| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 35.4 | Very low | 47 | Very low | 224 Ų | 224 | 136.2 Ų | 136.2 | 100% | 1.103 | 83% | 0.825 | S | S | * | * | 0 | 108 | 0 | -69.9 | 169.4 | 163 | 0 | 0 | 106.9 | |||||
| 2 | E | 41.8 | Very low | 47.4 | Very low | 169 Ų | 169 | 133.2 Ų | 133.2 | 79% | 0.79 | 83% | 0.825 | S | S | * | * | cis | -151.1 | 147.2 | 6.2 | -67.8 | -67.1 | 112.8 | 0 | 0 | 106.5 | ||||
| 3 | H | 43.6 | Very low | 47.8 | Very low | 167 Ų | 167 | 126.6 Ų | 126.6 | 77% | 0.773 | 80% | 0.8 | S | S | * | * | trans | -83.9 | 149 | 178.7 | -62.6 | -111.9 | 0 | 0 | 0 | 110.4 | ||||
| 4 | S | 51.1 | Low | 48.4 | Very low | 124 Ų | 124 | 127.6 Ų | 127.6 | 87% | 0.867 | 80% | 0.804 | S | S | * | * | -177.1 | 110.3 | 128.1 | -85.5 | 0 | 0 | 0 | 0 | 112.4 | |||||
| 5 | E | 60.1 | Low | 49.4 | Very low | 185 Ų | 185 | 127.4 Ų | 127.4 | 86% | 0.864 | 80% | 0.801 | S | S | * | * | trans | -69.4 | 145.7 | 152.9 | -60.1 | 148.9 | 98.5 | 0 | 0 | 109.3 | ||||
| 6 | G | 40.2 | Very low | 50.6 | Low | 75 Ų | 75 | 124.2 Ų | 124.2 | 77% | 0.773 | 78% | 0.779 | S | S | * | * | trans | 165.4 | 77.8 | 169.2 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 7 | A | 48 | Very low | 52.5 | Low | 97 Ų | 97 | 121.4 Ų | 121.4 | 80% | 0.802 | 76% | 0.763 | S | S | * | * | trans | 42.7 | 151.2 | 136.7 | 0 | 0 | 0 | 0 | 0 | 122.9 | ||||
| 8 | P | 51.3 | Low | 54.1 | Low | 128 Ų | 128 | 123.1 Ų | 123.1 | 83% | 0.831 | 76% | 0.76 | S | S | * | * | trans | -83.5 | 128.9 | -163.8 | 34.7 | -30.4 | 0 | 0 | 0 | 112 | ||||
| 9 | G | 42.1 | Very low | 55.5 | Low | 77 Ų | 77 | 124.3 Ų | 124.3 | 79% | 0.794 | 76% | 0.756 | S | S | * | * | trans | -94.2 | 94.1 | 169.2 | 0 | 0 | 0 | 0 | 0 | 110.2 | P11 | G9-P11 WeakPolarHBondContact O-CD 3.34Š| ||
| 10 | D | 51.7 | Low | 56.8 | Low | 141 Ų | 141 | 122.5 Ų | 122.5 | 75% | 0.754 | 74% | 0.741 | S | S | * | * | trans | -83.7 | 115.4 | 160.5 | 179.2 | 24.2 | 0 | 0 | 0 | 108.7 | ||||
| 11 | P | 52 | Low | 58.1 | Low | 111 Ų | 111 | 120.9 Ų | 120.9 | 72% | 0.721 | 73% | 0.728 | S | S | * | * | trans | -90.2 | 106 | 155.7 | 31.8 | -21.2 | 0 | 0 | 0 | 108.4 | G9 G13 | G9-P11 WeakPolarHBondContact O-CD 3.34Å; P11-G13 PolarHBondContact O-N 3.43Å | ||
| 12 | A | 51.4 | Low | 60.5 | Low | 100 Ų | 100 | 116.7 Ų | 116.7 | 83% | 0.826 | 71% | 0.706 | S | S | * | * | trans | -41.2 | 101.8 | 166.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 13 | G | 52.4 | Low | 62.4 | Low | 48 Ų | 48 | 115.3 Ų | 115.3 | 50% | 0.495 | 70% | 0.699 | S | S | . | * | trans | -163.5 | 71.2 | 174.5 | 0 | 0 | 0 | 0 | 0 | 107.5 | P11 V15 | P11-G13 PolarHBondContact O-N 3.43Å; G13-V15 VanDerWaalsContact C-N 3.29Å; G13-V15 WeakPolarHBondContact O-CG2 3.41Å; G13-V15 PolarHBondContact O-N 3.22Å | ||
| 14 | T | 56.6 | Low | 64.3 | Low | 140 Ų | 140 | 113 Ų | 113 | 86% | 0.859 | 69% | 0.69 | S | S | * | * | trans | 0.9 | 74.4 | 172.3 | 47.5 | 0 | 0 | 0 | 0 | 114.3 | V16 | T14-V16 PolarHBondContact O-N 3.12Š| ||
| 15 | V | 63.5 | Low | 65.8 | Low | 125 Ų | 125 | 111.2 Ų | 111.2 | 76% | 0.758 | 67% | 0.67 | S | S | * | * | trans | -76.6 | 90.7 | 168.4 | 175.2 | 0 | 0 | 0 | 0 | 103.9 | G13 P17 | G13-V15 VanDerWaalsContact C-N 3.29Å; G13-V15 WeakPolarHBondContact O-CG2 3.41Å; G13-V15 PolarHBondContact O-N 3.22Å; V15-P17 WeakPolarHBondContact O-CD 3.06Å; V15-P17 VanDerWaalsContact O-N 3.14Å | ||
| 16 | V | 68.9 | Low | 66.8 | Low | 76 Ų | 76 | 110.5 Ų | 110.5 | 46% | 0.461 | 66% | 0.66 | S | S | . | * | trans | -49.3 | 123.1 | 165.4 | 172.8 | 0 | 0 | 0 | 0 | 105.9 | T14 Q18 L20 L21 | T14-V16 PolarHBondContact O-N 3.12Å; V16-Q18 PolarHBondContact O-N 3.34Å; V16-L20 HydrophobicContact CG1-CD2 4.15Å; V16-L21 HydrophobicContact CG1-CB 4.17Å | ||
| 17 | P | 82.6 | Confident | 68.4 | Low | 76 Ų | 76 | 112.4 Ų | 112.4 | 49% | 0.494 | 65% | 0.647 | S | S | . | * | trans | -51.7 | 128.6 | 179.5 | -23.9 | 31.5 | 0 | 0 | 0 | 108.9 | V15 E19 L20 L21 | V15-P17 WeakPolarHBondContact O-CD 3.06Å; V15-P17 VanDerWaalsContact O-N 3.14Å; P17-E19 PolarHBondContact O-N 3.45Å; P17-E19 VanDerWaalsContact O-N 3.15Å; P17-L20 HydrophobicContact CB-CB 4.16Å; P17-L20 HydrophobicContact CG-CB 4.48Å; P17-L20 WeakPolarHBondContact O-CA 3.36Å; P17-L20 WeakPolarHBondContact O-CB 3.25Å; P17-L20 PolarHBondContact O-N 3.36Å; P17-L21 PolarHBondContact O-N 3.19Å | ||
| 18 | Q | 80.8 | Confident | 69.5 | Low | 152 Ų | 152 | 113.7 Ų | 113.7 | 71% | 0.71 | 64% | 0.635 | S | S | * | * | H | α-helix | trans | -59 | -31.5 | -175.2 | -68.5 | -150.6 | 7.6 | 0 | 0 | 112.2 | V16 L20 L21 E22 | V16-Q18 PolarHBondContact O-N 3.34Å; Q18-L20 VanDerWaalsContact C-N 3.31Å; Q18-L20 PolarHBondContact O-N 3.01Å; Q18-L21 PolarHBondContact O-N 2.88Å; Q18-E22 WeakPolarHBondContact O-CB 3.42Å; Q18-E22 PolarHBondContact O-N 3.37Å |
| 19 | E | 80.2 | Confident | 70.5 | Confident | 147 Ų | 147 | 117.1 Ų | 117.1 | 69% | 0.687 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -58.5 | -41.2 | 172.5 | -42 | -57.5 | 146.7 | 0 | 0 | 112.3 | P17 E22 E23 | P17-E19 PolarHBondContact O-N 3.45Å; P17-E19 VanDerWaalsContact O-N 3.15Å; E19-E22 PolarHBondContact O-N 3.01Å; E19-E23 WeakPolarHBondContact O-CB 3.18Å; E19-E23 PolarHBondContact O-N 2.67Å |
| 20 | L | 81.8 | Confident | 71.8 | Confident | 87 Ų | 87 | 117.5 Ų | 117.5 | 46% | 0.455 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -76.7 | -32.9 | -178.9 | -163.6 | 144.7 | 0 | 0 | 0 | 111 | V16 P17 Q18 M24 | V16-L20 HydrophobicContact CG1-CD2 4.15Å; P17-L20 HydrophobicContact CB-CB 4.16Å; P17-L20 HydrophobicContact CG-CB 4.48Å; P17-L20 WeakPolarHBondContact O-CA 3.36Å; P17-L20 WeakPolarHBondContact O-CB 3.25Å; P17-L20 PolarHBondContact O-N 3.36Å; Q18-L20 VanDerWaalsContact C-N 3.31Å; Q18-L20 PolarHBondContact O-N 3.01Å; L20-M24 HydrophobicContact CD2-CG 4.19Å; L20-M24 VanDerWaalsContact O-CB 3.29Å; L20-M24 WeakPolarHBondContact O-CB 3.06Å; L20-M24 WeakPolarHBondContact O-CG 3.44Å; L20-M24 PolarHBondContact O-N 2.81Å |
| 21 | L | 84.6 | Confident | 72.4 | Confident | 89 Ų | 89 | 115.2 Ų | 115.2 | 47% | 0.466 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -67.4 | -39.7 | 170.9 | -176 | 61.5 | 0 | 0 | 0 | 111.3 | V16 P17 Q18 M24 L25 | V16-L21 HydrophobicContact CG1-CB 4.17Å; P17-L21 PolarHBondContact O-N 3.19Å; Q18-L21 PolarHBondContact O-N 2.88Å; L21-M24 PolarHBondContact O-N 3.27Å; L21-L25 HydrophobicContact CD1-CD1 3.62Å; L21-L25 HydrophobicContact CG-CD1 3.91Å; L21-L25 VanDerWaalsContact O-CB 3.31Å; L21-L25 WeakPolarHBondContact O-CB 3.32Å; L21-L25 VanDerWaalsContact O-CD1 3.27Å; L21-L25 WeakPolarHBondContact O-CD1 3.45Å; L21-L25 PolarHBondContact O-N 2.91Å |
| 22 | E | 85.2 | Confident | 73.1 | Confident | 137 Ų | 137 | 114.3 Ų | 114.3 | 64% | 0.64 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -67.3 | -40.1 | 175.6 | -173.4 | 171.8 | 178.1 | 0 | 0 | 111.6 | Q18 E19 L25 W26 | Q18-E22 WeakPolarHBondContact O-CB 3.42Å; Q18-E22 PolarHBondContact O-N 3.37Å; E19-E22 PolarHBondContact O-N 3.01Å; E22-L25 CarbonylContact O-C 3.59Å; E22-L25 PolarHBondContact O-N 3.49Å; E22-W26 WeakPolarHBondContact O-CB 3.2Å; E22-W26 PolarHBondContact O-N 2.94Å |
| 23 | E | 81.4 | Confident | 73.6 | Confident | 139 Ų | 139 | 113 Ų | 113 | 65% | 0.65 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -64.6 | -43.6 | 174 | -171.3 | 174.6 | -179.5 | 0 | 0 | 111.7 | E19 W26 F27 | E19-E23 WeakPolarHBondContact O-CB 3.18Å; E19-E23 PolarHBondContact O-N 2.67Å; E23-W26 PolarHBondContact O-N 3.14Å; E23-F27 WeakPolarHBondContact O-CB 3.29Å; E23-F27 PolarHBondContact O-N 2.96Å |
| 24 | M | 83.3 | Confident | 74.1 | Confident | 118 Ų | 118 | 113.6 Ų | 113.6 | 58% | 0.581 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -64.3 | -39.5 | 173.6 | -76.5 | -97.3 | 120.8 | 0 | 0 | 112 | L20 L21 F27 F28 | L20-M24 HydrophobicContact CD2-CG 4.19Å; L20-M24 VanDerWaalsContact O-CB 3.29Å; L20-M24 WeakPolarHBondContact O-CB 3.06Å; L20-M24 WeakPolarHBondContact O-CG 3.44Å; L20-M24 PolarHBondContact O-N 2.81Å; L21-M24 PolarHBondContact O-N 3.27Å; M24-F27 PolarHBondContact O-N 3.3Å; M24-F28 VanDerWaalsContact O-CB 3.28Å; M24-F28 WeakPolarHBondContact O-CB 3.5Å; M24-F28 PolarHBondContact O-N 2.85Å |
| 25 | L | 83 | Confident | 75.3 | Confident | 87 Ų | 87 | 110.1 Ų | 110.1 | 46% | 0.455 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -70.9 | -33.5 | 175.1 | -104.6 | 82 | 0 | 0 | 0 | 112.1 | L21 E22 R29 | L21-L25 HydrophobicContact CD1-CD1 3.62Å; L21-L25 HydrophobicContact CG-CD1 3.91Å; L21-L25 VanDerWaalsContact O-CB 3.31Å; L21-L25 WeakPolarHBondContact O-CB 3.32Å; L21-L25 VanDerWaalsContact O-CD1 3.27Å; L21-L25 WeakPolarHBondContact O-CD1 3.45Å; L21-L25 PolarHBondContact O-N 2.91Å; E22-L25 CarbonylContact O-C 3.59Å; E22-L25 PolarHBondContact O-N 3.49Å; L25-R29 WeakPolarHBondContact O-CA 3.23Å; L25-R29 WeakPolarHBondContact O-CB 3.35Å; L25-R29 PolarHBondContact O-N 3.33Å |
| 26 | W | 82.5 | Confident | 76.2 | Confident | 170 Ų | 170 | 113.4 Ų | 113.4 | 64% | 0.644 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -66.9 | -44.9 | 174.6 | -176.3 | 94.1 | 0 | 0 | 0 | 109.6 | E22 E23 R29 V30 | E22-W26 WeakPolarHBondContact O-CB 3.2Å; E22-W26 PolarHBondContact O-N 2.94Å; E23-W26 PolarHBondContact O-N 3.14Å; W26-R29 PolarHBondContact O-N 2.83Å; W26-V30 HydrophobicContact CD2-CG2 4.19Å; W26-V30 HydrophobicContact CE3-CG2 4.44Å; W26-V30 HydrophobicContact CH2-CG2 4.37Å; W26-V30 HydrophobicContact CZ2-CG2 4.12Å; W26-V30 VanDerWaalsContact O-CB 3.31Å; W26-V30 WeakPolarHBondContact O-CB 3.45Å; W26-V30 VanDerWaalsContact O-CG2 3.27Å; W26-V30 WeakPolarHBondContact O-CG2 3.29Å; W26-V30 PolarHBondContact O-N 3.5Å |
| 27 | F | 73.6 | Confident | 77 | Confident | 116 Ų | 116 | 114.4 Ų | 114.4 | 51% | 0.509 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -60.5 | -50.8 | 173.1 | -173.2 | -93.7 | 0 | 0 | 0 | 111 | E23 M24 R29 V30 E31 | E23-F27 WeakPolarHBondContact O-CB 3.29Å; E23-F27 PolarHBondContact O-N 2.96Å; M24-F27 PolarHBondContact O-N 3.3Å; F27-R29 PolarHBondContact O-N 3.41Å; F27-V30 PolarHBondContact O-N 3.03Å; F27-E31 HydrophobicContact CD1-CB 4.37Å; F27-E31 HydrophobicContact CE1-CB 4.2Å; F27-E31 HydrophobicContact CE1-CG 4.03Å; F27-E31 HydrophobicContact CZ-CG 4.24Å; F27-E31 WeakPolarHBondContact O-CB 3.42Å; F27-E31 PolarHBondContact O-N 2.99Å |
| 28 | F | 70.2 | Confident | 77.2 | Confident | 124 Ų | 124 | 117 Ų | 117 | 54% | 0.544 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -63.9 | -40.8 | 179 | -163.1 | -102.5 | 0 | 0 | 0 | 111.5 | M24 V30 E31 D32 | M24-F28 VanDerWaalsContact O-CB 3.28Å; M24-F28 WeakPolarHBondContact O-CB 3.5Å; M24-F28 PolarHBondContact O-N 2.85Å; F28-V30 VanDerWaalsContact C-N 3.35Å; F28-V30 PolarHBondContact O-N 2.93Å; F28-E31 CarbonylContact O-C 3.56Å; F28-E31 PolarHBondContact O-N 3.49Å; F28-D32 HydrophobicContact CD1-CB 4.44Å; F28-D32 HydrophobicContact CE1-CB 4.39Å; F28-D32 WeakPolarHBondContact CE1-OD1 3.38Å; F28-D32 WeakPolarHBondContact CE1-OD2 3.38Å; F28-D32 VanDerWaalsContact CZ-OD1 3.23Å; F28-D32 WeakPolarHBondContact CZ-OD1 3.46Å; F28-D32 WeakPolarHBondContact O-CA 3.31Å; F28-D32 WeakPolarHBondContact O-CB 3.05Å; F28-D32 PolarHBondContact O-N 3.41Å |
| 29 | R | 71.6 | Confident | 77.7 | Confident | 199 Ų | 199 | 113.3 Ų | 113.3 | 75% | 0.751 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -66.5 | -34.1 | 177 | -175.8 | -177.1 | -62 | -175.8 | 2.5 | 113 | L25 W26 F27 | L25-R29 WeakPolarHBondContact O-CA 3.23Å; L25-R29 WeakPolarHBondContact O-CB 3.35Å; L25-R29 PolarHBondContact O-N 3.33Å; W26-R29 PolarHBondContact O-N 2.83Å; F27-R29 PolarHBondContact O-N 3.41Å |
| 30 | V | 69.9 | Low | 78.3 | Confident | 85 Ų | 85 | 110.3 Ų | 110.3 | 52% | 0.515 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -77.3 | -32.3 | 175.2 | 166.9 | 0 | 0 | 0 | 0 | 111.3 | W26 F27 F28 | W26-V30 HydrophobicContact CD2-CG2 4.19Å; W26-V30 HydrophobicContact CE3-CG2 4.44Å; W26-V30 HydrophobicContact CH2-CG2 4.37Å; W26-V30 HydrophobicContact CZ2-CG2 4.12Å; W26-V30 VanDerWaalsContact O-CB 3.31Å; W26-V30 WeakPolarHBondContact O-CB 3.45Å; W26-V30 VanDerWaalsContact O-CG2 3.27Å; W26-V30 WeakPolarHBondContact O-CG2 3.29Å; W26-V30 PolarHBondContact O-N 3.5Å; F27-V30 PolarHBondContact O-N 3.03Å; F28-V30 VanDerWaalsContact C-N 3.35Å; F28-V30 PolarHBondContact O-N 2.93Å |
| 31 | E | 64.4 | Low | 78.9 | Confident | 94 Ų | 94 | 110.8 Ų | 110.8 | 44% | 0.439 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -97 | -13.8 | -173.9 | -162.3 | 77.1 | 122.9 | 0 | 0 | 113.8 | F27 F28 A33 P35 | F27-E31 HydrophobicContact CD1-CB 4.37Å; F27-E31 HydrophobicContact CE1-CB 4.2Å; F27-E31 HydrophobicContact CE1-CG 4.03Å; F27-E31 HydrophobicContact CZ-CG 4.24Å; F27-E31 WeakPolarHBondContact O-CB 3.42Å; F27-E31 PolarHBondContact O-N 2.99Å; F28-E31 CarbonylContact O-C 3.56Å; F28-E31 PolarHBondContact O-N 3.49Å; E31-A33 PolarHBondContact O-N 3.45Å; E31-P35 WeakPolarHBondContact O-CD 3.42Å |
| 32 | D | 67.3 | Low | 79.4 | Confident | 91 Ų | 91 | 108.9 Ų | 108.9 | 49% | 0.487 | 54% | 0.543 | S | S | . | . | S | Bend | trans | -67.5 | 125 | -171.8 | -134.2 | -5.1 | 0 | 0 | 0 | 111.5 | F28 S34 | F28-D32 HydrophobicContact CD1-CB 4.44Å; F28-D32 HydrophobicContact CE1-CB 4.39Å; F28-D32 WeakPolarHBondContact CE1-OD1 3.38Å; F28-D32 WeakPolarHBondContact CE1-OD2 3.38Å; F28-D32 VanDerWaalsContact CZ-OD1 3.23Å; F28-D32 WeakPolarHBondContact CZ-OD1 3.46Å; F28-D32 WeakPolarHBondContact O-CA 3.31Å; F28-D32 WeakPolarHBondContact O-CB 3.05Å; F28-D32 PolarHBondContact O-N 3.41Å; D32-S34 PolarHBondContact O-N 2.89Å |
| 33 | A | 61.3 | Low | 80 | Confident | 73 Ų | 73 | 108 Ų | 108 | 60% | 0.603 | 54% | 0.542 | S | S | * | . | S | Bend | trans | 48.6 | -6.9 | 178.8 | 0 | 0 | 0 | 0 | 0 | 118 | E31 W36 N37 | E31-A33 PolarHBondContact O-N 3.45Å; A33-W36 PolarHBondContact O-N 3.05Å; A33-N37 PolarHBondContact O-N 2.79Å; A33-N37 VanDerWaalsContact O-N 3.12Å |
| 34 | S | 64.2 | Low | 80.7 | Confident | 61 Ų | 61 | 103.6 Ų | 103.6 | 43% | 0.427 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -61.1 | -43.8 | -175.7 | 170.6 | 0 | 0 | 0 | 0 | 112.2 | D32 W36 N37 H38 | D32-S34 PolarHBondContact O-N 2.89Å; S34-W36 VanDerWaalsContact C-N 3.31Å; S34-W36 PolarHBondContact O-N 3.33Å; S34-N37 PolarHBondContact O-N 2.9Å; S34-H38 VanDerWaalsContact O-CB 3.32Å; S34-H38 WeakPolarHBondContact O-CB 3.41Å; S34-H38 PolarHBondContact O-N 2.83Å |
| 35 | P | 80.6 | Confident | 81.4 | Confident | 67 Ų | 67 | 100.6 Ų | 100.6 | 44% | 0.435 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -62 | -37 | 177.8 | -23.9 | 34.6 | 0 | 0 | 0 | 113 | E31 S39 | E31-P35 WeakPolarHBondContact O-CD 3.42Å; P35-S39 WeakPolarHBondContact O-CB 3.45Å; P35-S39 PolarHBondContact O-N 2.82Å; P35-S39 PolarHBondContact O-OG 3.11Å |
| 36 | W | 82.2 | Confident | 82.1 | Confident | 194 Ų | 194 | 100.4 Ų | 100.4 | 74% | 0.735 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -68.6 | -44.5 | 178.5 | -177.8 | -99 | 0 | 0 | 0 | 111.4 | A33 S34 S39 I40 | A33-W36 PolarHBondContact O-N 3.05Å; S34-W36 VanDerWaalsContact C-N 3.31Å; S34-W36 PolarHBondContact O-N 3.33Å; W36-S39 PolarHBondContact O-N 2.94Å; W36-I40 HydrophobicContact CD2-CD1 4.49Å; W36-I40 HydrophobicContact CG-CD1 4.39Å; W36-I40 HydrophobicContact CZ2-CD1 4.39Å; W36-I40 VanDerWaalsContact NE1-CD1 3.25Å; W36-I40 WeakPolarHBondContact O-CG1 3.41Å; W36-I40 PolarHBondContact O-N 3.1Å |
| 37 | N | 87.2 | Confident | 82.8 | Confident | 97 Ų | 97 | 96 Ų | 96 | 52% | 0.519 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -66.1 | -43.1 | 177.2 | -166.9 | 27 | 0 | 0 | 0 | 111.5 | A33 S34 S39 I40 L41 | A33-N37 PolarHBondContact O-N 2.79Å; A33-N37 VanDerWaalsContact O-N 3.12Å; S34-N37 PolarHBondContact O-N 2.9Å; N37-S39 VanDerWaalsContact C-N 3.32Å; N37-S39 PolarHBondContact O-N 3.45Å; N37-I40 PolarHBondContact O-N 3.46Å; N37-L41 WeakPolarHBondContact O-CB 3.4Å; N37-L41 VanDerWaalsContact O-CG 3.28Å; N37-L41 WeakPolarHBondContact O-CG 3.26Å; N37-L41 PolarHBondContact O-N 3.47Å |
| 38 | H | 85.5 | Confident | 84 | Confident | 131 Ų | 131 | 94.9 Ų | 94.9 | 61% | 0.606 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -65.5 | -36.9 | 177.2 | -148.7 | 75 | 0 | 0 | 0 | 111.7 | S34 L41 A42 | S34-H38 VanDerWaalsContact O-CB 3.32Å; S34-H38 WeakPolarHBondContact O-CB 3.41Å; S34-H38 PolarHBondContact O-N 2.83Å; H38-L41 PolarHBondContact O-N 3.21Å; H38-A42 VanDerWaalsContact O-CB 3.24Å; H38-A42 WeakPolarHBondContact O-CB 3.21Å; H38-A42 PolarHBondContact O-N 2.62Å |
| 39 | S | 91.7 | Very high | 85.3 | Confident | 74 Ų | 74 | 95.1 Ų | 95.1 | 52% | 0.517 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -64.5 | -43.2 | 174.6 | -63.3 | 0 | 0 | 0 | 0 | 112.1 | P35 W36 N37 A42 L43 | P35-S39 WeakPolarHBondContact O-CB 3.45Å; P35-S39 PolarHBondContact O-N 2.82Å; P35-S39 PolarHBondContact O-OG 3.11Å; W36-S39 PolarHBondContact O-N 2.94Å; N37-S39 VanDerWaalsContact C-N 3.32Å; N37-S39 PolarHBondContact O-N 3.45Å; S39-A42 PolarHBondContact O-N 3.17Å; S39-L43 VanDerWaalsContact O-CB 3.27Å; S39-L43 WeakPolarHBondContact O-CB 3.3Å; S39-L43 PolarHBondContact O-N 3.26Å |
| 40 | I | 92.8 | Very high | 86.5 | Confident | 83 Ų | 83 | 90 Ų | 90 | 43% | 0.426 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -64.6 | -44.1 | 175.5 | -71.1 | 171.2 | 0 | 0 | 0 | 110.8 | W36 N37 L43 A44 | W36-I40 HydrophobicContact CD2-CD1 4.49Å; W36-I40 HydrophobicContact CG-CD1 4.39Å; W36-I40 HydrophobicContact CZ2-CD1 4.39Å; W36-I40 VanDerWaalsContact NE1-CD1 3.25Å; W36-I40 WeakPolarHBondContact O-CG1 3.41Å; W36-I40 PolarHBondContact O-N 3.1Å; N37-I40 PolarHBondContact O-N 3.46Å; I40-L43 PolarHBondContact O-N 3.09Å; I40-A44 VanDerWaalsContact O-CB 3.3Å; I40-A44 WeakPolarHBondContact O-CB 3.21Å; I40-A44 PolarHBondContact O-N 3.07Å |
| 41 | L | 93.8 | Very high | 87.7 | Confident | 98 Ų | 98 | 89.1 Ų | 89.1 | 51% | 0.513 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -63.2 | -43.9 | 177.4 | -73.1 | 172.7 | 0 | 0 | 0 | 111.8 | N37 H38 A44 A45 | N37-L41 WeakPolarHBondContact O-CB 3.4Å; N37-L41 VanDerWaalsContact O-CG 3.28Å; N37-L41 WeakPolarHBondContact O-CG 3.26Å; N37-L41 PolarHBondContact O-N 3.47Å; H38-L41 PolarHBondContact O-N 3.21Å; L41-A44 PolarHBondContact O-N 3.02Å; L41-A45 WeakPolarHBondContact O-CB 3.48Å; L41-A45 PolarHBondContact O-N 3.34Å |
| 42 | A | 95.4 | Very high | 89.2 | Confident | 49 Ų | 49 | 91 Ų | 91 | 41% | 0.405 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62.8 | -45.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.2 | H38 S39 A44 A45 V46 | H38-A42 VanDerWaalsContact O-CB 3.24Å; H38-A42 WeakPolarHBondContact O-CB 3.21Å; H38-A42 PolarHBondContact O-N 2.62Å; S39-A42 PolarHBondContact O-N 3.17Å; A42-A44 PolarHBondContact O-N 3.35Å; A42-A45 PolarHBondContact O-N 2.94Å; A42-V46 WeakPolarHBondContact O-CG2 3.26Å; A42-V46 PolarHBondContact O-N 3.43Å |
| 43 | L | 96.9 | Very high | 90.6 | Very high | 117 Ų | 117 | 92.2 Ų | 92.2 | 61% | 0.613 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -60.4 | -46.4 | 176.1 | -177.8 | 64.3 | 0 | 0 | 0 | 111.3 | S39 I40 A45 V46 V47 | S39-L43 VanDerWaalsContact O-CB 3.27Å; S39-L43 WeakPolarHBondContact O-CB 3.3Å; S39-L43 PolarHBondContact O-N 3.26Å; I40-L43 PolarHBondContact O-N 3.09Å; L43-A45 VanDerWaalsContact C-N 3.34Å; L43-A45 PolarHBondContact O-N 3.23Å; L43-V46 PolarHBondContact O-N 3.48Å; L43-V47 WeakPolarHBondContact O-CG2 3.44Å; L43-V47 PolarHBondContact O-N 3.49Å |
| 44 | A | 97.3 | Very high | 92.1 | Very high | 48 Ų | 48 | 93.9 Ų | 93.9 | 40% | 0.397 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -59.9 | -43.9 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | I40 L41 A42 V46 V47 V48 | I40-A44 VanDerWaalsContact O-CB 3.3Å; I40-A44 WeakPolarHBondContact O-CB 3.21Å; I40-A44 PolarHBondContact O-N 3.07Å; L41-A44 PolarHBondContact O-N 3.02Å; A42-A44 PolarHBondContact O-N 3.35Å; A44-V46 PolarHBondContact O-N 2.82Å; A44-V47 PolarHBondContact O-N 3.29Å; A44-V48 WeakPolarHBondContact O-CG2 3.33Å; A44-V48 PolarHBondContact O-N 3.48Å |
| 45 | A | 97.4 | Very high | 93.5 | Very high | 55 Ų | 55 | 95.8 Ų | 95.8 | 46% | 0.455 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -61.1 | -43.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | L41 A42 L43 V48 M49 | L41-A45 WeakPolarHBondContact O-CB 3.48Å; L41-A45 PolarHBondContact O-N 3.34Å; A42-A45 PolarHBondContact O-N 2.94Å; L43-A45 VanDerWaalsContact C-N 3.34Å; L43-A45 PolarHBondContact O-N 3.23Å; A45-V48 PolarHBondContact O-N 2.9Å; A45-M49 WeakPolarHBondContact O-CB 3.46Å; A45-M49 WeakPolarHBondContact O-CG 3.26Å; A45-M49 PolarHBondContact O-N 3.26Å |
| 46 | V | 98.2 | Very high | 93.9 | Very high | 82 Ų | 82 | 94.1 Ų | 94.1 | 50% | 0.497 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -61.5 | -45 | 176.1 | 171.8 | 0 | 0 | 0 | 0 | 111.2 | A42 L43 A44 V48 M49 I50 | A42-V46 WeakPolarHBondContact O-CG2 3.26Å; A42-V46 PolarHBondContact O-N 3.43Å; L43-V46 PolarHBondContact O-N 3.48Å; A44-V46 PolarHBondContact O-N 2.82Å; V46-V48 PolarHBondContact O-N 2.85Å; V46-M49 PolarHBondContact O-N 3.49Å; V46-I50 HydrophobicContact CG1-CD1 3.72Å; V46-I50 HydrophobicContact CG1-CG1 4.39Å; V46-I50 VanDerWaalsContact O-CG1 3.3Å; V46-I50 WeakPolarHBondContact O-CG1 3.44Å; V46-I50 PolarHBondContact O-N 3.34Å |
| 47 | V | 97.7 | Very high | 94.2 | Very high | 79 Ų | 79 | 92.1 Ų | 92.1 | 48% | 0.479 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -61.4 | -44.7 | 177.7 | 171.7 | 0 | 0 | 0 | 0 | 111.4 | L43 A44 M49 I50 S51 | L43-V47 WeakPolarHBondContact O-CG2 3.44Å; L43-V47 PolarHBondContact O-N 3.49Å; A44-V47 PolarHBondContact O-N 3.29Å; V47-M49 VanDerWaalsContact C-N 3.35Å; V47-M49 PolarHBondContact O-N 2.97Å; V47-I50 PolarHBondContact O-N 3.29Å; V47-S51 VanDerWaalsContact O-CB 3.32Å; V47-S51 WeakPolarHBondContact O-CB 3.36Å; V47-S51 PolarHBondContact O-N 3.47Å; V47-S51 PolarHBondContact O-OG 2.99Å |
| 48 | V | 97.8 | Very high | 94 | Very high | 92 Ų | 92 | 90.5 Ų | 90.5 | 56% | 0.558 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -61.9 | -44.3 | 176.8 | 170.8 | 0 | 0 | 0 | 0 | 110.7 | A44 A45 V46 S51 M52 | A44-V48 WeakPolarHBondContact O-CG2 3.33Å; A44-V48 PolarHBondContact O-N 3.48Å; A45-V48 PolarHBondContact O-N 2.9Å; V46-V48 PolarHBondContact O-N 2.85Å; V48-S51 PolarHBondContact O-N 3.18Å; V48-M52 WeakPolarHBondContact O-CB 3.38Å; V48-M52 PolarHBondContact O-N 3.45Å |
| 49 | M | 97.6 | Very high | 93.8 | Very high | 128 Ų | 128 | 88.5 Ų | 88.5 | 63% | 0.631 | 50% | 0.499 | S | S | * | . | H | α-helix | trans | -61.7 | -46.2 | 178 | -74.7 | -67.7 | -69.4 | 0 | 0 | 112.1 | A45 V46 V47 M52 F53 | A45-M49 WeakPolarHBondContact O-CB 3.46Å; A45-M49 WeakPolarHBondContact O-CG 3.26Å; A45-M49 PolarHBondContact O-N 3.26Å; V46-M49 PolarHBondContact O-N 3.49Å; V47-M49 VanDerWaalsContact C-N 3.35Å; V47-M49 PolarHBondContact O-N 2.97Å; M49-M52 PolarHBondContact O-N 3.22Å; M49-F53 VanDerWaalsContact O-CB 3.26Å; M49-F53 WeakPolarHBondContact O-CB 3.35Å; M49-F53 PolarHBondContact O-N 2.87Å |
| 50 | I | 97 | Very high | 92.9 | Very high | 92 Ų | 92 | 91.1 Ų | 91.1 | 47% | 0.472 | 50% | 0.503 | S | S | . | . | H | α-helix | trans | -62.3 | -45.5 | 176.4 | -66.8 | 166.5 | 0 | 0 | 0 | 110.1 | V46 V47 M52 F53 L54 | V46-I50 HydrophobicContact CG1-CD1 3.72Å; V46-I50 HydrophobicContact CG1-CG1 4.39Å; V46-I50 VanDerWaalsContact O-CG1 3.3Å; V46-I50 WeakPolarHBondContact O-CG1 3.44Å; V46-I50 PolarHBondContact O-N 3.34Å; V47-I50 PolarHBondContact O-N 3.29Å; I50-M52 PolarHBondContact O-N 3.18Å; I50-F53 PolarHBondContact O-N 3.07Å; I50-L54 HydrophobicContact CG2-CD1 3.9Å; I50-L54 HydrophobicContact CG2-CG 4.24Å; I50-L54 WeakPolarHBondContact O-CB 3.35Å; I50-L54 WeakPolarHBondContact O-CG 3.34Å; I50-L54 PolarHBondContact O-N 3.4Å |
| 51 | S | 95.9 | Very high | 91.7 | Very high | 66 Ų | 66 | 90 Ų | 90 | 46% | 0.462 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -59.6 | -46.8 | 178.9 | -59 | 0 | 0 | 0 | 0 | 111.5 | V47 V48 F53 L54 L55 | V47-S51 VanDerWaalsContact O-CB 3.32Å; V47-S51 WeakPolarHBondContact O-CB 3.36Å; V47-S51 PolarHBondContact O-N 3.47Å; V47-S51 PolarHBondContact O-OG 2.99Å; V48-S51 PolarHBondContact O-N 3.18Å; S51-F53 VanDerWaalsContact C-N 3.33Å; S51-F53 PolarHBondContact O-N 2.87Å; S51-L54 PolarHBondContact O-N 2.93Å; S51-L55 VanDerWaalsContact O-CB 3.25Å; S51-L55 WeakPolarHBondContact O-CB 3.25Å; S51-L55 PolarHBondContact O-N 3.46Å |
| 52 | M | 96.4 | Very high | 90.2 | Very high | 133 Ų | 133 | 88 Ų | 88 | 66% | 0.655 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -65.7 | -36.9 | 178 | -169.3 | 171.9 | 123.2 | 0 | 0 | 111.7 | V48 M49 I50 G56 | V48-M52 WeakPolarHBondContact O-CB 3.38Å; V48-M52 PolarHBondContact O-N 3.45Å; M49-M52 PolarHBondContact O-N 3.22Å; I50-M52 PolarHBondContact O-N 3.18Å; M52-G56 PolarHBondContact O-N 2.94Å |
| 53 | F | 95.6 | Very high | 88.6 | Confident | 117 Ų | 117 | 94.1 Ų | 94.1 | 51% | 0.513 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -67.6 | -46 | 176.7 | -177.5 | -108 | 0 | 0 | 0 | 112.8 | M49 I50 S51 L55 G56 R57 | M49-F53 VanDerWaalsContact O-CB 3.26Å; M49-F53 WeakPolarHBondContact O-CB 3.35Å; M49-F53 PolarHBondContact O-N 2.87Å; I50-F53 PolarHBondContact O-N 3.07Å; S51-F53 VanDerWaalsContact C-N 3.33Å; S51-F53 PolarHBondContact O-N 2.87Å; F53-L55 VanDerWaalsContact C-N 3.32Å; F53-G56 PolarHBondContact O-N 2.91Å; F53-R57 PolarHBondContact O-N 3.43Å |
| 54 | L | 93.1 | Very high | 86.7 | Confident | 108 Ų | 108 | 95.9 Ų | 95.9 | 57% | 0.565 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -62.2 | -41.8 | 175.2 | -69.8 | 176 | 0 | 0 | 0 | 111 | I50 S51 R57 S58 | I50-L54 HydrophobicContact CG2-CD1 3.9Å; I50-L54 HydrophobicContact CG2-CG 4.24Å; I50-L54 WeakPolarHBondContact O-CB 3.35Å; I50-L54 WeakPolarHBondContact O-CG 3.34Å; I50-L54 PolarHBondContact O-N 3.4Å; S51-L54 PolarHBondContact O-N 2.93Å; L54-R57 PolarHBondContact O-N 3.36Å; L54-S58 WeakPolarHBondContact O-CB 3.32Å; L54-S58 PolarHBondContact O-N 2.85Å; L54-S58 PolarHBondContact O-OG 3.49Å |
| 55 | L | 92.7 | Very high | 84.8 | Confident | 102 Ų | 102 | 100.9 Ų | 100.9 | 53% | 0.534 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -64.3 | -43.9 | 175.2 | -174.9 | 61.5 | 0 | 0 | 0 | 111.9 | S51 F53 R57 S58 I59 | S51-L55 VanDerWaalsContact O-CB 3.25Å; S51-L55 WeakPolarHBondContact O-CB 3.25Å; S51-L55 PolarHBondContact O-N 3.46Å; F53-L55 VanDerWaalsContact C-N 3.32Å; L55-R57 VanDerWaalsContact C-N 3.32Å; L55-R57 PolarHBondContact O-N 3.32Å; L55-S58 PolarHBondContact O-N 3.21Å; L55-S58 PolarHBondContact O-OG 2.63Å; L55-I59 HydrophobicContact CD1-CD1 4.17Å; L55-I59 HydrophobicContact CD1-CG1 4.49Å; L55-I59 HydrophobicContact CG-CD1 4.03Å; L55-I59 VanDerWaalsContact O-CG1 3.26Å; L55-I59 WeakPolarHBondContact O-CG1 3.39Å; L55-I59 PolarHBondContact O-N 3.33Å |
| 56 | G | 90.7 | Very high | 82.9 | Confident | 32 Ų | 32 | 106.9 Ų | 106.9 | 33% | 0.33 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -60.1 | -42.9 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.9 | M52 F53 Q60 | M52-G56 PolarHBondContact O-N 2.94Å; F53-G56 PolarHBondContact O-N 2.91Å; G56-Q60 WeakPolarHBondContact O-CB 3.23Å; G56-Q60 WeakPolarHBondContact O-CG 3.21Å; G56-Q60 PolarHBondContact O-N 3.27Å |
| 57 | R | 87.5 | Confident | 80.7 | Confident | 152 Ų | 152 | 110.4 Ų | 110.4 | 57% | 0.574 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -67 | -41.6 | 175.7 | -86.7 | -160.6 | 151.5 | 128.1 | 2.5 | 113.2 | F53 L54 L55 I59 Q60 A61 | F53-R57 PolarHBondContact O-N 3.43Å; L54-R57 PolarHBondContact O-N 3.36Å; L55-R57 VanDerWaalsContact C-N 3.32Å; L55-R57 PolarHBondContact O-N 3.32Å; R57-I59 VanDerWaalsContact C-N 3.33Å; R57-I59 PolarHBondContact O-N 2.82Å; R57-Q60 PolarHBondContact O-N 2.97Å; R57-A61 VanDerWaalsContact O-CB 3.31Å; R57-A61 WeakPolarHBondContact O-CB 3.32Å; R57-A61 PolarHBondContact O-N 3.41Å |
| 58 | S | 82.6 | Confident | 78.6 | Confident | 62 Ų | 62 | 113.6 Ų | 113.6 | 43% | 0.434 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -64.6 | -39.7 | 179.5 | 71.6 | 0 | 0 | 0 | 0 | 111.2 | L54 L55 S62 | L54-S58 WeakPolarHBondContact O-CB 3.32Å; L54-S58 PolarHBondContact O-N 2.85Å; L54-S58 PolarHBondContact O-OG 3.49Å; L55-S58 PolarHBondContact O-N 3.21Å; L55-S58 PolarHBondContact O-OG 2.63Å; S58-S62 WeakPolarHBondContact O-CB 3.22Å; S58-S62 PolarHBondContact O-N 3.37Å; S58-S62 PolarHBondContact O-OG 3.04Å |
| 59 | I | 81.4 | Confident | 76.3 | Confident | 90 Ų | 90 | 113.9 Ų | 113.9 | 46% | 0.462 | 57% | 0.573 | S | S | . | * | H | α-helix | trans | -67.2 | -42.1 | 174.5 | -64.2 | 167.3 | 0 | 0 | 0 | 111.1 | L55 R57 S62 R63 | L55-I59 HydrophobicContact CD1-CD1 4.17Å; L55-I59 HydrophobicContact CD1-CG1 4.49Å; L55-I59 HydrophobicContact CG-CD1 4.03Å; L55-I59 VanDerWaalsContact O-CG1 3.26Å; L55-I59 WeakPolarHBondContact O-CG1 3.39Å; L55-I59 PolarHBondContact O-N 3.33Å; R57-I59 VanDerWaalsContact C-N 3.33Å; R57-I59 PolarHBondContact O-N 2.82Å; I59-S62 WeakPolarHBondContact CA-OG 3.27Å; I59-S62 PolarHBondContact O-N 2.88Å; I59-S62 PolarHBondContact O-OG 3.42Å; I59-R63 WeakPolarHBondContact O-CB 3.24Å; I59-R63 PolarHBondContact O-N 2.92Å |
| 60 | Q | 73.4 | Confident | 74.2 | Confident | 128 Ų | 128 | 113.4 Ų | 113.4 | 60% | 0.598 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -64.8 | -43.3 | 176.1 | -78.1 | -174.8 | 8.3 | 0 | 0 | 112.2 | G56 R57 R63 K64 | G56-Q60 WeakPolarHBondContact O-CB 3.23Å; G56-Q60 WeakPolarHBondContact O-CG 3.21Å; G56-Q60 PolarHBondContact O-N 3.27Å; R57-Q60 PolarHBondContact O-N 2.97Å; Q60-R63 PolarHBondContact O-N 3.21Å; Q60-K64 WeakPolarHBondContact O-CB 3.21Å; Q60-K64 WeakPolarHBondContact O-CG 3.41Å; Q60-K64 PolarHBondContact O-N 3.4Å |
| 61 | A | 66.8 | Low | 72 | Confident | 60 Ų | 60 | 117.8 Ų | 117.8 | 50% | 0.496 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -63.2 | -42.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | R57 K64 Q65 | R57-A61 VanDerWaalsContact O-CB 3.31Å; R57-A61 WeakPolarHBondContact O-CB 3.32Å; R57-A61 PolarHBondContact O-N 3.41Å; A61-K64 PolarHBondContact O-N 3.35Å; A61-Q65 WeakPolarHBondContact O-CB 3.39Å; A61-Q65 PolarHBondContact O-N 3.48Å |
| 62 | S | 62.3 | Low | 69.6 | Low | 55 Ų | 55 | 123.5 Ų | 123.5 | 39% | 0.385 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -73 | -26.6 | 177.4 | 47.6 | 0 | 0 | 0 | 0 | 113.5 | S58 I59 K66 | S58-S62 WeakPolarHBondContact O-CB 3.22Å; S58-S62 PolarHBondContact O-N 3.37Å; S58-S62 PolarHBondContact O-OG 3.04Å; I59-S62 WeakPolarHBondContact CA-OG 3.27Å; I59-S62 PolarHBondContact O-N 2.88Å; I59-S62 PolarHBondContact O-OG 3.42Å; S62-K66 WeakPolarHBondContact O-CG 3.39Å; S62-K66 PolarHBondContact O-N 3.28Å |
| 63 | R | 61.3 | Low | 67.2 | Low | 179 Ų | 179 | 126 Ų | 126 | 68% | 0.675 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -71.6 | -41 | 166.1 | -93.8 | -172.3 | 167.2 | -124.9 | 1.1 | 112.8 | I59 Q60 Q65 K66 M67 | I59-R63 WeakPolarHBondContact O-CB 3.24Å; I59-R63 PolarHBondContact O-N 2.92Å; Q60-R63 PolarHBondContact O-N 3.21Å; R63-Q65 VanDerWaalsContact C-N 3.28Å; R63-Q65 PolarHBondContact O-N 2.9Å; R63-K66 PolarHBondContact O-N 2.85Å; R63-M67 PolarHBondContact O-N 3.42Å; R63-M67 VanDerWaalsContact O-N 3.11Å |
| 64 | K | 57.8 | Low | 64.4 | Low | 154 Ų | 154 | 125.6 Ų | 125.6 | 67% | 0.67 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -61 | -39.4 | 176 | -68.2 | -98.2 | -176.1 | -176.8 | 0 | 110.9 | Q60 A61 M67 Q68 | Q60-K64 WeakPolarHBondContact O-CB 3.21Å; Q60-K64 WeakPolarHBondContact O-CG 3.41Å; Q60-K64 PolarHBondContact O-N 3.4Å; A61-K64 PolarHBondContact O-N 3.35Å; K64-M67 PolarHBondContact O-N 3.5Å; K64-Q68 PolarHBondContact O-N 3.29Å |
| 65 | Q | 58 | Low | 62.5 | Low | 152 Ų | 152 | 125.4 Ų | 125.4 | 71% | 0.71 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -68.4 | -31.8 | 175.8 | -164 | 177.2 | 32.4 | 0 | 0 | 113 | A61 R63 M67 | A61-Q65 WeakPolarHBondContact O-CB 3.39Å; A61-Q65 PolarHBondContact O-N 3.48Å; R63-Q65 VanDerWaalsContact C-N 3.28Å; R63-Q65 PolarHBondContact O-N 2.9Å; Q65-M67 VanDerWaalsContact C-N 3.33Å |
| 66 | K | 56.4 | Low | 60.4 | Low | 182 Ų | 182 | 128.7 Ų | 128.7 | 79% | 0.791 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -77.8 | -14.3 | 173.6 | -74.2 | 178 | 177.5 | -71.4 | 0 | 114.2 | S62 R63 | S62-K66 WeakPolarHBondContact O-CG 3.39Å; S62-K66 PolarHBondContact O-N 3.28Å; R63-K66 PolarHBondContact O-N 2.85Å |
| 67 | M | 53.4 | Low | 58.2 | Low | 156 Ų | 156 | 133 Ų | 133 | 77% | 0.768 | 67% | 0.666 | S | S | * | * | H | α-helix | trans | -96.6 | -14.9 | 175.3 | -84.8 | 176 | 154.1 | 0 | 0 | 113.3 | R63 K64 Q65 P69 | R63-M67 PolarHBondContact O-N 3.42Å; R63-M67 VanDerWaalsContact O-N 3.11Å; K64-M67 PolarHBondContact O-N 3.5Å; Q65-M67 VanDerWaalsContact C-N 3.33Å; M67-P69 VanDerWaalsContact O-CD 3.29Å; M67-P69 WeakPolarHBondContact O-CD 3.3Å |
| 68 | Q | 52.8 | Low | 56.4 | Low | 145 Ų | 145 | 131.6 Ų | 131.6 | 68% | 0.678 | 67% | 0.669 | S | S | * | * | S | Bend | trans | -68 | 118.8 | 158 | -85.3 | -166.5 | 17.1 | 0 | 0 | 106.8 | K64 | K64-Q68 PolarHBondContact O-N 3.29Š|
| 69 | P | 48.8 | Very low | 54.6 | Low | 98 Ų | 98 | 137.6 Ų | 137.6 | 64% | 0.636 | 69% | 0.69 | S | S | * | * | trans | -53 | 144.4 | 165.9 | -13.6 | 26.5 | 0 | 0 | 0 | 107.4 | M67 E71 | M67-P69 VanDerWaalsContact O-CD 3.29Å; M67-P69 WeakPolarHBondContact O-CD 3.3Å; P69-E71 VanDerWaalsContact C-N 3.3Å; P69-E71 PolarHBondContact O-N 2.74Å | ||
| 70 | P | 53.4 | Low | 52.9 | Low | 118 Ų | 118 | 141.4 Ų | 141.4 | 77% | 0.766 | 71% | 0.71 | S | S | * | * | trans | -52.1 | 108 | 160.7 | 23.1 | -30 | 0 | 0 | 0 | 105.8 | K72 | P70-K72 PolarHBondContact O-N 3.31Š| ||
| 71 | E | 50.7 | Low | 51.5 | Low | 184 Ų | 184 | 140.5 Ų | 140.5 | 86% | 0.86 | 71% | 0.709 | S | S | * | * | trans | -56.4 | 111.6 | 178.2 | -174.8 | 171.4 | 106.2 | 0 | 0 | 105.1 | P69 E73 | P69-E71 VanDerWaalsContact C-N 3.3Å; P69-E71 PolarHBondContact O-N 2.74Å; E71-E73 PolarHBondContact O-N 3.41Å | ||
| 72 | K | 47.2 | Very low | 50.8 | Low | 186 Ų | 186 | 142.7 Ų | 142.7 | 81% | 0.809 | 71% | 0.709 | S | S | * | * | trans | -52.5 | 117.6 | -178.6 | -68.5 | 164 | 178 | 169.2 | 0 | 106.6 | P70 N74 | P70-K72 PolarHBondContact O-N 3.31Å; K72-N74 PolarHBondContact O-N 2.89Å | ||
| 73 | E | 44.5 | Very low | 50.1 | Low | 185 Ų | 185 | 144.8 Ų | 144.8 | 86% | 0.864 | 73% | 0.73 | S | S | * | * | trans | -41.1 | 95.6 | 149.6 | -178.4 | -171.3 | 127.1 | 0 | 0 | 108.2 | E71 | E71-E73 PolarHBondContact O-N 3.41Š| ||
| 74 | N | 36.8 | Very low | 49.4 | Very low | 110 Ų | 110 | 146.8 Ų | 146.8 | 59% | 0.588 | 74% | 0.737 | S | S | * | * | trans | -126.4 | 95.2 | 164.6 | -167.8 | -30.3 | 0 | 0 | 0 | 106.8 | K72 E76 | K72-N74 PolarHBondContact O-N 2.89Å; N74-E76 PolarHBondContact O-N 3.47Å | ||
| 75 | P | 53.2 | Low | 48.9 | Very low | 103 Ų | 103 | 142 Ų | 142 | 67% | 0.669 | 72% | 0.721 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.7 | 58.2 | -175.3 | 34.9 | -35.1 | 0 | 0 | 0 | 111.2 | ||
| 76 | E | 49.3 | Very low | 48.7 | Very low | 171 Ų | 171 | 141.8 Ų | 141.8 | 80% | 0.799 | 72% | 0.718 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -139.9 | -1.6 | 179.9 | -103.2 | -179.3 | 156 | 0 | 0 | 116.5 | N74 | N74-E76 PolarHBondContact O-N 3.47Š|
| 77 | V | 45.2 | Very low | 48.7 | Very low | 123 Ų | 123 | 138.9 Ų | 138.9 | 75% | 0.745 | 71% | 0.711 | S | S | * | * | S | Bend | trans | -117 | 0.4 | 179.4 | -166.7 | 0 | 0 | 0 | 0 | 113.4 | H79 | V77-H79 VanDerWaalsContact C-N 3.27Å; V77-H79 PolarHBondContact O-N 2.89Å |
| 78 | L | 48 | Very low | 48.8 | Very low | 123 Ų | 123 | 137.8 Ų | 137.8 | 64% | 0.644 | 70% | 0.704 | S | S | * | * | H | α-helix | trans | -69.4 | -10.3 | -176.6 | -99.8 | 164.3 | 0 | 0 | 0 | 115.7 | ||
| 79 | H | 46.6 | Very low | 49.4 | Very low | 187 Ų | 187 | 134.6 Ų | 134.6 | 87% | 0.866 | 69% | 0.691 | S | S | * | * | H | α-helix | trans | -94.6 | -11.1 | -167.8 | -101.2 | -85.4 | 0 | 0 | 0 | 116.8 | V77 | V77-H79 VanDerWaalsContact C-N 3.27Å; V77-H79 PolarHBondContact O-N 2.89Å |
| 80 | L | 45.1 | Very low | 50 | Low | 171 Ų | 171 | 134.9 Ų | 134.9 | 90% | 0.895 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -103.9 | -20.1 | 179.2 | -119 | 94.8 | 0 | 0 | 0 | 114.5 | ||
| 81 | D | 44.6 | Very low | 50.9 | Low | 108 Ų | 108 | 134.7 Ų | 134.7 | 58% | 0.578 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -98 | -12.4 | -175.8 | -149.3 | -101.4 | 0 | 0 | 0 | 113.7 | A83 R84 T85 | D81-A83 PolarHBondContact O-N 3.04Å; D81-A83 VanDerWaalsContact O-N 3.12Å; D81-R84 PolarHBondContact O-N 2.67Å; D81-T85 PolarHBondContact O-OG1 3.04Å |
| 82 | E | 51.3 | Low | 51.6 | Low | 107 Ų | 107 | 130 Ų | 130 | 50% | 0.5 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -58.5 | -25 | -180 | -170.3 | 90.3 | -144.5 | 0 | 0 | 113.4 | R84 | E82-R84 VanDerWaalsContact C-N 3.33Å; E82-R84 PolarHBondContact O-N 2.84Å |
| 83 | A | 47.6 | Very low | 52.5 | Low | 98 Ų | 98 | 126.3 Ų | 126.3 | 81% | 0.81 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -75 | -18.2 | -177.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | D81 | D81-A83 PolarHBondContact O-N 3.04Å; D81-A83 VanDerWaalsContact O-N 3.12Å |
| 84 | R | 45.7 | Very low | 53.7 | Low | 221 Ų | 221 | 121.9 Ų | 121.9 | 83% | 0.834 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -104.8 | -24.6 | -177.3 | -162.1 | 177.5 | -164.9 | 176.6 | 4.8 | 113.7 | D81 E82 | D81-R84 PolarHBondContact O-N 2.67Å; E82-R84 VanDerWaalsContact C-N 3.33Å; E82-R84 PolarHBondContact O-N 2.84Å |
| 85 | T | 49.2 | Very low | 55.4 | Low | 54 Ų | 54 | 124.8 Ų | 124.8 | 33% | 0.331 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -91.4 | -16.9 | -174.2 | 52.9 | 0 | 0 | 0 | 0 | 113.5 | D81 D87 H88 N89 | D81-T85 PolarHBondContact O-OG1 3.04Å; T85-D87 PolarHBondContact O-N 3.4Å; T85-H88 PolarHBondContact O-N 3.49Å; T85-N89 PolarHBondContact O-N 2.88Å; T85-N89 PolarHBondContact O-OD1 3.48Å |
| 86 | K | 52 | Low | 55.9 | Low | 147 Ų | 147 | 126.1 Ų | 126.1 | 64% | 0.639 | 63% | 0.631 | S | S | * | * | H | α-helix | trans | -50.6 | -33 | -177 | -170.9 | 168.8 | -179.5 | 173.2 | 0 | 115.1 | N90 | K86-N90 PolarHBondContact O-N 3.26Å |
| 87 | D | 57.1 | Low | 56.6 | Low | 121 Ų | 121 | 121.3 Ų | 121.3 | 65% | 0.647 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -74.2 | -33.6 | -179.3 | -62.2 | -42 | 0 | 0 | 0 | 113.2 | T85 N89 L91 | T85-D87 PolarHBondContact O-N 3.4Å; D87-N89 VanDerWaalsContact C-N 3.34Å; D87-L91 PolarHBondContact O-N 2.98Å |
| 88 | H | 56.8 | Low | 57.6 | Low | 133 Ų | 133 | 120.7 Ų | 120.7 | 62% | 0.616 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -73.3 | -31.2 | 176.2 | -100.8 | 61 | 0 | 0 | 0 | 112 | T85 N92 | T85-H88 PolarHBondContact O-N 3.49Å; H88-N92 WeakPolarHBondContact O-CB 3.28Å; H88-N92 PolarHBondContact O-N 2.95Å; H88-N92 PolarHBondContact O-ND2 2.83Å |
| 89 | N | 64.4 | Low | 58.2 | Low | 79 Ų | 79 | 120.4 Ų | 120.4 | 42% | 0.422 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -69.7 | -38.8 | -178.6 | -47.9 | -7.2 | 0 | 0 | 0 | 110.2 | T85 D87 N93 | T85-N89 PolarHBondContact O-N 2.88Å; T85-N89 PolarHBondContact O-OD1 3.48Å; D87-N89 VanDerWaalsContact C-N 3.34Å; N89-N93 VanDerWaalsContact O-CB 3.32Å; N89-N93 WeakPolarHBondContact O-CB 3.01Å; N89-N93 PolarHBondContact O-N 3.37Å |
| 90 | N | 62.4 | Low | 58.4 | Low | 103 Ų | 103 | 116 Ų | 116 | 55% | 0.551 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -68.6 | -43.7 | 177.8 | -171 | -94.3 | 0 | 0 | 0 | 112 | K86 N92 N93 L94 | K86-N90 PolarHBondContact O-N 3.26Å; N90-N92 PolarHBondContact O-N 3.45Å; N90-N93 PolarHBondContact O-N 2.95Å; N90-L94 WeakPolarHBondContact O-CB 3.42Å; N90-L94 PolarHBondContact O-N 2.89Å |
| 91 | L | 70.3 | Confident | 58.6 | Low | 115 Ų | 115 | 115.3 Ų | 115.3 | 60% | 0.602 | 59% | 0.586 | S | S | * | * | H | α-helix | trans | -62.7 | -42.2 | 176.1 | -80.8 | 165.3 | 0 | 0 | 0 | 112.1 | D87 R95 | D87-L91 PolarHBondContact O-N 2.98Å; L91-R95 VanDerWaalsContact O-CB 3.25Å; L91-R95 WeakPolarHBondContact O-CB 3.32Å; L91-R95 PolarHBondContact O-N 2.98Å |
| 92 | N | 65.6 | Low | 59.3 | Low | 85 Ų | 85 | 117.4 Ų | 117.4 | 46% | 0.455 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -65.5 | -47.2 | 175.3 | -75.2 | -22.2 | 0 | 0 | 0 | 110.6 | H88 N90 L94 R95 E96 | H88-N92 WeakPolarHBondContact O-CB 3.28Å; H88-N92 PolarHBondContact O-N 2.95Å; H88-N92 PolarHBondContact O-ND2 2.83Å; N90-N92 PolarHBondContact O-N 3.45Å; N92-L94 VanDerWaalsContact C-N 3.31Å; N92-L94 PolarHBondContact O-N 3.25Å; N92-R95 PolarHBondContact O-N 3.31Å; N92-R95 VanDerWaalsContact O-N 3.14Å; N92-E96 WeakPolarHBondContact O-CB 3.44Å; N92-E96 WeakPolarHBondContact O-CG 3.33Å; N92-E96 PolarHBondContact O-N 3.27Å |
| 93 | N | 67.4 | Low | 59.1 | Low | 108 Ų | 108 | 116.9 Ų | 116.9 | 58% | 0.578 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -59.9 | -39.4 | 178.4 | -168.8 | -96 | 0 | 0 | 0 | 112.9 | N89 N90 E96 T97 | N89-N93 VanDerWaalsContact O-CB 3.32Å; N89-N93 WeakPolarHBondContact O-CB 3.01Å; N89-N93 PolarHBondContact O-N 3.37Å; N90-N93 PolarHBondContact O-N 2.95Å; N93-E96 PolarHBondContact O-N 3.47Å; N93-T97 WeakPolarHBondContact O-CB 3.23Å; N93-T97 PolarHBondContact O-N 3.45Å; N93-T97 PolarHBondContact O-OG1 3.3Å |
| 94 | L | 69.9 | Low | 59.2 | Low | 92 Ų | 92 | 117.1 Ų | 117.1 | 48% | 0.482 | 58% | 0.584 | S | S | . | * | H | α-helix | trans | -68.9 | -39.6 | 176.9 | -156.9 | 156.2 | 0 | 0 | 0 | 111.2 | N90 N92 T97 L98 | N90-L94 WeakPolarHBondContact O-CB 3.42Å; N90-L94 PolarHBondContact O-N 2.89Å; N92-L94 VanDerWaalsContact C-N 3.31Å; N92-L94 PolarHBondContact O-N 3.25Å; L94-T97 PolarHBondContact O-N 3.33Å; L94-L98 HydrophobicContact CD2-CD1 3.54Å; L94-L98 HydrophobicContact CD2-CG 3.94Å; L94-L98 WeakPolarHBondContact O-CG 2.98Å; L94-L98 PolarHBondContact O-N 2.88Å |
| 95 | R | 71.1 | Confident | 59.4 | Low | 171 Ų | 171 | 109.6 Ų | 109.6 | 65% | 0.645 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -67 | -40 | 176.4 | -157.9 | -179.8 | -176.4 | -171.8 | -0.1 | 112.2 | L91 N92 T97 L98 L99 | L91-R95 VanDerWaalsContact O-CB 3.25Å; L91-R95 WeakPolarHBondContact O-CB 3.32Å; L91-R95 PolarHBondContact O-N 2.98Å; N92-R95 PolarHBondContact O-N 3.31Å; N92-R95 VanDerWaalsContact O-N 3.14Å; R95-T97 VanDerWaalsContact C-N 3.33Å; R95-L98 PolarHBondContact O-N 3.38Å; R95-L99 HydrophobicContact CG-CD1 4.18Å; R95-L99 VanDerWaalsContact O-CB 3.29Å; R95-L99 WeakPolarHBondContact O-CB 3.42Å; R95-L99 WeakPolarHBondContact O-CD1 3.18Å; R95-L99 VanDerWaalsContact O-CG 3.23Å; R95-L99 WeakPolarHBondContact O-CG 3.43Å; R95-L99 PolarHBondContact O-N 2.84Å |
| 96 | E | 64.9 | Low | 59.4 | Low | 131 Ų | 131 | 110.6 Ų | 110.6 | 61% | 0.612 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -65.4 | -37.9 | 173 | -61.2 | -79.1 | 116.4 | 0 | 0 | 110.6 | N92 N93 L99 S100 | N92-E96 WeakPolarHBondContact O-CB 3.44Å; N92-E96 WeakPolarHBondContact O-CG 3.33Å; N92-E96 PolarHBondContact O-N 3.27Å; N93-E96 PolarHBondContact O-N 3.47Å; E96-L99 PolarHBondContact O-N 3.42Å; E96-S100 WeakPolarHBondContact O-CB 3.31Å; E96-S100 PolarHBondContact O-N 3.37Å |
| 97 | T | 63.9 | Low | 59.3 | Low | 71 Ų | 71 | 110.1 Ų | 110.1 | 44% | 0.436 | 58% | 0.579 | S | S | . | * | H | α-helix | trans | -67.6 | -43.3 | 175.9 | -51.3 | 0 | 0 | 0 | 0 | 111.4 | N93 L94 R95 S100 E101 | N93-T97 WeakPolarHBondContact O-CB 3.23Å; N93-T97 PolarHBondContact O-N 3.45Å; N93-T97 PolarHBondContact O-OG1 3.3Å; L94-T97 PolarHBondContact O-N 3.33Å; R95-T97 VanDerWaalsContact C-N 3.33Å; T97-S100 PolarHBondContact O-N 3.12Å; T97-E101 WeakPolarHBondContact O-CB 3.29Å; T97-E101 PolarHBondContact O-N 2.9Å |
| 98 | L | 66.3 | Low | 58.9 | Low | 110 Ų | 110 | 108.8 Ų | 108.8 | 58% | 0.576 | 58% | 0.575 | S | S | * | * | H | α-helix | trans | -69.2 | -32 | 176.8 | -69.9 | 177.3 | 0 | 0 | 0 | 113.3 | L94 R95 | L94-L98 HydrophobicContact CD2-CD1 3.54Å; L94-L98 HydrophobicContact CD2-CG 3.94Å; L94-L98 WeakPolarHBondContact O-CG 2.98Å; L94-L98 PolarHBondContact O-N 2.88Å; R95-L98 PolarHBondContact O-N 3.38Å |
| 99 | L | 59.6 | Low | 58.6 | Low | 117 Ų | 117 | 109.6 Ų | 109.6 | 61% | 0.613 | 58% | 0.579 | S | S | * | * | H | α-helix | trans | -77.1 | -33.9 | 175 | -74.9 | 166.6 | 0 | 0 | 0 | 112.1 | R95 E96 | R95-L99 HydrophobicContact CG-CD1 4.18Å; R95-L99 VanDerWaalsContact O-CB 3.29Å; R95-L99 WeakPolarHBondContact O-CB 3.42Å; R95-L99 WeakPolarHBondContact O-CD1 3.18Å; R95-L99 VanDerWaalsContact O-CG 3.23Å; R95-L99 WeakPolarHBondContact O-CG 3.43Å; R95-L99 PolarHBondContact O-N 2.84Å; E96-L99 PolarHBondContact O-N 3.42Å |
| 100 | S | 50.8 | Low | 58.1 | Low | 94 Ų | 94 | 111.6 Ų | 111.6 | 66% | 0.657 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -78.2 | -31.3 | 177.1 | -172.6 | 0 | 0 | 0 | 0 | 112.7 | E96 T97 K102 P103 | E96-S100 WeakPolarHBondContact O-CB 3.31Å; E96-S100 PolarHBondContact O-N 3.37Å; T97-S100 PolarHBondContact O-N 3.12Å; S100-K102 PolarHBondContact O-N 2.7Å; S100-P103 WeakPolarHBondContact O-CD 3.28Å |
| 101 | E | 49.9 | Very low | 57.6 | Low | 156 Ų | 156 | 110.8 Ų | 110.8 | 73% | 0.729 | 58% | 0.582 | S | S | * | * | S | Bend | trans | -71.9 | -15.8 | 177.7 | -174.5 | 159.3 | 102.9 | 0 | 0 | 113 | T97 | T97-E101 WeakPolarHBondContact O-CB 3.29Å; T97-E101 PolarHBondContact O-N 2.9Å |
| 102 | K | 58.7 | Low | 56.8 | Low | 153 Ų | 153 | 110.4 Ų | 110.4 | 67% | 0.665 | 58% | 0.58 | S | S | * | * | trans | -119.6 | 79.9 | -179.4 | -161.9 | 127.8 | 176.4 | 173.5 | 0 | 113.7 | S100 S105 | S100-K102 PolarHBondContact O-N 2.7Å; K102-S105 WeakPolarHBondContact CE-OG 3.12Å | ||
| 103 | P | 48.4 | Very low | 56.2 | Low | 96 Ų | 96 | 113.2 Ų | 113.2 | 62% | 0.623 | 59% | 0.588 | S | S | * | * | S | Bend | trans | -135.2 | 13.8 | 143.8 | 40 | -29.4 | 0 | 0 | 0 | 114 | S100 | S100-P103 WeakPolarHBondContact O-CD 3.28Š|
| 104 | N | 48.2 | Very low | 55.6 | Low | 102 Ų | 102 | 114 Ų | 114 | 55% | 0.545 | 59% | 0.588 | S | S | . | * | S | Bend | trans | -107.3 | -6.3 | -175.6 | -143.2 | -13 | 0 | 0 | 0 | 115.4 | V108 | N104-V108 WeakPolarHBondContact O-CG2 3.45Š|
| 105 | S | 50.8 | Low | 55 | Low | 63 Ų | 63 | 117.3 Ų | 117.3 | 44% | 0.441 | 59% | 0.594 | S | S | . | * | H | α-helix | trans | -80 | -30.5 | 177.6 | 21.3 | 0 | 0 | 0 | 0 | 113.2 | K102 | K102-S105 WeakPolarHBondContact CE-OG 3.12Å |
| 106 | A | 49.7 | Very low | 54.1 | Low | 76 Ų | 76 | 114.1 Ų | 114.1 | 63% | 0.628 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -79.8 | -27 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113 | L110 | A106-L110 PolarHBondContact O-N 3.27Å |
| 107 | Q | 49 | Very low | 53.6 | Low | 136 Ų | 136 | 111.8 Ų | 111.8 | 64% | 0.636 | 59% | 0.585 | S | S | * | * | H | α-helix | trans | -75.4 | -37.4 | -179.8 | -159.8 | 178.5 | 94.4 | 0 | 0 | 111.5 | E109 L110 E111 | Q107-E109 VanDerWaalsContact C-N 3.34Å; Q107-E109 PolarHBondContact O-N 2.66Å; Q107-L110 PolarHBondContact O-N 3.44Å; Q107-E111 WeakPolarHBondContact O-CB 3.21Å; Q107-E111 PolarHBondContact O-N 2.94Å |
| 108 | V | 48.6 | Very low | 52.9 | Low | 93 Ų | 93 | 113 Ų | 113 | 56% | 0.564 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -67.1 | -33.1 | 177 | 174.1 | 0 | 0 | 0 | 0 | 112.2 | N104 L112 | N104-V108 WeakPolarHBondContact O-CG2 3.45Å; V108-L112 WeakPolarHBondContact O-CB 3.02Å; V108-L112 PolarHBondContact O-N 3.31Å |
| 109 | E | 51.5 | Low | 52.3 | Low | 151 Ų | 151 | 112.2 Ų | 112.2 | 71% | 0.706 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -74.6 | -32.8 | 176.7 | -165 | 176.2 | 126 | 0 | 0 | 112.6 | Q107 K113 | Q107-E109 VanDerWaalsContact C-N 3.34Å; Q107-E109 PolarHBondContact O-N 2.66Å; E109-K113 WeakPolarHBondContact O-CB 3.49Å; E109-K113 PolarHBondContact O-N 3.49Å |
| 110 | L | 53.7 | Low | 51.9 | Low | 120 Ų | 120 | 112.4 Ų | 112.4 | 63% | 0.628 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -72.8 | -40.5 | 177.5 | -131 | 170.4 | 0 | 0 | 0 | 111.6 | A106 Q107 K113 E114 | A106-L110 PolarHBondContact O-N 3.27Å; Q107-L110 PolarHBondContact O-N 3.44Å; L110-K113 PolarHBondContact O-N 3.45Å; L110-E114 WeakPolarHBondContact O-CB 3.27Å; L110-E114 PolarHBondContact O-N 2.8Å |
| 111 | E | 51.8 | Low | 51.8 | Low | 86 Ų | 86 | 115.7 Ų | 115.7 | 40% | 0.402 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -68.4 | -39.1 | 179 | -142.7 | -97.8 | 126.5 | 0 | 0 | 112.1 | Q107 E114 R115 | Q107-E111 WeakPolarHBondContact O-CB 3.21Å; Q107-E111 PolarHBondContact O-N 2.94Å; E111-E114 PolarHBondContact O-N 2.82Å; E111-R115 PolarHBondContact O-N 2.87Å; E111-R115 IonicContact OE1-CZ 2.78Å; E111-R115 IonicContact OE1-NE 2.99Å; E111-R115 PolarHBondContact OE1-NE 2.93Å; E111-R115 IonicContact OE1-NH1 3.43Å; E111-R115 PolarHBondContact OE1-NH1 2.92Å; E111-R115 IonicContact OE1-NH2 2.62Å; E111-R115 PolarHBondContact OE1-NH2 2.72Å; E111-R115 IonicContact OE2-CZ 3.15Å; E111-R115 IonicContact OE2-NE 3.98Å; E111-R115 IonicContact OE2-NH1 2.94Å; E111-R115 PolarHBondContact OE2-NH1 3.42Å; E111-R115 IonicContact OE2-NH2 3.09Å; E111-R115 PolarHBondContact OE2-NH2 2.76Å; E111-R115 VanDerWaalsContact OE2-NH2 3.09Å |
| 112 | L | 53.7 | Low | 51.4 | Low | 108 Ų | 108 | 114 Ų | 114 | 57% | 0.565 | 60% | 0.596 | S | S | * | * | H | α-helix | trans | -69.9 | -37.5 | 177.7 | -164.9 | 138.7 | 0 | 0 | 0 | 111.9 | V108 R115 D116 | V108-L112 WeakPolarHBondContact O-CB 3.02Å; V108-L112 PolarHBondContact O-N 3.31Å; L112-R115 PolarHBondContact O-N 2.79Å; L112-D116 PolarHBondContact O-N 3.33Å; L112-D116 VanDerWaalsContact O-N 3.1Å |
| 113 | K | 52.6 | Low | 50.5 | Low | 144 Ų | 144 | 111.8 Ų | 111.8 | 63% | 0.626 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -71.4 | -32.8 | 176.4 | -170.8 | 159.6 | 178.5 | 173.6 | 0 | 112.9 | E109 L110 V117 | E109-K113 WeakPolarHBondContact O-CB 3.49Å; E109-K113 PolarHBondContact O-N 3.49Å; L110-K113 PolarHBondContact O-N 3.45Å; K113-V117 WeakPolarHBondContact O-CB 3.48Å; K113-V117 WeakPolarHBondContact O-CG2 3.27Å; K113-V117 PolarHBondContact O-N 2.96Å |
| 114 | E | 54 | Low | 50.1 | Low | 124 Ų | 124 | 114.6 Ų | 114.6 | 58% | 0.579 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -67.3 | -40.9 | 174.7 | -167.2 | 173.6 | 159.7 | 0 | 0 | 111.3 | L110 E111 V117 L118 | L110-E114 WeakPolarHBondContact O-CB 3.27Å; L110-E114 PolarHBondContact O-N 2.8Å; E111-E114 PolarHBondContact O-N 2.82Å; E114-V117 PolarHBondContact O-N 2.74Å; E114-L118 WeakPolarHBondContact O-CB 3.46Å; E114-L118 PolarHBondContact O-N 3.28Å |
| 115 | R | 57 | Low | 50.2 | Low | 161 Ų | 161 | 116 Ų | 116 | 61% | 0.608 | 61% | 0.613 | S | S | * | * | H | α-helix | trans | -65.9 | -40.3 | 174.8 | -71.4 | -176 | 177.7 | 142.9 | 4 | 113.3 | E111 L112 L118 S119 | E111-R115 PolarHBondContact O-N 2.87Å; E111-R115 IonicContact OE1-CZ 2.78Å; E111-R115 IonicContact OE1-NE 2.99Å; E111-R115 PolarHBondContact OE1-NE 2.93Å; E111-R115 IonicContact OE1-NH1 3.43Å; E111-R115 PolarHBondContact OE1-NH1 2.92Å; E111-R115 IonicContact OE1-NH2 2.62Å; E111-R115 PolarHBondContact OE1-NH2 2.72Å; E111-R115 IonicContact OE2-CZ 3.15Å; E111-R115 IonicContact OE2-NE 3.98Å; E111-R115 IonicContact OE2-NH1 2.94Å; E111-R115 PolarHBondContact OE2-NH1 3.42Å; E111-R115 IonicContact OE2-NH2 3.09Å; E111-R115 PolarHBondContact OE2-NH2 2.76Å; E111-R115 VanDerWaalsContact OE2-NH2 3.09Å; L112-R115 PolarHBondContact O-N 2.79Å; R115-L118 PolarHBondContact O-N 3.31Å; R115-S119 VanDerWaalsContact O-CB 3.26Å; R115-S119 WeakPolarHBondContact O-CB 3.31Å; R115-S119 PolarHBondContact O-N 3.03Å |
| 116 | D | 53.8 | Low | 49.7 | Very low | 104 Ų | 104 | 118.8 Ų | 118.8 | 56% | 0.556 | 63% | 0.629 | S | S | * | * | H | α-helix | trans | -65.6 | -38.2 | 175.8 | -85.7 | -34.6 | 0 | 0 | 0 | 112 | L112 V120 | L112-D116 PolarHBondContact O-N 3.33Å; L112-D116 VanDerWaalsContact O-N 3.1Å; D116-V120 WeakPolarHBondContact O-CG2 3.43Å; D116-V120 PolarHBondContact O-N 3.28Å |
| 117 | V | 53.3 | Low | 49.5 | Very low | 82 Ų | 82 | 122.6 Ų | 122.6 | 50% | 0.497 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -74 | -36.6 | 178.2 | 173.9 | 0 | 0 | 0 | 0 | 111.4 | K113 E114 V120 F121 | K113-V117 WeakPolarHBondContact O-CB 3.48Å; K113-V117 WeakPolarHBondContact O-CG2 3.27Å; K113-V117 PolarHBondContact O-N 2.96Å; E114-V117 PolarHBondContact O-N 2.74Å; V117-V120 PolarHBondContact O-N 3.21Å; V117-F121 PolarHBondContact O-N 3.15Å |
| 118 | L | 50.1 | Low | 49.1 | Very low | 98 Ų | 98 | 122.2 Ų | 122.2 | 51% | 0.513 | 64% | 0.641 | S | S | . | * | H | α-helix | trans | -73.8 | -30.8 | 177.9 | -149.9 | 151.3 | 0 | 0 | 0 | 111.4 | E114 R115 V120 F121 L122 | E114-L118 WeakPolarHBondContact O-CB 3.46Å; E114-L118 PolarHBondContact O-N 3.28Å; R115-L118 PolarHBondContact O-N 3.31Å; L118-V120 VanDerWaalsContact C-N 3.28Å; L118-V120 PolarHBondContact O-N 2.89Å; L118-F121 PolarHBondContact O-N 3.47Å; L118-L122 PolarHBondContact O-N 3.42Å |
| 119 | S | 53.6 | Low | 48.7 | Very low | 92 Ų | 92 | 126.7 Ų | 126.7 | 64% | 0.643 | 66% | 0.656 | S | S | * | * | H | α-helix | trans | -67.9 | -23.6 | 171.9 | -171.1 | 0 | 0 | 0 | 0 | 113.6 | R115 | R115-S119 VanDerWaalsContact O-CB 3.26Å; R115-S119 WeakPolarHBondContact O-CB 3.31Å; R115-S119 PolarHBondContact O-N 3.03Å |
| 120 | V | 51.7 | Low | 47.9 | Very low | 121 Ų | 121 | 128.8 Ų | 128.8 | 73% | 0.733 | 69% | 0.687 | S | S | * | * | H | α-helix | trans | -82.5 | -22 | 174.3 | 171.8 | 0 | 0 | 0 | 0 | 111.7 | D116 V117 L118 | D116-V120 WeakPolarHBondContact O-CG2 3.43Å; D116-V120 PolarHBondContact O-N 3.28Å; V117-V120 PolarHBondContact O-N 3.21Å; L118-V120 VanDerWaalsContact C-N 3.28Å; L118-V120 PolarHBondContact O-N 2.89Å |
| 121 | F | 48 | Very low | 47.6 | Very low | 163 Ų | 163 | 129.3 Ų | 129.3 | 72% | 0.715 | 69% | 0.69 | S | S | * | * | H | α-helix | trans | -98.9 | -5.5 | -175.4 | -96.6 | -84.3 | 0 | 0 | 0 | 115.3 | V117 L118 P123 | V117-F121 PolarHBondContact O-N 3.15Å; L118-F121 PolarHBondContact O-N 3.47Å; F121-P123 VanDerWaalsContact O-CD 3.23Å; F121-P123 WeakPolarHBondContact O-CD 3.46Å |
| 122 | L | 40.7 | Very low | 47.4 | Very low | 121 Ų | 121 | 131.5 Ų | 131.5 | 63% | 0.634 | 71% | 0.706 | S | S | * | * | trans | -100.5 | 101.3 | 175.3 | -139.1 | 79.5 | 0 | 0 | 0 | 109.6 | L118 D124 | L118-L122 PolarHBondContact O-N 3.42Å; L122-D124 PolarHBondContact O-N 3.42Å | ||
| 123 | P | 40.7 | Very low | 47.1 | Very low | 106 Ų | 106 | 132.8 Ų | 132.8 | 69% | 0.688 | 71% | 0.713 | S | S | * | * | trans | -65.6 | 129.5 | 157.8 | 28.5 | -28.7 | 0 | 0 | 0 | 106.9 | F121 I125 | F121-P123 VanDerWaalsContact O-CD 3.23Å; F121-P123 WeakPolarHBondContact O-CD 3.46Å; P123-I125 PolarHBondContact O-N 2.82Å | ||
| 124 | D | 39.6 | Very low | 46.7 | Very low | 156 Ų | 156 | 132.2 Ų | 132.2 | 83% | 0.834 | 72% | 0.719 | S | S | * | * | trans | -41.5 | 115.7 | 170.9 | -73.5 | -58.6 | 0 | 0 | 0 | 109.7 | L122 P126 | L122-D124 PolarHBondContact O-N 3.42Å; D124-P126 WeakPolarHBondContact O-CD 3.38Å | ||
| 125 | I | 50.3 | Low | 46.3 | Very low | 131 Ų | 131 | 132.7 Ų | 132.7 | 67% | 0.672 | 73% | 0.727 | S | S | * | * | trans | -76.8 | 112 | 158.9 | -75.7 | 162.7 | 0 | 0 | 0 | 104.5 | P123 E127 | P123-I125 PolarHBondContact O-N 2.82Å; I125-E127 HydrophobicContact CG2-CG 4.41Å; I125-E127 PolarHBondContact O-N 2.9Å | ||
| 126 | P | 40.9 | Very low | 45.6 | Very low | 121 Ų | 121 | 130.8 Ų | 130.8 | 79% | 0.786 | 74% | 0.735 | S | S | * | * | trans | -75.5 | 102 | 169.5 | 29.8 | -26.7 | 0 | 0 | 0 | 107.2 | D124 | D124-P126 WeakPolarHBondContact O-CD 3.38Š| ||
| 127 | E | 44.7 | Very low | 45 | Very low | 157 Ų | 157 | 132.7 Ų | 132.7 | 73% | 0.734 | 75% | 0.748 | S | S | * | * | trans | -65.1 | 135.7 | 157.8 | -52 | -100.7 | 105.3 | 0 | 0 | 107.9 | I125 | I125-E127 HydrophobicContact CG2-CG 4.41Å; I125-E127 PolarHBondContact O-N 2.9Å | ||
| 128 | T | 40.8 | Very low | 44.4 | Very low | 128 Ų | 128 | 136.6 Ų | 136.6 | 79% | 0.785 | 77% | 0.767 | S | S | * | * | trans | 86.9 | 132.4 | 155.9 | 49.6 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 129 | E | 39.8 | Very low | 43.9 | Very low | 187 Ų | 187 | 139.8 Ų | 139.8 | 87% | 0.874 | 79% | 0.788 | S | S | * | * | trans | 86.6 | 101 | 144.1 | 92.4 | -174.8 | 113.8 | 0 | 0 | 121.7 | ||||
| 130 | S | 35.7 | Very low | 43 | Very low | 195 Ų | 195 | 144.2 Ų | 144.2 | 100% | 1.364 | 80% | 0.802 | S | S | * | * | 177.1 | 0 | 113.9 | -174.2 | 0 | 0 | 0 | 0 | 112.1 |
Retrieved 130 of 130 residues in 44.2 ms
(Link to these results)