75-L97 VanDerWaalsContact CG2-CD1 3.47Å; T75-L97 HydrophobicContact CG2-CG 3.91Å; I93-L97 PolarHBondContact O-N 3.49Å; W94-L97 HydrophobicContact CE3-CD1 4.29Å; W94-L97 PolarHBondContact O-N 3.48Å; L97-F99 VanDerWaalsContact C-N 3.35Å; L97-F99 PolarHBondContact O-N 2.9Å; L97-Y100 WeakPolarHBondContact O-CB 3.44Å; L97-Y100 PolarHBondContact O-N 2.87Å; L97-V101 WeakPolarHBondContact O-CG2 3.31Å; L97-V101 PolarHBondContact O-N 3.05Å; L97-V101 VanDerWaalsContact O-N 3.12Å |
| 98 | A | 90.1 | Very high | 87.6 | Confident | 60 Ų | 60 | 72.9 Ų | 72.9 | 50% | 0.496 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -63.4 | -42 | 178 | 0 | 0 | 0 | 0 | 0 | 111.6 | W94 G95 Y100 V101 F102 | W94-A98 WeakPolarHBondContact O-CB 3.27Å; W94-A98 PolarHBondContact O-N 2.84Å; G95-A98 PolarHBondContact O-N 3.42Å; A98-Y100 VanDerWaalsContact C-N 3.35Å; A98-Y100 PolarHBondContact O-N 3.46Å; A98-V101 PolarHBondContact O-N 3.16Å; A98-F102 WeakPolarHBondContact O-CB 3.39Å; A98-F102 PolarHBondContact O-N 2.73Å |
| 99 | F | 91.9 | Very high | 86.6 | Confident | 136 Ų | 136 | 68.9 Ų | 68.9 | 60% | 0.596 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -61 | -43.3 | 175.8 | -179.7 | -98.7 | 0 | 0 | 0 | 111.7 | G95 S96 L97 V101 F102 F103 | G95-F99 WeakPolarHBondContact O-CB 3.31Å; G95-F99 PolarHBondContact O-N 3.16Å; S96-F99 PolarHBondContact O-N 2.92Å; L97-F99 VanDerWaalsContact C-N 3.35Å; L97-F99 PolarHBondContact O-N 2.9Å; F99-V101 PolarHBondContact O-N 3.38Å; F99-F102 PolarHBondContact O-N 3.28Å; F99-F103 HydrophobicContact CE1-CB 4.48Å; F99-F103 WeakPolarHBondContact O-CB 3.25Å; F99-F103 PolarHBondContact O-N 3.06Å |
| 100 | Y | 90.1 | Very high | 85.6 | Confident | 23 Ų | 23 | 71 Ų | 71 | 9% | 0.09 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -58.2 | -48.7 | 175.6 | 168.1 | -109 | 0 | 0 | 0 | 112.1 | F67 T68 V71 F72 S96 L97 A98 S104 | F67-Y100 AromaticContact CD1-CE2 3.57Å; F67-Y100 HydrophobicContact CD1-CE2 3.57Å; F67-Y100 AromaticContact CD1-CZ 3.93Å; F67-Y100 HydrophobicContact CE1-CD2 4.13Å; F67-Y100 AromaticContact CE1-CE2 3.49Å; F67-Y100 HydrophobicContact CE1-CE2 3.49Å; F67-Y100 VanDerWaalsContact CE1-CE2 3.49Å; T68-Y100 WeakPolarHBondContact CA-OH 3.38Å; T68-Y100 HydrophobicContact CG2-CE1 4.25Å; T68-Y100 PolarHBondContact OG1-OH 3.46Å; V71-Y100 HydrophobicContact CB-CD1 4.46Å; V71-Y100 HydrophobicContact CB-CE1 4.49Å; V71-Y100 HydrophobicContact CG1-CD1 3.96Å; V71-Y100 HydrophobicContact CG1-CD2 4.34Å; V71-Y100 HydrophobicContact CG1-CE1 4.47Å; V71-Y100 HydrophobicContact CG1-CG 3.88Å; V71-Y100 HydrophobicContact CG2-CD2 4.27Å; V71-Y100 HydrophobicContact CG2-CE2 4.22Å; F72-Y100 HydrophobicContact CE2-CD1 4.39Å; F72-Y100 HydrophobicContact CE2-CE1 4.37Å; S96-Y100 WeakPolarHBondContact O-CB 3.27Å; S96-Y100 PolarHBondContact O-N 2.9Å; L97-Y100 WeakPolarHBondContact O-CB 3.44Å; L97-Y100 PolarHBondContact O-N 2.87Å; A98-Y100 VanDerWaalsContact C-N 3.35Å; A98-Y100 PolarHBondContact O-N 3.46Å; Y100-S104 WeakPolarHBondContact CE2-OG 3.43Å; Y100-S104 VanDerWaalsContact O-CB 3.29Å; Y100-S104 WeakPolarHBondContact O-CB 3.27Å; Y100-S104 PolarHBondContact O-N 2.76Å; Y100-S104 PolarHBondContact O-OG 3.07Å |
| 101 | V | 87.3 | Confident | 84.6 | Confident | 49 Ų | 49 | 69.2 Ų | 69.2 | 30% | 0.297 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -63 | -49 | 179.3 | 175.5 | 0 | 0 | 0 | 0 | 110.4 | L97 A98 F99 F103 S104 F105 F124 | L97-V101 WeakPolarHBondContact O-CG2 3.31Å; L97-V101 PolarHBondContact O-N 3.05Å; L97-V101 VanDerWaalsContact O-N 3.12Å; A98-V101 PolarHBondContact O-N 3.16Å; F99-V101 PolarHBondContact O-N 3.38Å; V101-F103 PolarHBondContact O-N 3.14Å; V101-S104 PolarHBondContact O-N 3.34Å; V101-F105 HydrophobicContact CG1-CD2 3.83Å; V101-F105 HydrophobicContact CG1-CE2 3.75Å; V101-F105 VanDerWaalsContact O-CD2 3.28Å; V101-F105 WeakPolarHBondContact O-CD2 3.13Å; V101-F105 PolarHBondContact O-N 2.92Å; V101-F124 HydrophobicContact CG1-CE1 4.42Å |
| 102 | F | 87.4 | Confident | 83 | Confident | 136 Ų | 136 | 62.9 Ų | 62.9 | 60% | 0.596 | 33% | 0.327 | S | S | * | . | H | α-helix | trans | -59.9 | -48.1 | 179.9 | 179 | -97.5 | 0 | 0 | 0 | 112.2 | A98 F99 S104 F105 F106 | A98-F102 WeakPolarHBondContact O-CB 3.39Å; A98-F102 PolarHBondContact O-N 2.73Å; F99-F102 PolarHBondContact O-N 3.28Å; F102-S104 VanDerWaalsContact C-N 3.32Å; F102-S104 PolarHBondContact O-N 2.96Å; F102-F105 PolarHBondContact O-N 3.12Å; F102-F106 PolarHBondContact O-N 2.92Å |
| 103 | F | 86 | Confident | 81.8 | Confident | 96 Ų | 96 | 63.6 Ų | 63.6 | 42% | 0.421 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -61.8 | -40.8 | 178.4 | -178.3 | -99.3 | 0 | 0 | 0 | 111.7 | F99 V101 F105 F106 W107 | F99-F103 HydrophobicContact CE1-CB 4.48Å; F99-F103 WeakPolarHBondContact O-CB 3.25Å; F99-F103 PolarHBondContact O-N 3.06Å; V101-F103 PolarHBondContact O-N 3.14Å; F103-F105 VanDerWaalsContact C-N 3.35Å; F103-F105 PolarHBondContact O-N 3.5Å; F103-F106 PolarHBondContact O-N 3.32Å; F103-W107 HydrophobicContact CZ-CE3 4.06Å; F103-W107 VanDerWaalsContact O-CB 3.31Å; F103-W107 WeakPolarHBondContact O-CB 3.32Å; F103-W107 PolarHBondContact O-N 3.5Å |
| 104 | S | 84.3 | Confident | 80.5 | Confident | 19 Ų | 19 | 71.6 Ų | 71.6 | 13% | 0.133 | 37% | 0.368 | C | S | . | . | H | α-helix | trans | -64.6 | -37.6 | 178.3 | -59.8 | 0 | 0 | 0 | 0 | 112.3 | Y100 V101 F102 G108 | Y100-S104 WeakPolarHBondContact CE2-OG 3.43Å; Y100-S104 VanDerWaalsContact O-CB 3.29Å; Y100-S104 WeakPolarHBondContact O-CB 3.27Å; Y100-S104 PolarHBondContact O-N 2.76Å; Y100-S104 PolarHBondContact O-OG 3.07Å; V101-S104 PolarHBondContact O-N 3.34Å; F102-S104 VanDerWaalsContact C-N 3.32Å; F102-S104 PolarHBondContact O-N 2.96Å; S104-G108 PolarHBondContact O-N 3.36Å |
| 105 | F | 82 | Confident | 79.2 | Confident | 98 Ų | 98 | 68.7 Ų | 68.7 | 43% | 0.43 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -67.5 | -44.8 | 172.2 | -87.4 | -73.2 | 0 | 0 | 0 | 112.6 | V101 F102 F103 G108 G109 F124 A125 L128 | V101-F105 HydrophobicContact CG1-CD2 3.83Å; V101-F105 HydrophobicContact CG1-CE2 3.75Å; V101-F105 VanDerWaalsContact O-CD2 3.28Å; V101-F105 WeakPolarHBondContact O-CD2 3.13Å; V101-F105 PolarHBondContact O-N 2.92Å; F102-F105 PolarHBondContact O-N 3.12Å; F103-F105 VanDerWaalsContact C-N 3.35Å; F103-F105 PolarHBondContact O-N 3.5Å; F105-G108 PolarHBondContact O-N 3.16Å; F105-G109 PolarHBondContact O-N 2.9Å; F105-F124 HydrophobicContact CD1-CD1 4.26Å; F105-F124 HydrophobicContact CD2-CD1 4.01Å; F105-F124 AromaticContact CD2-CE1 3.65Å; F105-F124 HydrophobicContact CD2-CE1 3.65Å; F105-F124 HydrophobicContact CE1-CD1 4.34Å; F105-F124 HydrophobicContact CE2-CD1 4.08Å; F105-F124 AromaticContact CE2-CE1 3.65Å; F105-F124 HydrophobicContact CE2-CE1 3.65Å; F105-F124 HydrophobicContact CG-CD1 4.1Å; F105-F124 HydrophobicContact CG-CE1 4.21Å; F105-F124 HydrophobicContact CZ-CD1 4.27Å; F105-F124 HydrophobicContact CZ-CE1 4.21Å; F105-A125 HydrophobicContact CE1-CB 4.43Å; F105-L128 HydrophobicContact CE1-CD1 4.06Å; F105-L128 HydrophobicContact CE2-CD1 3.48Å; F105-L128 VanDerWaalsContact CE2-CD1 3.48Å; F105-L128 HydrophobicContact CZ-CD1 3.16Å |
| 106 | F | 82.4 | Confident | 77.6 | Confident | 85 Ų | 85 | 78 Ų | 78 | 37% | 0.373 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -63.2 | -44.4 | -179.7 | -168.3 | -97.1 | 0 | 0 | 0 | 111.5 | F102 F103 G109 I110 I111 | F102-F106 PolarHBondContact O-N 2.92Å; F103-F106 PolarHBondContact O-N 3.32Å; F106-G109 PolarHBondContact O-N 3.33Å; F106-I110 HydrophobicContact CD2-CB 4.38Å; F106-I110 HydrophobicContact CD2-CD1 3.55Å; F106-I110 HydrophobicContact CD2-CG1 4.5Å; F106-I110 HydrophobicContact CE2-CB 4.17Å; F106-I110 HydrophobicContact CE2-CD1 3.55Å; F106-I110 HydrophobicContact CE2-CG1 4.46Å; F106-I110 HydrophobicContact CE2-CG2 4.06Å; F106-I110 HydrophobicContact CZ-CB 4.37Å; F106-I110 HydrophobicContact CZ-CG2 4.01Å; F106-I110 PolarHBondContact O-N 3.13Å; F106-I111 HydrophobicContact CD1-CD1 3.72Å; F106-I111 HydrophobicContact CD1-CG1 3.94Å; F106-I111 HydrophobicContact CE1-CD1 3.8Å; F106-I111 HydrophobicContact CE1-CG1 3.76Å |
| 107 | W | 76.3 | Confident | 75.7 | Confident | 94 Ų | 94 | 81.3 Ų | 81.3 | 36% | 0.356 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -65.3 | -42.6 | 174.1 | -170.3 | -90 | 0 | 0 | 0 | 112.2 | F103 G109 I111 W112 L115 | F103-W107 HydrophobicContact CZ-CE3 4.06Å; F103-W107 VanDerWaalsContact O-CB 3.31Å; F103-W107 WeakPolarHBondContact O-CB 3.32Å; F103-W107 PolarHBondContact O-N 3.5Å; W107-G109 VanDerWaalsContact C-N 3.3Å; W107-G109 PolarHBondContact O-N 2.96Å; W107-I111 HydrophobicContact CD2-CD1 4.25Å; W107-I111 HydrophobicContact CE3-CD1 3.44Å; W107-I111 VanDerWaalsContact CE3-CD1 3.44Å; W107-I111 HydrophobicContact CZ3-CD1 3.9Å; W107-I111 HydrophobicContact CZ3-CG2 4.38Å; W107-W112 PolarHBondContact O-NE1 3.44Å; W107-L115 HydrophobicContact CH2-CD1 3.91Å; W107-L115 HydrophobicContact CZ2-CD1 3.79Å |
| 108 | G | 72.1 | Confident | 74.1 | Confident | 9 Ų | 9 | 86.1 Ų | 86.1 | 9% | 0.093 | 43% | 0.425 | C | S | . | . | H | α-helix | trans | -70.2 | -18.1 | 179.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | S104 F105 W112 F122 | S104-G108 PolarHBondContact O-N 3.36Å; F105-G108 PolarHBondContact O-N 3.16Å; G108-W112 PolarHBondContact O-NE1 2.9Å; G108-F122 PolarHBondContact O-N 2.96Å |
| 109 | G | 70.1 | Confident | 72.5 | Confident | 34 Ų | 34 | 90.8 Ų | 90.8 | 35% | 0.351 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -118.1 | -46.2 | -175.6 | 0 | 0 | 0 | 0 | 0 | 116.8 | F105 F106 W107 | F105-G109 PolarHBondContact O-N 2.9Å; F106-G109 PolarHBondContact O-N 3.33Å; W107-G109 VanDerWaalsContact C-N 3.3Å; W107-G109 PolarHBondContact O-N 2.96Å |
| 110 | I | 67.8 | Low | 70.9 | Confident | 105 Ų | 105 | 87.3 Ų | 87.3 | 54% | 0.538 | 42% | 0.416 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -104.5 | -31 | -160.2 | -66.7 | 164.4 | 0 | 0 | 0 | 113.9 | F106 W112 P113 | F106-I110 HydrophobicContact CD2-CB 4.38Å; F106-I110 HydrophobicContact CD2-CD1 3.55Å; F106-I110 HydrophobicContact CD2-CG1 4.5Å; F106-I110 HydrophobicContact CE2-CB 4.17Å; F106-I110 HydrophobicContact CE2-CD1 3.55Å; F106-I110 HydrophobicContact CE2-CG1 4.46Å; F106-I110 HydrophobicContact CE2-CG2 4.06Å; F106-I110 HydrophobicContact CZ-CB 4.37Å; F106-I110 HydrophobicContact CZ-CG2 4.01Å; F106-I110 PolarHBondContact O-N 3.13Å; I110-W112 VanDerWaalsContact C-N 3.28Å; I110-W112 PolarHBondContact O-N 3.35Å; I110-P113 WeakPolarHBondContact O-CD 3.31Å |
| 111 | I | 66.6 | Low | 69.4 | Low | 37 Ų | 37 | 92.4 Ų | 92.4 | 19% | 0.19 | 44% | 0.436 | C | S | . | . | S | Bend | trans | -77.8 | -12.2 | -168.4 | -62.4 | -179.5 | 0 | 0 | 0 | 113.4 | F106 W107 F114 L115 | F106-I111 HydrophobicContact CD1-CD1 3.72Å; F106-I111 HydrophobicContact CD1-CG1 3.94Å; F106-I111 HydrophobicContact CE1-CD1 3.8Å; F106-I111 HydrophobicContact CE1-CG1 3.76Å; W107-I111 HydrophobicContact CD2-CD1 4.25Å; W107-I111 HydrophobicContact CE3-CD1 3.44Å; W107-I111 VanDerWaalsContact CE3-CD1 3.44Å; W107-I111 HydrophobicContact CZ3-CD1 3.9Å; W107-I111 HydrophobicContact CZ3-CG2 4.38Å; I111-F114 PolarHBondContact O-N 2.95Å; I111-F114 VanDerWaalsContact O-N 3.16Å; I111-L115 HydrophobicContact CG2-CD1 3.59Å; I111-L115 HydrophobicContact CG2-CG 4.01Å |
| 112 | W | 60.5 | Low | 68.3 | Low | 9 Ų | 9 | 95.7 Ų | 95.7 | 3% | 0.034 | 45% | 0.446 | C | S | . | . | G | 310 helix | trans | -63.3 | -27 | -170.7 | -58.5 | 98.5 | 0 | 0 | 0 | 118.3 | W107 G108 I110 F114 L115 Q117 Q118 M120 Y121 | W107-W112 PolarHBondContact O-NE1 3.44Å; G108-W112 PolarHBondContact O-NE1 2.9Å; I110-W112 VanDerWaalsContact C-N 3.28Å; I110-W112 PolarHBondContact O-N 3.35Å; W112-F114 PolarHBondContact O-N 2.92Å; W112-F114 VanDerWaalsContact O-N 3.16Å; W112-L115 PolarHBondContact O-N 2.94Å; W112-Q117 WeakPolarHBondContact CZ3-O 3.36Å; W112-Q118 HydrophobicContact CB-CG 4.39Å; W112-Q118 VanDerWaalsContact CE3-CA 3.49Å; W112-Q118 HydrophobicContact CE3-CB 3.88Å; W112-Q118 HydrophobicContact CE3-CG 3.85Å; W112-Q118 VanDerWaalsContact CZ3-CA 3.41Å; W112-Q118 HydrophobicContact CZ3-CB 4.28Å; W112-Q118 PolarHBondContact O-NE2 2.69Å; W112-M120 VanDerWaalsContact CH2-C 3.47Å; W112-M120 HydrophobicContact CH2-CB 3.57Å; W112-M120 HydrophobicContact CH2-CG 4.33Å; W112-M120 VanDerWaalsContact CH2-N 3.27Å; W112-M120 HydrophobicContact CZ2-CB 3.84Å; W112-M120 WeakPolarHBondContact CZ2-O 3.21Å; W112-Y121 HydrophobicContact CB-CD2 4.25Å; W112-Y121 AromaticContact CD1-CD2 3.38Å; W112-Y121 AromaticContact CD1-CE2 3.9Å; W112-Y121 HydrophobicContact CD2-CD2 4.08Å; W112-Y121 AromaticContact CG-CD2 3.63Å; W112-Y121 HydrophobicContact CG-CD2 3.63Å; W112-Y121 HydrophobicContact CG-CE2 4.33Å; W112-Y121 AromaticContact NE1-CD2 3.56Å |
| 113 | P | 65.7 | Low | 67.3 | Low | 105 Ų | 105 | 89.9 Ų | 89.9 | 68% | 0.682 | 42% | 0.422 | S | S | * | . | G | 310 helix | trans | -62.4 | -19 | 174 | -21.1 | 32.9 | 0 | 0 | 0 | 113.3 | I110 | I110-P113 WeakPolarHBondContact O-CD 3.31Š|
| 114 | F | 64 | Low | 66.6 | Low | 182 Ų | 182 | 85.9 Ų | 85.9 | 80% | 0.798 | 41% | 0.405 | S | S | * | . | G | 310 helix | trans | -107 | -7.8 | -173.9 | -56.8 | -77 | 0 | 0 | 0 | 114 | I111 W112 | I111-F114 PolarHBondContact O-N 2.95Å; I111-F114 VanDerWaalsContact O-N 3.16Å; W112-F114 PolarHBondContact O-N 2.92Å; W112-F114 VanDerWaalsContact O-N 3.16Å |
| 115 | L | 63.6 | Low | 66 | Low | 69 Ų | 69 | 86 Ų | 86 | 36% | 0.361 | 41% | 0.407 | S | S | . | . | trans | -109.5 | 130.9 | -177.9 | -69.8 | 173.9 | 0 | 0 | 0 | 111.4 | W107 I111 W112 Q117 | W107-L115 HydrophobicContact CH2-CD1 3.91Å; W107-L115 HydrophobicContact CZ2-CD1 3.79Å; I111-L115 HydrophobicContact CG2-CD1 3.59Å; I111-L115 HydrophobicContact CG2-CG 4.01Å; W112-L115 PolarHBondContact O-N 2.94Å; L115-Q117 PolarHBondContact O-N 3.14Å; L115-Q117 VanDerWaalsContact O-N 3.14Å | ||
| 116 | K | 56.8 | Low | 65.4 | Low | 227 Ų | 227 | 83.3 Ų | 83.3 | 99% | 0.987 | 40% | 0.396 | S | S | * | . | S | Bend | trans | -67.7 | -9.4 | -178 | -69 | -171.9 | 176.8 | -175.5 | 0 | 114.9 | ||
| 117 | Q | 54.2 | Low | 65 | Low | 122 Ų | 122 | 79.3 Ų | 79.3 | 57% | 0.57 | 38% | 0.378 | S | S | * | . | trans | -133.8 | 93.6 | -171.4 | -165.8 | 142.8 | -17.5 | 0 | 0 | 112.1 | W112 L115 R119 | W112-Q117 WeakPolarHBondContact CZ3-O 3.36Å; L115-Q117 PolarHBondContact O-N 3.14Å; L115-Q117 VanDerWaalsContact O-N 3.14Å; Q117-R119 VanDerWaalsContact C-N 3.29Å; Q117-R119 HydrophobicContact CG-CG 3.85Å; Q117-R119 PolarHBondContact O-N 3.32Å | ||
| 118 | Q | 56.3 | Low | 64.9 | Low | 114 Ų | 114 | 76.4 Ų | 76.4 | 53% | 0.533 | 37% | 0.37 | S | S | . | . | trans | -84 | 46.3 | -173.5 | -59.7 | -159.9 | -18.3 | 0 | 0 | 115.3 | W112 | W112-Q118 HydrophobicContact CB-CG 4.39Å; W112-Q118 VanDerWaalsContact CE3-CA 3.49Å; W112-Q118 HydrophobicContact CE3-CB 3.88Å; W112-Q118 HydrophobicContact CE3-CG 3.85Å; W112-Q118 VanDerWaalsContact CZ3-CA 3.41Å; W112-Q118 HydrophobicContact CZ3-CB 4.28Å; W112-Q118 PolarHBondContact O-NE2 2.69Å | ||
| 119 | R | 56.6 | Low | 65 | Low | 158 Ų | 158 | 80.4 Ų | 80.4 | 60% | 0.596 | 40% | 0.396 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -86.4 | -12.2 | -170.7 | -66.1 | -163.9 | 179.3 | -158.3 | -2.2 | 116.4 | W60 Q117 | W60-R119 HydrophobicContact CZ2-CB 4.48Å; Q117-R119 VanDerWaalsContact C-N 3.29Å; Q117-R119 HydrophobicContact CG-CG 3.85Å; Q117-R119 PolarHBondContact O-N 3.32Å |
| 120 | M | 58.5 | Low | 65.4 | Low | 62 Ų | 62 | 79 Ų | 79 | 31% | 0.305 | 38% | 0.381 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -114.7 | 14.2 | 176.5 | -46.9 | 170.2 | 170.7 | 0 | 0 | 113.2 | W60 W112 F122 V123 | W60-M120 HydrophobicContact CB-CG 4.22Å; W60-M120 HydrophobicContact CD2-CE 4.08Å; W60-M120 HydrophobicContact CD2-CG 4.16Å; W60-M120 HydrophobicContact CE3-CE 3.17Å; W60-M120 HydrophobicContact CE3-CG 4.16Å; W60-M120 HydrophobicContact CE3-SD 4.48Å; W60-M120 HydrophobicContact CG-CG 4.23Å; W60-M120 HydrophobicContact CH2-CE 4.19Å; W60-M120 HydrophobicContact CZ3-CE 3.23Å; W112-M120 VanDerWaalsContact CH2-C 3.47Å; W112-M120 HydrophobicContact CH2-CB 3.57Å; W112-M120 HydrophobicContact CH2-CG 4.33Å; W112-M120 VanDerWaalsContact CH2-N 3.27Å; W112-M120 HydrophobicContact CZ2-CB 3.84Å; W112-M120 WeakPolarHBondContact CZ2-O 3.21Å; M120-F122 PolarHBondContact O-N 3.39Å; M120-V123 HydrophobicContact CB-CG2 4.5Å; M120-V123 PolarHBondContact O-N 2.98Å |
| 121 | Y | 58.9 | Low | 66 | Low | 131 Ų | 131 | 79.1 Ų | 79.1 | 51% | 0.514 | 39% | 0.386 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -57.9 | 124.4 | -178.4 | -177.7 | -102.3 | 0 | 0 | 0 | 110.2 | W112 V123 | W112-Y121 HydrophobicContact CB-CD2 4.25Å; W112-Y121 AromaticContact CD1-CD2 3.38Å; W112-Y121 AromaticContact CD1-CE2 3.9Å; W112-Y121 HydrophobicContact CD2-CD2 4.08Å; W112-Y121 AromaticContact CG-CD2 3.63Å; W112-Y121 HydrophobicContact CG-CD2 3.63Å; W112-Y121 HydrophobicContact CG-CE2 4.33Å; W112-Y121 AromaticContact NE1-CD2 3.56Å; Y121-V123 PolarHBondContact O-N 3.37Å |
| 122 | F | 64.5 | Low | 66.7 | Low | 117 Ų | 117 | 79.9 Ų | 79.9 | 51% | 0.513 | 40% | 0.395 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 61.5 | 4.1 | 179 | -146 | -104.8 | 0 | 0 | 0 | 116.8 | G108 M120 F124 A125 Q126 | G108-F122 PolarHBondContact O-N 2.96Å; M120-F122 PolarHBondContact O-N 3.39Å; F122-F124 VanDerWaalsContact C-N 3.33Å; F122-F124 PolarHBondContact O-N 3.3Å; F122-A125 HydrophobicContact CD1-CB 3.97Å; F122-A125 HydrophobicContact CD2-CB 3.92Å; F122-A125 HydrophobicContact CE1-CB 3.79Å; F122-A125 HydrophobicContact CE2-CB 3.73Å; F122-A125 HydrophobicContact CG-CB 4.04Å; F122-A125 HydrophobicContact CZ-CB 3.67Å; F122-A125 PolarHBondContact O-N 3.44Å; F122-Q126 WeakPolarHBondContact O-CB 3.42Å; F122-Q126 PolarHBondContact O-N 3.42Å |
| 123 | V | 67 | Low | 67.6 | Low | 15 Ų | 15 | 79.4 Ų | 79.4 | 9% | 0.091 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -61.9 | -40.2 | -178.1 | 169.2 | 0 | 0 | 0 | 0 | 112 | T61 M120 Y121 M127 | T61-V123 HydrophobicContact CG2-CG1 3.99Å; T61-V123 WeakPolarHBondContact OG1-CG1 3.33Å; M120-V123 HydrophobicContact CB-CG2 4.5Å; M120-V123 PolarHBondContact O-N 2.98Å; Y121-V123 PolarHBondContact O-N 3.37Å; V123-M127 WeakPolarHBondContact O-CB 3.1Å; V123-M127 PolarHBondContact O-N 3.37Å |
| 124 | F | 69.6 | Low | 68.5 | Low | 11 Ų | 11 | 79 Ų | 79 | 5% | 0.048 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -67 | -42.9 | 177.9 | -168.7 | -108.8 | 0 | 0 | 0 | 111.7 | T64 V101 F105 F122 Q126 M127 L128 | T64-F124 HydrophobicContact CG2-CD2 3.73Å; T64-F124 HydrophobicContact CG2-CE2 4.44Å; V101-F124 HydrophobicContact CG1-CE1 4.42Å; F105-F124 HydrophobicContact CD1-CD1 4.26Å; F105-F124 HydrophobicContact CD2-CD1 4.01Å; F105-F124 AromaticContact CD2-CE1 3.65Å; F105-F124 HydrophobicContact CD2-CE1 3.65Å; F105-F124 HydrophobicContact CE1-CD1 4.34Å; F105-F124 HydrophobicContact CE2-CD1 4.08Å; F105-F124 AromaticContact CE2-CE1 3.65Å; F105-F124 HydrophobicContact CE2-CE1 3.65Å; F105-F124 HydrophobicContact CG-CD1 4.1Å; F105-F124 HydrophobicContact CG-CE1 4.21Å; F105-F124 HydrophobicContact CZ-CD1 4.27Å; F105-F124 HydrophobicContact CZ-CE1 4.21Å; F122-F124 VanDerWaalsContact C-N 3.33Å; F122-F124 PolarHBondContact O-N 3.3Å; F124-Q126 PolarHBondContact O-N 3.47Å; F124-M127 HydrophobicContact CD2-CE 3.86Å; F124-M127 HydrophobicContact CE2-CE 3.73Å; F124-M127 WeakPolarHBondContact O-CB 3.13Å; F124-M127 PolarHBondContact O-N 2.96Å; F124-L128 HydrophobicContact CD1-CD1 3.69Å; F124-L128 HydrophobicContact CD1-CG 4.4Å; F124-L128 HydrophobicContact CE1-CD1 3.42Å; F124-L128 VanDerWaalsContact CE1-CD1 3.42Å; F124-L128 HydrophobicContact CE1-CG 4.26Å; F124-L128 HydrophobicContact CG-CD1 4.47Å; F124-L128 HydrophobicContact CZ-CD1 3.99Å; F124-L128 HydrophobicContact CZ-CD2 4.32Å; F124-L128 HydrophobicContact CZ-CG 4.45Å; F124-L128 VanDerWaalsContact O-CG 3.27Å; F124-L128 WeakPolarHBondContact O-CG 3.37Å; F124-L128 PolarHBondContact O-N 3.08Å |
| 125 | A | 71.6 | Confident | 69.5 | Low | 23 Ų | 23 | 75.8 Ų | 75.8 | 19% | 0.19 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -65.1 | -40.6 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | F105 F122 L128 S129 | F105-A125 HydrophobicContact CE1-CB 4.43Å; F122-A125 HydrophobicContact CD1-CB 3.97Å; F122-A125 HydrophobicContact CD2-CB 3.92Å; F122-A125 HydrophobicContact CE1-CB 3.79Å; F122-A125 HydrophobicContact CE2-CB 3.73Å; F122-A125 HydrophobicContact CG-CB 4.04Å; F122-A125 HydrophobicContact CZ-CB 3.67Å; F122-A125 PolarHBondContact O-N 3.44Å; A125-L128 PolarHBondContact O-N 2.89Å; A125-S129 PolarHBondContact O-N 2.71Å |
| 126 | Q | 71.3 | Confident | 70.5 | Confident | 40 Ų | 40 | 73.2 Ų | 73.2 | 19% | 0.187 | 36% | 0.357 | C | S | . | . | H | α-helix | trans | -64.3 | -42.5 | 176.4 | -164 | 173.7 | -13.2 | 0 | 0 | 111.9 | E51 F122 F124 L128 S129 | E51-Q126 VanDerWaalsContact CD-NE2 3.34Å; E51-Q126 WeakPolarHBondContact OE1-CG 3.41Å; E51-Q126 PolarHBondContact OE1-NE2 3.16Å; E51-Q126 PolarHBondContact OE2-NE2 2.89Å; F122-Q126 WeakPolarHBondContact O-CB 3.42Å; F122-Q126 PolarHBondContact O-N 3.42Å; F124-Q126 PolarHBondContact O-N 3.47Å; Q126-L128 PolarHBondContact O-N 3.43Å; Q126-S129 WeakPolarHBondContact O-CB 3.37Å; Q126-S129 PolarHBondContact O-N 2.97Å |
| 127 | M | 73.4 | Confident | 72 | Confident | 1 Ų | 1 | 62.7 Ų | 62.7 | 1% | 0.005 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -58.6 | -46.1 | 173.7 | -176.6 | -165 | 80.3 | 0 | 0 | 111.9 | T61 T64 I65 T68 V123 F124 S129 S130 T133 | T61-M127 HydrophobicContact CG2-CB 4.37Å; T64-M127 HydrophobicContact CG2-SD 3.97Å; I65-M127 HydrophobicContact CB-SD 4.29Å; I65-M127 HydrophobicContact CD1-CG 4.21Å; I65-M127 HydrophobicContact CG1-CG 3.63Å; I65-M127 HydrophobicContact CG1-SD 3.41Å; I65-M127 WeakPolarHBondContact CG1-SD 3.24Å; T68-M127 HydrophobicContact CG2-CE 4.36Å; V123-M127 WeakPolarHBondContact O-CB 3.1Å; V123-M127 PolarHBondContact O-N 3.37Å; F124-M127 HydrophobicContact CD2-CE 3.86Å; F124-M127 HydrophobicContact CE2-CE 3.73Å; F124-M127 WeakPolarHBondContact O-CB 3.13Å; F124-M127 PolarHBondContact O-N 2.96Å; M127-S129 VanDerWaalsContact C-N 3.25Å; M127-S129 PolarHBondContact O-N 3.3Å; M127-S130 PolarHBondContact O-N 3.15Å; M127-T133 HydrophobicContact CG-CG2 3.79Å |
| 128 | L | 73.1 | Confident | 73.6 | Confident | 34 Ų | 34 | 61.8 Ų | 61.8 | 18% | 0.178 | 31% | 0.31 | C | S | . | . | H | α-helix | trans | -71.1 | -20 | -179.4 | -62.1 | 172.7 | 0 | 0 | 0 | 113.2 | F105 F124 A125 Q126 S130 W134 | F105-L128 HydrophobicContact CE1-CD1 4.06Å; F105-L128 HydrophobicContact CE2-CD1 3.48Å; F105-L128 VanDerWaalsContact CE2-CD1 3.48Å; F105-L128 HydrophobicContact CZ-CD1 3.16Å; F124-L128 HydrophobicContact CD1-CD1 3.69Å; F124-L128 HydrophobicContact CD1-CG 4.4Å; F124-L128 HydrophobicContact CE1-CD1 3.42Å; F124-L128 VanDerWaalsContact CE1-CD1 3.42Å; F124-L128 HydrophobicContact CE1-CG 4.26Å; F124-L128 HydrophobicContact CG-CD1 4.47Å; F124-L128 HydrophobicContact CZ-CD1 3.99Å; F124-L128 HydrophobicContact CZ-CD2 4.32Å; F124-L128 HydrophobicContact CZ-CG 4.45Å; F124-L128 VanDerWaalsContact O-CG 3.27Å; F124-L128 WeakPolarHBondContact O-CG 3.37Å; F124-L128 PolarHBondContact O-N 3.08Å; A125-L128 PolarHBondContact O-N 2.89Å; Q126-L128 PolarHBondContact O-N 3.43Å; L128-S130 VanDerWaalsContact C-N 3.28Å; L128-W134 HydrophobicContact CB-CZ2 4.26Å; L128-W134 HydrophobicContact CD2-CH2 3.65Å; L128-W134 HydrophobicContact CD2-CZ2 3.12Å; L128-W134 HydrophobicContact CG-CZ2 4.18Å; L128-W134 PolarHBondContact O-NE1 3.25Å |
| 129 | S | 76 | Confident | 75.2 | Confident | 92 Ų | 92 | 61.3 Ų | 61.3 | 64% | 0.643 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -73.3 | -21.1 | 176.9 | -167.4 | 0 | 0 | 0 | 0 | 112.8 | A125 Q126 M127 | A125-S129 PolarHBondContact O-N 2.71Å; Q126-S129 WeakPolarHBondContact O-CB 3.37Å; Q126-S129 PolarHBondContact O-N 2.97Å; M127-S129 VanDerWaalsContact C-N 3.25Å; M127-S129 PolarHBondContact O-N 3.3Å |
| 130 | S | 78.5 | Confident | 76.7 | Confident | 5 Ų | 5 | 54.4 Ų | 54.4 | 4% | 0.035 | 29% | 0.285 | C | S | . | . | trans | -89.6 | 111.4 | -178.5 | 171.1 | 0 | 0 | 0 | 0 | 111.5 | L50 Y57 M127 L128 S132 T133 W134 | L50-S130 WeakPolarHBondContact O-CB 3.39Å; L50-S130 PolarHBondContact O-OG 3.2Å; Y57-S130 WeakPolarHBondContact OH-CB 3.39Å; M127-S130 PolarHBondContact O-N 3.15Å; L128-S130 VanDerWaalsContact C-N 3.28Å; S130-S132 VanDerWaalsContact C-N 3.28Å; S130-S132 PolarHBondContact O-N 2.89Å; S130-T133 VanDerWaalsContact CB-OG1 3.31Å; S130-T133 WeakPolarHBondContact CB-OG1 3.48Å; S130-T133 WeakPolarHBondContact O-CB 3.28Å; S130-T133 PolarHBondContact O-N 3.07Å; S130-T133 VanDerWaalsContact O-N 3.16Å; S130-T133 PolarHBondContact OG-N 3.36Å; S130-T133 PolarHBondContact OG-OG1 3.23Å; S130-W134 PolarHBondContact O-N 2.76Å | ||
| 131 | V | 80.1 | Confident | 78.3 | Confident | 107 Ų | 107 | 52.2 Ų | 52.2 | 65% | 0.648 | 27% | 0.274 | S | S | * | . | H | α-helix | trans | -60.6 | -37.7 | 175.6 | 178.6 | 0 | 0 | 0 | 0 | 111.7 | T133 W134 L135 | V131-T133 VanDerWaalsContact C-N 3.27Å; V131-T133 PolarHBondContact O-N 2.99Å; V131-W134 WeakPolarHBondContact O-CB 3.36Å; V131-W134 PolarHBondContact O-N 2.95Å; V131-L135 HydrophobicContact CG1-CD1 4.36Å; V131-L135 HydrophobicContact CG1-CG 4.48Å; V131-L135 PolarHBondContact O-N 3.18Å |
| 132 | S | 79.6 | Confident | 79.7 | Confident | 53 Ų | 53 | 52.1 Ų | 52.1 | 37% | 0.371 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -59.7 | -40 | 176.9 | -173.7 | 0 | 0 | 0 | 0 | 111.7 | L50 S130 W134 L135 A136 | L50-S132 WeakPolarHBondContact CD2-OG 3.41Å; S130-S132 VanDerWaalsContact C-N 3.28Å; S130-S132 PolarHBondContact O-N 2.89Å; S132-W134 PolarHBondContact O-N 3.45Å; S132-L135 PolarHBondContact O-N 3.32Å; S132-A136 WeakPolarHBondContact O-CB 3.46Å; S132-A136 PolarHBondContact O-N 3.45Å |
| 133 | T | 80.5 | Confident | 80.9 | Confident | 0 Ų | 0 | 50 Ų | 50 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -65 | -40.8 | 177.3 | -55 | 0 | 0 | 0 | 0 | 111.6 | I65 M127 S130 V131 A136 I137 | I65-T133 HydrophobicContact CD1-CG2 3.87Å; I65-T133 HydrophobicContact CG1-CG2 4.02Å; M127-T133 HydrophobicContact CG-CG2 3.79Å; S130-T133 VanDerWaalsContact CB-OG1 3.31Å; S130-T133 WeakPolarHBondContact CB-OG1 3.48Å; S130-T133 WeakPolarHBondContact O-CB 3.28Å; S130-T133 PolarHBondContact O-N 3.07Å; S130-T133 VanDerWaalsContact O-N 3.16Å; S130-T133 PolarHBondContact OG-N 3.36Å; S130-T133 PolarHBondContact OG-OG1 3.23Å; V131-T133 VanDerWaalsContact C-N 3.27Å; V131-T133 PolarHBondContact O-N 2.99Å; T133-A136 PolarHBondContact O-N 3.06Å; T133-I137 HydrophobicContact CG2-CD1 3.99Å; T133-I137 WeakPolarHBondContact O-CG1 3.22Å; T133-I137 PolarHBondContact O-N 3.32Å |
| 134 | W | 83.5 | Confident | 81.9 | Confident | 97 Ų | 97 | 49.3 Ų | 49.3 | 37% | 0.367 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -63.4 | -44.7 | 174.8 | -79.2 | 103.9 | 0 | 0 | 0 | 113.4 | L128 S130 V131 S132 A136 I137 I138 | L128-W134 HydrophobicContact CB-CZ2 4.26Å; L128-W134 HydrophobicContact CD2-CH2 3.65Å; L128-W134 HydrophobicContact CD2-CZ2 3.12Å; L128-W134 HydrophobicContact CG-CZ2 4.18Å; L128-W134 PolarHBondContact O-NE1 3.25Å; S130-W134 PolarHBondContact O-N 2.76Å; V131-W134 WeakPolarHBondContact O-CB 3.36Å; V131-W134 PolarHBondContact O-N 2.95Å; S132-W134 PolarHBondContact O-N 3.45Å; W134-A136 VanDerWaalsContact C-N 3.29Å; W134-A136 PolarHBondContact O-N 2.76Å; W134-I137 PolarHBondContact O-N 3.02Å; W134-I138 WeakPolarHBondContact O-CG1 3.34Å; W134-I138 PolarHBondContact O-N 2.95Å |
| 135 | L | 85.6 | Confident | 82.8 | Confident | 114 Ų | 114 | 49.4 Ų | 49.4 | 60% | 0.597 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -60.6 | -42.3 | 176.6 | -69.8 | 175.5 | 0 | 0 | 0 | 111 | V131 S132 I138 L139 | V131-L135 HydrophobicContact CG1-CD1 4.36Å; V131-L135 HydrophobicContact CG1-CG 4.48Å; V131-L135 PolarHBondContact O-N 3.18Å; S132-L135 PolarHBondContact O-N 3.32Å; L135-I138 PolarHBondContact O-N 2.96Å; L135-L139 VanDerWaalsContact O-CB 3.27Å; L135-L139 WeakPolarHBondContact O-CB 3.47Å; L135-L139 PolarHBondContact O-N 3.45Å |
| 136 | A | 85.3 | Confident | 83.6 | Confident | 15 Ų | 15 | 53.6 Ų | 53.6 | 12% | 0.124 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -63.9 | -43.3 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | L44 S132 T133 W134 I138 L139 L140 | L44-A136 HydrophobicContact CD1-CB 3.46Å; L44-A136 VanDerWaalsContact CD1-CB 3.46Å; L44-A136 HydrophobicContact CD2-CB 3.58Å; L44-A136 HydrophobicContact CG-CB 4.09Å; S132-A136 WeakPolarHBondContact O-CB 3.46Å; S132-A136 PolarHBondContact O-N 3.45Å; T133-A136 PolarHBondContact O-N 3.06Å; W134-A136 VanDerWaalsContact C-N 3.29Å; W134-A136 PolarHBondContact O-N 2.76Å; A136-I138 PolarHBondContact O-N 2.99Å; A136-L139 PolarHBondContact O-N 3.46Å; A136-L140 WeakPolarHBondContact O-CB 3.36Å; A136-L140 WeakPolarHBondContact O-CG 3.37Å; A136-L140 PolarHBondContact O-N 3.21Å |
| 137 | I | 87.3 | Confident | 84.3 | Confident | 5 Ų | 5 | 53 Ų | 53 | 3% | 0.026 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -58.6 | -49.6 | 175.7 | -71.6 | 164.2 | 0 | 0 | 0 | 110.6 | I65 T68 V69 T133 W134 L139 L140 I141 | I65-I137 HydrophobicContact CG2-CG1 4.31Å; T68-I137 HydrophobicContact CG2-CD1 4.33Å; V69-I137 HydrophobicContact CG2-CB 4.21Å; V69-I137 HydrophobicContact CG2-CG1 3.86Å; V69-I137 HydrophobicContact CG2-CG2 4.07Å; T133-I137 HydrophobicContact CG2-CD1 3.99Å; T133-I137 WeakPolarHBondContact O-CG1 3.22Å; T133-I137 PolarHBondContact O-N 3.32Å; W134-I137 PolarHBondContact O-N 3.02Å; I137-L139 VanDerWaalsContact C-N 3.34Å; I137-L139 PolarHBondContact O-N 2.92Å; I137-L140 PolarHBondContact O-N 3.42Å; I137-I141 HydrophobicContact CG2-CD1 3.74Å; I137-I141 WeakPolarHBondContact O-CD1 3.45Å; I137-I141 VanDerWaalsContact O-CG1 3.24Å; I137-I141 WeakPolarHBondContact O-CG1 3.46Å; I137-I141 PolarHBondContact O-N 3.15Å |
| 138 | I | 88.7 | Confident | 84.8 | Confident | 104 Ų | 104 | 53.2 Ų | 53.2 | 53% | 0.533 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -61.1 | -44.3 | 179.3 | -68.2 | 161.1 | 0 | 0 | 0 | 110.7 | W134 L135 A136 I141 F142 | W134-I138 WeakPolarHBondContact O-CG1 3.34Å; W134-I138 PolarHBondContact O-N 2.95Å; L135-I138 PolarHBondContact O-N 2.96Å; A136-I138 PolarHBondContact O-N 2.99Å; I138-I141 PolarHBondContact O-N 3.48Å; I138-F142 PolarHBondContact O-N 2.72Å |
| 139 | L | 88.9 | Confident | 85.4 | Confident | 103 Ų | 103 | 54.8 Ų | 54.8 | 54% | 0.539 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -62 | -44.6 | 177.8 | -177.2 | 67.7 | 0 | 0 | 0 | 111.5 | L135 A136 I137 F142 I143 | L135-L139 VanDerWaalsContact O-CB 3.27Å; L135-L139 WeakPolarHBondContact O-CB 3.47Å; L135-L139 PolarHBondContact O-N 3.45Å; A136-L139 PolarHBondContact O-N 3.46Å; I137-L139 VanDerWaalsContact C-N 3.34Å; I137-L139 PolarHBondContact O-N 2.92Å; L139-F142 PolarHBondContact O-N 3.15Å; L139-I143 HydrophobicContact CD1-CD1 4.14Å; L139-I143 HydrophobicContact CD1-CG1 4.45Å; L139-I143 HydrophobicContact CD2-CD1 4.41Å; L139-I143 HydrophobicContact CG-CD1 3.83Å; L139-I143 HydrophobicContact CG-CG1 4.48Å; L139-I143 VanDerWaalsContact O-CG1 3.31Å; L139-I143 WeakPolarHBondContact O-CG1 3.24Å; L139-I143 PolarHBondContact O-N 3.29Å |
| 140 | L | 89.4 | Confident | 86 | Confident | 13 Ų | 13 | 54.4 Ų | 54.4 | 7% | 0.068 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -64.5 | -41.6 | 178.8 | -71.6 | 175.4 | 0 | 0 | 0 | 112.1 | V36 T41 V69 A136 I137 F142 I143 S144 | V36-L140 HydrophobicContact CG1-CD2 4.28Å; T41-L140 HydrophobicContact CG2-CD1 3.93Å; V69-L140 HydrophobicContact CG1-CB 3.88Å; V69-L140 HydrophobicContact CG2-CB 4.42Å; V69-L140 HydrophobicContact CG2-CD1 4.14Å; A136-L140 WeakPolarHBondContact O-CB 3.36Å; A136-L140 WeakPolarHBondContact O-CG 3.37Å; A136-L140 PolarHBondContact O-N 3.21Å; I137-L140 PolarHBondContact O-N 3.42Å; L140-F142 VanDerWaalsContact C-N 3.31Å; L140-F142 PolarHBondContact O-N 2.91Å; L140-I143 PolarHBondContact O-N 3.11Å; L140-S144 WeakPolarHBondContact O-CB 3.17Å; L140-S144 PolarHBondContact O-N 3.4Å |
| 141 | I | 90.6 | Very high | 86.2 | Confident | 16 Ų | 16 | 56.5 Ų | 56.5 | 8% | 0.082 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -58.1 | -46.9 | 172.9 | -68.6 | 162.7 | 0 | 0 | 0 | 109.7 | V69 F72 L76 I137 I138 S144 L145 | V69-I141 HydrophobicContact CG1-CG1 4.3Å; F72-I141 HydrophobicContact CB-CD1 3.59Å; F72-I141 HydrophobicContact CB-CG1 4.22Å; F72-I141 HydrophobicContact CD1-CD1 4.31Å; F72-I141 HydrophobicContact CG-CD1 4.18Å; L76-I141 HydrophobicContact CD1-CG2 3.57Å; I137-I141 HydrophobicContact CG2-CD1 3.74Å; I137-I141 WeakPolarHBondContact O-CD1 3.45Å; I137-I141 VanDerWaalsContact O-CG1 3.24Å; I137-I141 WeakPolarHBondContact O-CG1 3.46Å; I137-I141 PolarHBondContact O-N 3.15Å; I138-I141 PolarHBondContact O-N 3.48Å; I141-S144 PolarHBondContact O-N 3.22Å; I141-L145 HydrophobicContact CG2-CD1 3.71Å; I141-L145 HydrophobicContact CG2-CG 4.37Å; I141-L145 WeakPolarHBondContact O-CB 3.28Å; I141-L145 VanDerWaalsContact O-CG 3.31Å; I141-L145 WeakPolarHBondContact O-CG 3.42Å; I141-L145 PolarHBondContact O-N 2.99Å |
| 142 | F | 89.6 | Confident | 86.4 | Confident | 130 Ų | 130 | 54 Ų | 54 | 57% | 0.57 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -64.2 | -46.8 | -178.7 | -168.6 | -93.2 | 0 | 0 | 0 | 112.4 | I138 L139 L140 S144 L145 F146 | I138-F142 PolarHBondContact O-N 2.72Å; L139-F142 PolarHBondContact O-N 3.15Å; L140-F142 VanDerWaalsContact C-N 3.31Å; L140-F142 PolarHBondContact O-N 2.91Å; F142-S144 VanDerWaalsContact C-N 3.27Å; F142-S144 PolarHBondContact O-N 3.46Å; F142-L145 PolarHBondContact O-N 2.9Å; F142-F146 HydrophobicContact CE1-CD2 4.42Å; F142-F146 WeakPolarHBondContact O-CB 3.31Å; F142-F146 PolarHBondContact O-N 2.9Å |
| 143 | I | 89.5 | Confident | 86.8 | Confident | 72 Ų | 72 | 55 Ų | 55 | 37% | 0.369 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -60.9 | -40.2 | 177 | -67.7 | 169 | 0 | 0 | 0 | 110.5 | V36 L139 L140 P147 | V36-I143 HydrophobicContact CG1-CG2 3.97Å; L139-I143 HydrophobicContact CD1-CD1 4.14Å; L139-I143 HydrophobicContact CD1-CG1 4.45Å; L139-I143 HydrophobicContact CD2-CD1 4.41Å; L139-I143 HydrophobicContact CG-CD1 3.83Å; L139-I143 HydrophobicContact CG-CG1 4.48Å; L139-I143 VanDerWaalsContact O-CG1 3.31Å; L139-I143 WeakPolarHBondContact O-CG1 3.24Å; L139-I143 PolarHBondContact O-N 3.29Å; L140-I143 PolarHBondContact O-N 3.11Å; I143-P147 WeakPolarHBondContact O-CD 3.26Å |
| 144 | S | 88.6 | Confident | 87 | Confident | 0 Ų | 0 | 59.8 Ų | 59.8 | 0% | 0 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -69 | -37.6 | 179.5 | -169.4 | 0 | 0 | 0 | 0 | 112.9 | E33 F37 L140 I141 F142 P147 | E33-S144 WeakPolarHBondContact CG-OG 3.34Å; F37-S144 VanDerWaalsContact CE1-OG 3.25Å; F37-S144 WeakPolarHBondContact CE1-OG 3.36Å; F37-S144 WeakPolarHBondContact CZ-OG 3.43Å; L140-S144 WeakPolarHBondContact O-CB 3.17Å; L140-S144 PolarHBondContact O-N 3.4Å; I141-S144 PolarHBondContact O-N 3.22Å; F142-S144 VanDerWaalsContact C-N 3.27Å; F142-S144 PolarHBondContact O-N 3.46Å; S144-P147 WeakPolarHBondContact O-CD 3.35Å; S144-P147 WeakPolarHBondContact O-CG 3.31Å |
| 145 | L | 88.1 | Confident | 87 | Confident | 13 Ų | 13 | 59.8 Ų | 59.8 | 7% | 0.068 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -82.1 | -20.3 | 179.3 | -67.8 | 175.6 | 0 | 0 | 0 | 113.1 | T73 L76 K77 L80 I141 F142 E148 I149 | T73-L145 HydrophobicContact CG2-CD2 3.89Å; T73-L145 HydrophobicContact CG2-CG 4.16Å; L76-L145 HydrophobicContact CB-CD1 3.93Å; L76-L145 HydrophobicContact CD1-CD1 4.28Å; K77-L145 HydrophobicContact CB-CD2 4.08Å; L80-L145 HydrophobicContact CD1-CD1 4.32Å; L80-L145 HydrophobicContact CD1-CD2 4.34Å; I141-L145 HydrophobicContact CG2-CD1 3.71Å; I141-L145 HydrophobicContact CG2-CG 4.37Å; I141-L145 WeakPolarHBondContact O-CB 3.28Å; I141-L145 VanDerWaalsContact O-CG 3.31Å; I141-L145 WeakPolarHBondContact O-CG 3.42Å; I141-L145 PolarHBondContact O-N 2.99Å; F142-L145 PolarHBondContact O-N 2.9Å; L145-E148 PolarHBondContact O-N 2.95Å; L145-E148 VanDerWaalsContact O-N 3.14Å; L145-I149 HydrophobicContact CB-CD1 4.16Å; L145-I149 WeakPolarHBondContact O-CG1 3.42Å; L145-I149 PolarHBondContact O-N 2.82Å |
| 146 | F | 88.1 | Confident | 86.9 | Confident | 111 Ų | 111 | 58 Ų | 58 | 49% | 0.487 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -50.4 | -51.7 | 180 | -173.9 | -99.4 | 0 | 0 | 0 | 114.8 | F142 E148 I149 L150 | F142-F146 HydrophobicContact CE1-CD2 4.42Å; F142-F146 WeakPolarHBondContact O-CB 3.31Å; F142-F146 PolarHBondContact O-N 2.9Å; F146-E148 VanDerWaalsContact C-N 3.25Å; F146-E148 PolarHBondContact O-N 3.35Å; F146-I149 PolarHBondContact O-N 2.81Å; F146-L150 WeakPolarHBondContact O-CB 3.49Å; F146-L150 PolarHBondContact O-N 2.94Å |
| 147 | P | 85.3 | Confident | 86.9 | Confident | 28 Ų | 28 | 61.6 Ų | 61.6 | 18% | 0.182 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -58.6 | -40.4 | 179.1 | 23.2 | -35.1 | 0 | 0 | 0 | 111.6 | L29 F32 I143 S144 L150 L151 | L29-P147 HydrophobicContact CD1-CB 4.15Å; L29-P147 HydrophobicContact CD1-CG 4.02Å; F32-P147 HydrophobicContact CD1-CG 4.19Å; F32-P147 HydrophobicContact CE1-CG 3.91Å; I143-P147 WeakPolarHBondContact O-CD 3.26Å; S144-P147 WeakPolarHBondContact O-CD 3.35Å; S144-P147 WeakPolarHBondContact O-CG 3.31Å; P147-L150 PolarHBondContact O-N 3.47Å; P147-L151 WeakPolarHBondContact O-CB 3.5Å; P147-L151 WeakPolarHBondContact O-CD1 3.32Å; P147-L151 WeakPolarHBondContact O-CG 3.44Å; P147-L151 PolarHBondContact O-N 3.04Å |
| 148 | E | 84.6 | Confident | 86.6 | Confident | 6 Ų | 6 | 70.9 Ų | 70.9 | 3% | 0.028 | 35% | 0.35 | C | S | . | . | H | α-helix | trans | -69 | -44.9 | -178.8 | -176.5 | 159.1 | -130.4 | 0 | 0 | 112.7 | K77 L145 F146 L150 L151 I152 | K77-E148 WeakPolarHBondContact CE-OE1 3.46Å; K77-E148 WeakPolarHBondContact CE-OE2 3.27Å; K77-E148 VanDerWaalsContact CG-OE2 3.23Å; K77-E148 WeakPolarHBondContact CG-OE2 3.09Å; K77-E148 IonicContact NZ-OE1 2.81Å; K77-E148 PolarHBondContact NZ-OE1 3.34Å; K77-E148 IonicContact NZ-OE2 2.7Å; K77-E148 PolarHBondContact NZ-OE2 3.25Å; L145-E148 PolarHBondContact O-N 2.95Å; L145-E148 VanDerWaalsContact O-N 3.14Å; F146-E148 VanDerWaalsContact C-N 3.25Å; F146-E148 PolarHBondContact O-N 3.35Å; E148-L150 VanDerWaalsContact C-N 3.29Å; E148-L150 PolarHBondContact O-N 3.07Å; E148-L151 PolarHBondContact O-N 3.24Å; E148-L151 VanDerWaalsContact O-N 3.15Å; E148-I152 HydrophobicContact CG-CD1 4.01Å; E148-I152 VanDerWaalsContact O-CG1 3.3Å; E148-I152 WeakPolarHBondContact O-CG1 3.45Å; E148-I152 PolarHBondContact O-N 3.37Å |
| 149 | I | 86.5 | Confident | 86 | Confident | 66 Ų | 66 | 72 Ų | 72 | 34% | 0.338 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -58.3 | -45.7 | 174.4 | -66.6 | 168.4 | 0 | 0 | 0 | 109.9 | L80 L145 F146 L151 I152 V153 | L80-I149 HydrophobicContact CD1-CD1 4.45Å; L80-I149 HydrophobicContact CD1-CG1 4.17Å; L145-I149 HydrophobicContact CB-CD1 4.16Å; L145-I149 WeakPolarHBondContact O-CG1 3.42Å; L145-I149 PolarHBondContact O-N 2.82Å; F146-I149 PolarHBondContact O-N 2.81Å; I149-L151 VanDerWaalsContact C-N 3.3Å; I149-L151 PolarHBondContact O-N 3.37Å; I149-I152 PolarHBondContact O-N 2.97Å; I149-V153 HydrophobicContact CG2-CG2 4.42Å; I149-V153 VanDerWaalsContact O-CG2 3.31Å; I149-V153 WeakPolarHBondContact O-CG2 3.28Å; I149-V153 PolarHBondContact O-N 3.34Å |
| 150 | L | 87.3 | Confident | 85.4 | Confident | 84 Ų | 84 | 76 Ų | 76 | 44% | 0.44 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -58.9 | -43.8 | 177.3 | -173 | 69.4 | 0 | 0 | 0 | 111.2 | F146 P147 E148 V153 L154 | F146-L150 WeakPolarHBondContact O-CB 3.49Å; F146-L150 PolarHBondContact O-N 2.94Å; P147-L150 PolarHBondContact O-N 3.47Å; E148-L150 VanDerWaalsContact C-N 3.29Å; E148-L150 PolarHBondContact O-N 3.07Å; L150-V153 PolarHBondContact O-N 3.02Å; L150-L154 HydrophobicContact CG-CD1 4.02Å; L150-L154 HydrophobicContact CG-CG 4.46Å; L150-L154 WeakPolarHBondContact O-CB 3.37Å; L150-L154 VanDerWaalsContact O-CG 3.24Å; L150-L154 WeakPolarHBondContact O-CG 3.34Å; L150-L154 PolarHBondContact O-N 3.38Å |
| 151 | L | 83.8 | Confident | 84.9 | Confident | 49 Ų | 49 | 78.5 Ų | 78.5 | 26% | 0.257 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -66.5 | -38.8 | 178.9 | -73.1 | 155.9 | 0 | 0 | 0 | 112.3 | Y25 P147 E148 I149 K155 | Y25-L151 HydrophobicContact CE2-CD1 4.11Å; Y25-L151 HydrophobicContact CE2-CD2 4.39Å; Y25-L151 WeakPolarHBondContact OH-CD1 3.22Å; Y25-L151 VanDerWaalsContact OH-CD2 3.28Å; Y25-L151 WeakPolarHBondContact OH-CD2 3.4Å; Y25-L151 VanDerWaalsContact OH-CG 3.32Å; Y25-L151 WeakPolarHBondContact OH-CG 3.42Å; P147-L151 WeakPolarHBondContact O-CB 3.5Å; P147-L151 WeakPolarHBondContact O-CD1 3.32Å; P147-L151 WeakPolarHBondContact O-CG 3.44Å; P147-L151 PolarHBondContact O-N 3.04Å; E148-L151 PolarHBondContact O-N 3.24Å; E148-L151 VanDerWaalsContact O-N 3.15Å; I149-L151 VanDerWaalsContact C-N 3.3Å; I149-L151 PolarHBondContact O-N 3.37Å; L151-K155 VanDerWaalsContact O-CB 3.29Å; L151-K155 WeakPolarHBondContact O-CB 3.44Å; L151-K155 VanDerWaalsContact O-CG 3.23Å; L151-K155 WeakPolarHBondContact O-CG 3Å; L151-K155 PolarHBondContact O-N 3.23Å |
| 152 | I | 84.6 | Confident | 84.1 | Confident | 54 Ų | 54 | 80.7 Ų | 80.7 | 28% | 0.277 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -63 | -47.5 | 173.8 | -69.5 | 165.3 | 0 | 0 | 0 | 110.2 | E148 I149 K155 N156 | E148-I152 HydrophobicContact CG-CD1 4.01Å; E148-I152 VanDerWaalsContact O-CG1 3.3Å; E148-I152 WeakPolarHBondContact O-CG1 3.45Å; E148-I152 PolarHBondContact O-N 3.37Å; I149-I152 PolarHBondContact O-N 2.97Å; I152-K155 PolarHBondContact O-N 3.44Å; I152-N156 WeakPolarHBondContact O-CB 3.49Å; I152-N156 PolarHBondContact O-N 3.49Å; I152-N156 PolarHBondContact O-ND2 2.89Å |
| 153 | V | 86.8 | Confident | 83.3 | Confident | 76 Ų | 76 | 82.7 Ų | 82.7 | 46% | 0.461 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -62.3 | -49.8 | 179 | 172.3 | 0 | 0 | 0 | 0 | 110.9 | I149 L150 K155 N156 V157 | I149-V153 HydrophobicContact CG2-CG2 4.42Å; I149-V153 VanDerWaalsContact O-CG2 3.31Å; I149-V153 WeakPolarHBondContact O-CG2 3.28Å; I149-V153 PolarHBondContact O-N 3.34Å; L150-V153 PolarHBondContact O-N 3.02Å; V153-K155 VanDerWaalsContact C-N 3.34Å; V153-K155 PolarHBondContact O-N 2.91Å; V153-N156 PolarHBondContact O-N 3.5Å; V153-N156 VanDerWaalsContact O-N 3.12Å; V153-V157 HydrophobicContact CG1-CG2 4.27Å; V153-V157 WeakPolarHBondContact O-CG2 3.27Å; V153-V157 PolarHBondContact O-N 2.85Å |
| 154 | L | 85.9 | Confident | 82.5 | Confident | 99 Ų | 99 | 82.8 Ų | 82.8 | 52% | 0.518 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -59.4 | -43.6 | 178.5 | -73.1 | 172.9 | 0 | 0 | 0 | 111.9 | L150 N156 V157 R158 | L150-L154 HydrophobicContact CG-CD1 4.02Å; L150-L154 HydrophobicContact CG-CG 4.46Å; L150-L154 WeakPolarHBondContact O-CB 3.37Å; L150-L154 VanDerWaalsContact O-CG 3.24Å; L150-L154 WeakPolarHBondContact O-CG 3.34Å; L150-L154 PolarHBondContact O-N 3.38Å; L154-N156 VanDerWaalsContact C-N 3.35Å; L154-N156 PolarHBondContact O-N 3.28Å; L154-V157 PolarHBondContact O-N 3.33Å; L154-R158 VanDerWaalsContact O-CB 3.31Å; L154-R158 WeakPolarHBondContact O-CB 3.37Å; L154-R158 PolarHBondContact O-N 3.49Å |
| 155 | K | 82.4 | Confident | 81.6 | Confident | 98 Ų | 98 | 89.1 Ų | 89.1 | 43% | 0.426 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -62.7 | -41.5 | 175.4 | -77.2 | 173.1 | -179 | 170.5 | 0 | 111.4 | L151 I152 V153 R159 | L151-K155 VanDerWaalsContact O-CB 3.29Å; L151-K155 WeakPolarHBondContact O-CB 3.44Å; L151-K155 VanDerWaalsContact O-CG 3.23Å; L151-K155 WeakPolarHBondContact O-CG 3Å; L151-K155 PolarHBondContact O-N 3.23Å; I152-K155 PolarHBondContact O-N 3.44Å; V153-K155 VanDerWaalsContact C-N 3.34Å; V153-K155 PolarHBondContact O-N 2.91Å; K155-R159 WeakPolarHBondContact O-CB 2.95Å; K155-R159 WeakPolarHBondContact O-CG 3.37Å; K155-R159 PolarHBondContact O-N 3.19Å |
| 156 | N | 83.4 | Confident | 80.7 | Confident | 76 Ų | 76 | 94.3 Ų | 94.3 | 41% | 0.406 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -67.6 | -43 | 179 | -73.3 | -21.3 | 0 | 0 | 0 | 112.2 | I152 V153 L154 R159 R160 | I152-N156 WeakPolarHBondContact O-CB 3.49Å; I152-N156 PolarHBondContact O-N 3.49Å; I152-N156 PolarHBondContact O-ND2 2.89Å; V153-N156 PolarHBondContact O-N 3.5Å; V153-N156 VanDerWaalsContact O-N 3.12Å; L154-N156 VanDerWaalsContact C-N 3.35Å; L154-N156 PolarHBondContact O-N 3.28Å; N156-R159 PolarHBondContact O-N 2.99Å; N156-R160 WeakPolarHBondContact O-CB 3.44Å; N156-R160 PolarHBondContact O-N 3.09Å |
| 157 | V | 85.6 | Confident | 80 | Confident | 90 Ų | 90 | 94.8 Ų | 94.8 | 55% | 0.545 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -62.4 | -48.1 | 175.5 | 172.6 | 0 | 0 | 0 | 0 | 110.5 | V153 L154 R159 R160 S161 | V153-V157 HydrophobicContact CG1-CG2 4.27Å; V153-V157 WeakPolarHBondContact O-CG2 3.27Å; V153-V157 PolarHBondContact O-N 2.85Å; L154-V157 PolarHBondContact O-N 3.33Å; V157-R159 VanDerWaalsContact C-N 3.34Å; V157-R159 PolarHBondContact O-N 2.91Å; V157-R160 WeakPolarHBondContact O-CB 3.48Å; V157-R160 PolarHBondContact O-N 3.38Å; V157-R160 VanDerWaalsContact O-N 3.08Å; V157-S161 PolarHBondContact O-N 3.28Å |
| 158 | R | 81.4 | Confident | 79.5 | Confident | 200 Ų | 200 | 98.3 Ų | 98.3 | 76% | 0.755 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -59.8 | -42.8 | 177.4 | -172.6 | 175.9 | -178.5 | 179.9 | 1.2 | 112 | L154 R160 S161 A162 | L154-R158 VanDerWaalsContact O-CB 3.31Å; L154-R158 WeakPolarHBondContact O-CB 3.37Å; L154-R158 PolarHBondContact O-N 3.49Å; R158-R160 VanDerWaalsContact C-N 3.31Å; R158-R160 PolarHBondContact O-N 3.14Å; R158-S161 PolarHBondContact O-N 3.37Å; R158-A162 WeakPolarHBondContact O-CB 3.31Å; R158-A162 PolarHBondContact O-N 3.17Å |
| 159 | R | 75.4 | Confident | 78.8 | Confident | 128 Ų | 128 | 101.9 Ų | 101.9 | 48% | 0.483 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -63.7 | -34.5 | 175.1 | -75.8 | 173.8 | -177.7 | -165.2 | 1.2 | 112.6 | K155 N156 V157 R163 | K155-R159 WeakPolarHBondContact O-CB 2.95Å; K155-R159 WeakPolarHBondContact O-CG 3.37Å; K155-R159 PolarHBondContact O-N 3.19Å; N156-R159 PolarHBondContact O-N 2.99Å; V157-R159 VanDerWaalsContact C-N 3.34Å; V157-R159 PolarHBondContact O-N 2.91Å; R159-R163 PolarHBondContact O-N 3.44Å |
| 160 | R | 76.1 | Confident | 77.8 | Confident | 188 Ų | 188 | 103 Ų | 103 | 71% | 0.709 | 52% | 0.518 | S | S | * | . | H | α-helix | trans | -70.8 | -47.2 | 176.9 | -165.4 | 176.5 | -176 | -179.6 | 0.5 | 110.9 | N156 V157 R158 A162 R163 V164 | N156-R160 WeakPolarHBondContact O-CB 3.44Å; N156-R160 PolarHBondContact O-N 3.09Å; V157-R160 WeakPolarHBondContact O-CB 3.48Å; V157-R160 PolarHBondContact O-N 3.38Å; V157-R160 VanDerWaalsContact O-N 3.08Å; R158-R160 VanDerWaalsContact C-N 3.31Å; R158-R160 PolarHBondContact O-N 3.14Å; R160-A162 PolarHBondContact O-N 3.4Å; R160-R163 PolarHBondContact O-N 2.9Å; R160-V164 WeakPolarHBondContact O-CG2 3.38Å; R160-V164 PolarHBondContact O-N 3.22Å; R160-V164 VanDerWaalsContact O-N 3.11Å |
| 161 | S | 79.4 | Confident | 76.6 | Confident | 65 Ų | 65 | 103.8 Ų | 103.8 | 46% | 0.455 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -59.3 | -45.1 | 176.4 | 174.6 | 0 | 0 | 0 | 0 | 112.4 | V157 R158 R163 V164 H165 | V157-S161 PolarHBondContact O-N 3.28Å; R158-S161 PolarHBondContact O-N 3.37Å; S161-R163 VanDerWaalsContact C-N 3.32Å; S161-R163 PolarHBondContact O-N 3.22Å; S161-V164 PolarHBondContact O-N 3.1Å; S161-H165 PolarHBondContact O-N 2.74Å; S161-H165 VanDerWaalsContact O-N 3.14Å |
| 162 | A | 74.2 | Confident | 75.1 | Confident | 62 Ų | 62 | 108 Ų | 108 | 51% | 0.512 | 57% | 0.572 | S | S | . | * | H | α-helix | trans | -62.7 | -36.1 | 177 | 0 | 0 | 0 | 0 | 0 | 113.3 | R158 R160 H166 | R158-A162 WeakPolarHBondContact O-CB 3.31Å; R158-A162 PolarHBondContact O-N 3.17Å; R160-A162 PolarHBondContact O-N 3.4Å; A162-H166 PolarHBondContact O-N 3.21Å |
| 163 | R | 71.9 | Confident | 74.6 | Confident | 172 Ų | 172 | 110.8 Ų | 110.8 | 65% | 0.649 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -65.8 | -41.2 | 174.5 | -98.4 | -172.9 | -76.5 | 178.9 | -4.4 | 112.2 | R159 R160 S161 H166 L167 | R159-R163 PolarHBondContact O-N 3.44Å; R160-R163 PolarHBondContact O-N 2.9Å; S161-R163 VanDerWaalsContact C-N 3.32Å; S161-R163 PolarHBondContact O-N 3.22Å; R163-H166 PolarHBondContact O-N 3.29Å; R163-L167 WeakPolarHBondContact O-CG 3.46Å; R163-L167 PolarHBondContact O-N 3.16Å; R163-L167 VanDerWaalsContact O-N 3.09Å |
| 164 | V | 73.7 | Confident | 74 | Confident | 74 Ų | 74 | 112.6 Ų | 112.6 | 45% | 0.448 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -62.6 | -46.4 | 178.9 | 172.8 | 0 | 0 | 0 | 0 | 110.9 | R160 S161 H166 L167 I168 | R160-V164 WeakPolarHBondContact O-CG2 3.38Å; R160-V164 PolarHBondContact O-N 3.22Å; R160-V164 VanDerWaalsContact O-N 3.11Å; S161-V164 PolarHBondContact O-N 3.1Å; V164-H166 VanDerWaalsContact C-N 3.34Å; V164-H166 PolarHBondContact O-N 2.64Å; V164-L167 PolarHBondContact O-N 3.38Å; V164-I168 HydrophobicContact CG1-CD1 3.8Å; V164-I168 WeakPolarHBondContact O-CG1 3.46Å; V164-I168 PolarHBondContact O-N 3.39Å; V164-I168 VanDerWaalsContact O-N 3.09Å |
| 165 | H | 70.1 | Confident | 73.3 | Confident | 133 Ų | 133 | 113.3 Ų | 113.3 | 62% | 0.616 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -59.2 | -42 | 176.8 | -90.4 | -87.8 | 0 | 0 | 0 | 113.2 | S161 I168 S169 | S161-H165 PolarHBondContact O-N 2.74Å; S161-H165 VanDerWaalsContact O-N 3.14Å; H165-I168 PolarHBondContact O-N 2.7Å; H165-S169 PolarHBondContact O-N 2.77Å; H165-S169 PolarHBondContact O-OG 3.49Å |
| 166 | H | 69.1 | Low | 72.8 | Confident | 122 Ų | 122 | 114.2 Ų | 114.2 | 57% | 0.565 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -67.2 | -34.7 | 178.5 | -173.9 | -71.6 | 0 | 0 | 0 | 112.8 | A162 R163 V164 S169 S170 | A162-H166 PolarHBondContact O-N 3.21Å; R163-H166 PolarHBondContact O-N 3.29Å; V164-H166 VanDerWaalsContact C-N 3.34Å; V164-H166 PolarHBondContact O-N 2.64Å; H166-S169 PolarHBondContact O-OG 3.49Å; H166-S170 WeakPolarHBondContact O-CB 3.5Å; H166-S170 PolarHBondContact O-N 2.96Å |
| 167 | L | 72.3 | Confident | 72.2 | Confident | 121 Ų | 121 | 116.6 Ų | 116.6 | 63% | 0.634 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -67.6 | -43.3 | 176.1 | -71.5 | 169.2 | 0 | 0 | 0 | 111 | R163 V164 S170 S171 | R163-L167 WeakPolarHBondContact O-CG 3.46Å; R163-L167 PolarHBondContact O-N 3.16Å; R163-L167 VanDerWaalsContact O-N 3.09Å; V164-L167 PolarHBondContact O-N 3.38Å; L167-S170 PolarHBondContact O-N 3.37Å; L167-S171 PolarHBondContact O-N 3.47Å; L167-S171 PolarHBondContact O-OG 3.17Å; L167-S171 VanDerWaalsContact O-OG 3.12Å |
| 168 | I | 74.3 | Confident | 71.3 | Confident | 102 Ų | 102 | 118.4 Ų | 118.4 | 52% | 0.523 | 63% | 0.626 | S | S | . | * | H | α-helix | trans | -63.4 | -43.1 | 178.1 | -64.1 | 166.7 | 0 | 0 | 0 | 111.2 | V164 H165 S170 S171 A172 | V164-I168 HydrophobicContact CG1-CD1 3.8Å; V164-I168 WeakPolarHBondContact O-CG1 3.46Å; V164-I168 PolarHBondContact O-N 3.39Å; V164-I168 VanDerWaalsContact O-N 3.09Å; H165-I168 PolarHBondContact O-N 2.7Å; I168-S170 PolarHBondContact O-N 3.21Å; I168-S171 PolarHBondContact O-N 3Å; I168-S171 PolarHBondContact O-OG 3.03Å; I168-A172 PolarHBondContact O-N 3.01Å |
| 169 | S | 70.1 | Confident | 70.5 | Confident | 81 Ų | 81 | 112.6 Ų | 112.6 | 57% | 0.566 | 62% | 0.616 | S | S | * | * | H | α-helix | trans | -72.6 | -15.5 | 178.9 | 73.5 | 0 | 0 | 0 | 0 | 114.1 | H165 H166 | H165-S169 PolarHBondContact O-N 2.77Å; H165-S169 PolarHBondContact O-OG 3.49Å; H166-S169 PolarHBondContact O-OG 3.49Å |
| 170 | S | 66.6 | Low | 70.2 | Confident | 89 Ų | 89 | 111.4 Ų | 111.4 | 62% | 0.622 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -94.3 | -14.2 | 177.1 | -177.9 | 0 | 0 | 0 | 0 | 112.6 | H166 L167 I168 | H166-S170 WeakPolarHBondContact O-CB 3.5Å; H166-S170 PolarHBondContact O-N 2.96Å; L167-S170 PolarHBondContact O-N 3.37Å; I168-S170 PolarHBondContact O-N 3.21Å |
| 171 | S | 61.8 | Low | 69.7 | Low | 100 Ų | 100 | 105 Ų | 105 | 70% | 0.699 | 62% | 0.62 | S | S | * | * | trans | -98.7 | -5.8 | 178.3 | 55.7 | 0 | 0 | 0 | 0 | 114 | L167 I168 | L167-S171 PolarHBondContact O-N 3.47Å; L167-S171 PolarHBondContact O-OG 3.17Å; L167-S171 VanDerWaalsContact O-OG 3.12Å; I168-S171 PolarHBondContact O-N 3Å; I168-S171 PolarHBondContact O-OG 3.03Å | ||
| 172 | A | 52.8 | Low | 68.8 | Low | 139 Ų | 139 | 108.6 Ų | 108.6 | 100% | 1.149 | 64% | 0.635 | S | S | * | * | trans | -103.6 | 0 | 172.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | I168 | I168-A172 PolarHBondContact O-N 3.01Š|
Retrieved 172 of 172 residues in 114.4 ms
(Link to these results)