| 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 | 46.9 | Very low | 73.9 | Confident | 201 Ų | 201 | 86.5 Ų | 86.5 | 99% | 0.99 | 48% | 0.477 | S | S | * | . | 0 | 127.8 | 0 | -151.8 | 165.3 | -162 | 0 | 0 | 108.2 | L3 V226 | M1-L3 PolarHBondContact O-N 3.42Å; M1-V226 HydrophobicContact CE-CG1 4.29Å; M1-V226 HydrophobicContact SD-CG1 4.01Å | |||
| 2 | A | 51.2 | Low | 75.2 | Confident | 86 Ų | 86 | 91.8 Ų | 91.8 | 71% | 0.711 | 49% | 0.486 | S | S | * | . | trans | -71.5 | 114 | -176.3 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 3 | L | 59.3 | Low | 76.3 | Confident | 41 Ų | 41 | 93.1 Ų | 93.1 | 22% | 0.215 | 49% | 0.492 | C | S | . | . | trans | -55.6 | 139.5 | 167.8 | -79.3 | 104.1 | 0 | 0 | 0 | 109.3 | M1 W5 I7 K8 | M1-L3 PolarHBondContact O-N 3.42Å; L3-W5 PolarHBondContact O-N 2.97Å; L3-I7 HydrophobicContact CB-CB 4.36Å; L3-I7 HydrophobicContact CD2-CB 3.83Å; L3-I7 HydrophobicContact CD2-CD1 4.4Å; L3-I7 HydrophobicContact CD2-CG2 3.38Å; L3-K8 HydrophobicContact CB-CG 3.99Å; L3-K8 WeakPolarHBondContact O-CE 3.4Å | ||
| 4 | P | 76.3 | Confident | 77.2 | Confident | 83 Ų | 83 | 87.2 Ų | 87.2 | 54% | 0.539 | 46% | 0.461 | S | S | . | . | trans | -47.4 | 139.3 | 171.7 | -23.7 | 30.2 | 0 | 0 | 0 | 110 | G6 I7 K8 | P4-G6 PolarHBondContact O-N 3.1Å; P4-I7 HydrophobicContact CB-CG1 4.34Å; P4-I7 HydrophobicContact CG-CD1 4.02Å; P4-I7 HydrophobicContact CG-CG1 4.36Å; P4-I7 PolarHBondContact O-N 3.48Å; P4-K8 PolarHBondContact O-N 2.93Å | ||
| 5 | W | 75.1 | Confident | 78.3 | Confident | 222 Ų | 222 | 85.2 Ų | 85.2 | 84% | 0.841 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -49.6 | -33.5 | -175.5 | -61 | 97.3 | 0 | 0 | 0 | 113.3 | L3 K8 C9 | L3-W5 PolarHBondContact O-N 2.97Å; W5-K8 PolarHBondContact O-N 3.38Å; W5-C9 PolarHBondContact O-N 2.9Å; W5-C9 VanDerWaalsContact O-N 3.1Å |
| 6 | G | 79.4 | Confident | 79.3 | Confident | 54 Ų | 54 | 86.1 Ų | 86.1 | 56% | 0.557 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -62.9 | -39 | 174.5 | 0 | 0 | 0 | 0 | 0 | 114.7 | P4 C9 L10 | P4-G6 PolarHBondContact O-N 3.1Å; G6-C9 PolarHBondContact O-N 2.84Å; G6-L10 WeakPolarHBondContact O-CB 3.44Å; G6-L10 PolarHBondContact O-N 3.31Å |
| 7 | I | 80.2 | Confident | 80 | Confident | 46 Ų | 46 | 86.9 Ų | 86.9 | 24% | 0.236 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -75.2 | -32.7 | -178.8 | -49.3 | -176.4 | 0 | 0 | 0 | 110.8 | L3 P4 L10 K11 L216 A219 | L3-I7 HydrophobicContact CB-CB 4.36Å; L3-I7 HydrophobicContact CD2-CB 3.83Å; L3-I7 HydrophobicContact CD2-CD1 4.4Å; L3-I7 HydrophobicContact CD2-CG2 3.38Å; P4-I7 HydrophobicContact CB-CG1 4.34Å; P4-I7 HydrophobicContact CG-CD1 4.02Å; P4-I7 HydrophobicContact CG-CG1 4.36Å; P4-I7 PolarHBondContact O-N 3.48Å; I7-L10 PolarHBondContact O-N 3.35Å; I7-K11 WeakPolarHBondContact O-CB 3.43Å; I7-K11 PolarHBondContact O-N 3.22Å; I7-L216 HydrophobicContact CG2-CD1 4.01Å; I7-A219 HydrophobicContact CD1-CB 3.76Å; I7-A219 HydrophobicContact CG2-CB 3.99Å |
| 8 | K | 83.1 | Confident | 80.8 | Confident | 78 Ų | 78 | 82.7 Ų | 82.7 | 34% | 0.339 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -63.3 | -45.2 | 171.1 | -66.7 | -177.9 | -178.9 | 174.5 | 0 | 111.2 | L3 P4 W5 L10 K11 Y12 | L3-K8 HydrophobicContact CB-CG 3.99Å; L3-K8 WeakPolarHBondContact O-CE 3.4Å; P4-K8 PolarHBondContact O-N 2.93Å; W5-K8 PolarHBondContact O-N 3.38Å; K8-L10 VanDerWaalsContact C-N 3.34Å; K8-L10 PolarHBondContact O-N 3.39Å; K8-K11 PolarHBondContact O-N 3.39Å; K8-Y12 WeakPolarHBondContact O-CD2 3.36Å; K8-Y12 PolarHBondContact O-N 3.46Å; K8-Y12 VanDerWaalsContact O-N 3.15Å |
| 9 | C | 86.7 | Confident | 81.6 | Confident | 75 Ų | 75 | 82.4 Ų | 82.4 | 51% | 0.507 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -58.9 | -46.8 | 174.7 | -172.2 | 0 | 0 | 0 | 0 | 111.2 | W5 G6 K11 Y12 L13 | W5-C9 PolarHBondContact O-N 2.9Å; W5-C9 VanDerWaalsContact O-N 3.1Å; G6-C9 PolarHBondContact O-N 2.84Å; C9-K11 PolarHBondContact O-N 2.94Å; C9-Y12 PolarHBondContact O-N 2.95Å; C9-L13 PolarHBondContact O-N 3.5Å |
| 10 | L | 86.2 | Confident | 82.3 | Confident | 27 Ų | 27 | 84.2 Ų | 84.2 | 14% | 0.141 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -59.2 | -44 | 177.4 | -172.9 | 65.7 | 0 | 0 | 0 | 112.5 | G6 I7 K8 Y12 L13 I14 F212 L215 | G6-L10 WeakPolarHBondContact O-CB 3.44Å; G6-L10 PolarHBondContact O-N 3.31Å; I7-L10 PolarHBondContact O-N 3.35Å; K8-L10 VanDerWaalsContact C-N 3.34Å; K8-L10 PolarHBondContact O-N 3.39Å; L10-Y12 PolarHBondContact O-N 3.5Å; L10-L13 PolarHBondContact O-N 2.68Å; L10-I14 HydrophobicContact CD1-CD1 4.34Å; L10-I14 HydrophobicContact CG-CD1 3.94Å; L10-I14 VanDerWaalsContact O-CG1 3.31Å; L10-I14 WeakPolarHBondContact O-CG1 3.29Å; L10-I14 PolarHBondContact O-N 2.93Å; L10-F212 HydrophobicContact CD1-CB 3.92Å; L10-F212 HydrophobicContact CD1-CD1 3.58Å; L10-F212 HydrophobicContact CD1-CD2 4.19Å; L10-F212 HydrophobicContact CD1-CE1 4.08Å; L10-F212 HydrophobicContact CD1-CG 3.65Å; L10-L215 HydrophobicContact CD2-CB 4.26Å |
| 11 | K | 88 | Confident | 82.8 | Confident | 39 Ų | 39 | 84.2 Ų | 84.2 | 17% | 0.17 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -56.8 | -48.7 | 176.2 | 176.2 | 179.9 | 172.3 | 168.1 | 0 | 111.5 | I7 K8 C9 I14 F15 A79 I80 E82 L216 | I7-K11 WeakPolarHBondContact O-CB 3.43Å; I7-K11 PolarHBondContact O-N 3.22Å; K8-K11 PolarHBondContact O-N 3.39Å; C9-K11 PolarHBondContact O-N 2.94Å; K11-I14 PolarHBondContact O-N 2.88Å; K11-F15 WeakPolarHBondContact O-CB 3.14Å; K11-F15 PolarHBondContact O-N 3.25Å; K11-A79 WeakPolarHBondContact CE-O 3.36Å; K11-I80 PolarHBondContact NZ-O 3.15Å; K11-E82 IonicContact NZ-OE1 3.17Å; K11-E82 PolarHBondContact NZ-OE1 2.98Å; K11-L216 HydrophobicContact CB-CD1 4.26Å |
| 12 | Y | 89.9 | Confident | 85.2 | Confident | 149 Ų | 149 | 78.2 Ų | 78.2 | 58% | 0.584 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -68.4 | -37.3 | 179.6 | -74.4 | -66.3 | 0 | 0 | 0 | 112.5 | K8 C9 L10 F15 I16 | K8-Y12 WeakPolarHBondContact O-CD2 3.36Å; K8-Y12 PolarHBondContact O-N 3.46Å; K8-Y12 VanDerWaalsContact O-N 3.15Å; C9-Y12 PolarHBondContact O-N 2.95Å; L10-Y12 PolarHBondContact O-N 3.5Å; Y12-F15 PolarHBondContact O-N 3.41Å; Y12-I16 WeakPolarHBondContact O-CB 3.25Å; Y12-I16 VanDerWaalsContact O-CG1 3.25Å; Y12-I16 WeakPolarHBondContact O-CG1 3.45Å; Y12-I16 PolarHBondContact O-N 3.34Å |
| 13 | L | 90 | Very high | 87.4 | Confident | 109 Ų | 109 | 77.9 Ų | 77.9 | 57% | 0.571 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -60.9 | -49.5 | 173.9 | -90.2 | 169.1 | 0 | 0 | 0 | 111.9 | C9 L10 F15 I16 F17 | C9-L13 PolarHBondContact O-N 3.5Å; L10-L13 PolarHBondContact O-N 2.68Å; L13-F15 VanDerWaalsContact C-N 3.3Å; L13-F15 PolarHBondContact O-N 2.67Å; L13-I16 PolarHBondContact O-N 2.97Å; L13-F17 VanDerWaalsContact O-CB 3.26Å; L13-F17 WeakPolarHBondContact O-CB 3.2Å; L13-F17 PolarHBondContact O-N 2.97Å |
| 14 | I | 88.9 | Confident | 89.2 | Confident | 11 Ų | 11 | 78 Ų | 78 | 6% | 0.056 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -59.6 | -44.5 | 176.6 | -67.5 | 166.8 | 0 | 0 | 0 | 110 | L10 K11 N18 A79 F212 L216 | L10-I14 HydrophobicContact CD1-CD1 4.34Å; L10-I14 HydrophobicContact CG-CD1 3.94Å; L10-I14 VanDerWaalsContact O-CG1 3.31Å; L10-I14 WeakPolarHBondContact O-CG1 3.29Å; L10-I14 PolarHBondContact O-N 2.93Å; K11-I14 PolarHBondContact O-N 2.88Å; I14-N18 WeakPolarHBondContact CG2-ND2 3.37Å; I14-N18 VanDerWaalsContact O-CB 3.3Å; I14-N18 WeakPolarHBondContact O-CB 3.31Å; I14-N18 PolarHBondContact O-N 3.33Å; I14-N18 PolarHBondContact O-ND2 3.32Å; I14-A79 HydrophobicContact CG2-CB 3.99Å; I14-F212 HydrophobicContact CD1-CB 3.96Å; I14-F212 HydrophobicContact CG1-CB 4.25Å; I14-L216 HydrophobicContact CD1-CB 4.2Å; I14-L216 HydrophobicContact CD1-CD2 3.81Å |
| 15 | F | 92.9 | Very high | 90.1 | Very high | 57 Ų | 57 | 74.1 Ų | 74.1 | 25% | 0.25 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -61 | -53.3 | 179.2 | 173.7 | -100.2 | 0 | 0 | 0 | 112 | K11 Y12 L13 F17 N18 F19 C76 A79 I80 | K11-F15 WeakPolarHBondContact O-CB 3.14Å; K11-F15 PolarHBondContact O-N 3.25Å; Y12-F15 PolarHBondContact O-N 3.41Å; L13-F15 VanDerWaalsContact C-N 3.3Å; L13-F15 PolarHBondContact O-N 2.67Å; F15-F17 PolarHBondContact O-N 2.95Å; F15-N18 PolarHBondContact O-N 3.5Å; F15-F19 WeakPolarHBondContact O-CB 3.46Å; F15-F19 PolarHBondContact O-N 3.49Å; F15-C76 HydrophobicContact CD2-CB 3.95Å; F15-C76 HydrophobicContact CE2-CB 4.1Å; F15-A79 HydrophobicContact CB-CB 4.44Å; F15-I80 HydrophobicContact CD2-CB 4.21Å; F15-I80 HydrophobicContact CE2-CB 4.36Å; F15-I80 HydrophobicContact CE2-CD1 4.05Å; F15-I80 HydrophobicContact CZ-CD1 4.39Å |
| 16 | I | 94.1 | Very high | 91.2 | Very high | 100 Ų | 100 | 66.1 Ų | 66.1 | 51% | 0.513 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -61.8 | -47.1 | -177.3 | -68.1 | 166 | 0 | 0 | 0 | 110.3 | Y12 L13 F19 M20 | Y12-I16 WeakPolarHBondContact O-CB 3.25Å; Y12-I16 VanDerWaalsContact O-CG1 3.25Å; Y12-I16 WeakPolarHBondContact O-CG1 3.45Å; Y12-I16 PolarHBondContact O-N 3.34Å; L13-I16 PolarHBondContact O-N 2.97Å; I16-F19 PolarHBondContact O-N 3.4Å; I16-M20 WeakPolarHBondContact O-CG 3.3Å; I16-M20 PolarHBondContact O-N 3.44Å |
| 17 | F | 92.1 | Very high | 92 | Very high | 99 Ų | 99 | 66.3 Ų | 66.3 | 43% | 0.434 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -60.8 | -51.3 | 179.6 | -176.6 | -96.8 | 0 | 0 | 0 | 111.4 | L13 F15 F19 M20 F21 I205 | L13-F17 VanDerWaalsContact O-CB 3.26Å; L13-F17 WeakPolarHBondContact O-CB 3.2Å; L13-F17 PolarHBondContact O-N 2.97Å; F15-F17 PolarHBondContact O-N 2.95Å; F17-F19 VanDerWaalsContact C-N 3.29Å; F17-F19 PolarHBondContact O-N 3.46Å; F17-M20 PolarHBondContact O-N 3.44Å; F17-F21 AromaticContact CD1-CD2 3.9Å; F17-F21 HydrophobicContact CD1-CD2 3.9Å; F17-F21 HydrophobicContact CD1-CE2 4.05Å; F17-F21 HydrophobicContact CD2-CD2 4.4Å; F17-F21 HydrophobicContact CD2-CE2 4.11Å; F17-F21 AromaticContact CE1-CD2 3.62Å; F17-F21 HydrophobicContact CE1-CD2 3.62Å; F17-F21 AromaticContact CE1-CE2 3.38Å; F17-F21 HydrophobicContact CE1-CE2 3.38Å; F17-F21 HydrophobicContact CE1-CZ 4.15Å; F17-F21 HydrophobicContact CE2-CD2 4.17Å; F17-F21 AromaticContact CE2-CE2 3.47Å; F17-F21 HydrophobicContact CE2-CE2 3.47Å; F17-F21 VanDerWaalsContact CE2-CE2 3.47Å; F17-F21 HydrophobicContact CE2-CZ 4.39Å; F17-F21 HydrophobicContact CG-CD2 4.3Å; F17-F21 HydrophobicContact CG-CE2 4.39Å; F17-F21 AromaticContact CZ-CD2 3.79Å; F17-F21 HydrophobicContact CZ-CD2 3.79Å; F17-F21 AromaticContact CZ-CE2 3.06Å; F17-F21 HydrophobicContact CZ-CE2 3.06Å; F17-F21 AromaticContact CZ-CZ 3.74Å; F17-F21 HydrophobicContact CZ-CZ 3.74Å; F17-F21 WeakPolarHBondContact O-CD2 3.3Å; F17-F21 PolarHBondContact O-N 3.12Å; F17-I205 HydrophobicContact CE1-CG2 4.47Å; F17-I205 HydrophobicContact CZ-CG2 3.8Å |
| 18 | N | 93.8 | Very high | 92.6 | Very high | 11 Ų | 11 | 66.1 Ų | 66.1 | 6% | 0.059 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -67.1 | -30.7 | 179.9 | -77.3 | -79.6 | 0 | 0 | 0 | 112.9 | I14 F15 F21 W22 C76 F90 | I14-N18 WeakPolarHBondContact CG2-ND2 3.37Å; I14-N18 VanDerWaalsContact O-CB 3.3Å; I14-N18 WeakPolarHBondContact O-CB 3.31Å; I14-N18 PolarHBondContact O-N 3.33Å; I14-N18 PolarHBondContact O-ND2 3.32Å; F15-N18 PolarHBondContact O-N 3.5Å; N18-F21 PolarHBondContact O-N 3.43Å; N18-W22 WeakPolarHBondContact O-CB 3.17Å; N18-W22 PolarHBondContact O-N 2.99Å; N18-C76 HydrophobicContact CB-CB 4.25Å; N18-F90 WeakPolarHBondContact OD1-CE2 3.32Å; N18-F90 WeakPolarHBondContact OD1-CZ 3.34Å |
| 19 | F | 95.6 | Very high | 93.2 | Very high | 77 Ų | 77 | 63.7 Ų | 63.7 | 34% | 0.338 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -66.7 | -41.1 | 174.3 | -175.1 | -104.6 | 0 | 0 | 0 | 111.8 | F15 I16 F17 F21 W22 L23 | F15-F19 WeakPolarHBondContact O-CB 3.46Å; F15-F19 PolarHBondContact O-N 3.49Å; I16-F19 PolarHBondContact O-N 3.4Å; F17-F19 VanDerWaalsContact C-N 3.29Å; F17-F19 PolarHBondContact O-N 3.46Å; F19-F21 VanDerWaalsContact C-N 3.35Å; F19-W22 AromaticContact CD2-CE3 3.83Å; F19-W22 HydrophobicContact CD2-CE3 3.83Å; F19-W22 HydrophobicContact CD2-CZ3 4.26Å; F19-W22 AromaticContact CE2-CE3 3.58Å; F19-W22 HydrophobicContact CE2-CE3 3.58Å; F19-W22 AromaticContact CE2-CZ3 3.54Å; F19-W22 HydrophobicContact CE2-CZ3 3.54Å; F19-W22 HydrophobicContact CZ-CE3 4.32Å; F19-W22 HydrophobicContact CZ-CZ3 4.11Å; F19-W22 WeakPolarHBondContact O-CB 3.31Å; F19-W22 PolarHBondContact O-N 2.97Å; F19-L23 HydrophobicContact CD1-CD1 4.06Å; F19-L23 HydrophobicContact CE1-CD1 3.61Å; F19-L23 HydrophobicContact CE1-CG 4.19Å; F19-L23 HydrophobicContact CZ-CD1 4.14Å; F19-L23 HydrophobicContact CZ-CD2 4.41Å; F19-L23 HydrophobicContact CZ-CG 4.33Å; F19-L23 WeakPolarHBondContact O-CG 3.44Å; F19-L23 PolarHBondContact O-N 3.49Å |
| 20 | M | 95.5 | Very high | 93.5 | Very high | 118 Ų | 118 | 62.8 Ų | 62.8 | 58% | 0.581 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -62.8 | -41.9 | 172.5 | -68.4 | -61 | -65.4 | 0 | 0 | 111.7 | I16 F17 W22 L23 A24 | I16-M20 WeakPolarHBondContact O-CG 3.3Å; I16-M20 PolarHBondContact O-N 3.44Å; F17-M20 PolarHBondContact O-N 3.44Å; M20-W22 VanDerWaalsContact C-N 3.34Å; M20-W22 PolarHBondContact O-N 3.06Å; M20-L23 PolarHBondContact O-N 3.11Å; M20-A24 WeakPolarHBondContact O-CB 3.23Å; M20-A24 PolarHBondContact O-N 3.32Å |
| 21 | F | 93.6 | Very high | 93.6 | Very high | 85 Ų | 85 | 65.4 Ų | 65.4 | 37% | 0.373 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -63.6 | -38.3 | 174.5 | -92.4 | -92.8 | 0 | 0 | 0 | 112.9 | F17 N18 F19 A24 G25 M68 | F17-F21 AromaticContact CD1-CD2 3.9Å; F17-F21 HydrophobicContact CD1-CD2 3.9Å; F17-F21 HydrophobicContact CD1-CE2 4.05Å; F17-F21 HydrophobicContact CD2-CD2 4.4Å; F17-F21 HydrophobicContact CD2-CE2 4.11Å; F17-F21 AromaticContact CE1-CD2 3.62Å; F17-F21 HydrophobicContact CE1-CD2 3.62Å; F17-F21 AromaticContact CE1-CE2 3.38Å; F17-F21 HydrophobicContact CE1-CE2 3.38Å; F17-F21 HydrophobicContact CE1-CZ 4.15Å; F17-F21 HydrophobicContact CE2-CD2 4.17Å; F17-F21 AromaticContact CE2-CE2 3.47Å; F17-F21 HydrophobicContact CE2-CE2 3.47Å; F17-F21 VanDerWaalsContact CE2-CE2 3.47Å; F17-F21 HydrophobicContact CE2-CZ 4.39Å; F17-F21 HydrophobicContact CG-CD2 4.3Å; F17-F21 HydrophobicContact CG-CE2 4.39Å; F17-F21 AromaticContact CZ-CD2 3.79Å; F17-F21 HydrophobicContact CZ-CD2 3.79Å; F17-F21 AromaticContact CZ-CE2 3.06Å; F17-F21 HydrophobicContact CZ-CE2 3.06Å; F17-F21 AromaticContact CZ-CZ 3.74Å; F17-F21 HydrophobicContact CZ-CZ 3.74Å; F17-F21 WeakPolarHBondContact O-CD2 3.3Å; F17-F21 PolarHBondContact O-N 3.12Å; N18-F21 PolarHBondContact O-N 3.43Å; F19-F21 VanDerWaalsContact C-N 3.35Å; F21-A24 PolarHBondContact O-N 3.31Å; F21-G25 PolarHBondContact O-N 3.24Å; F21-M68 HydrophobicContact CD1-CE 4.11Å; F21-M68 HydrophobicContact CE1-CE 4.49Å |
| 22 | W | 97.4 | Very high | 93.5 | Very high | 75 Ų | 75 | 63.5 Ų | 63.5 | 28% | 0.284 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -61.9 | -49.1 | 175.1 | 174.6 | 66.9 | 0 | 0 | 0 | 111.3 | N18 F19 M20 A24 G25 T26 M69 | N18-W22 WeakPolarHBondContact O-CB 3.17Å; N18-W22 PolarHBondContact O-N 2.99Å; F19-W22 AromaticContact CD2-CE3 3.83Å; F19-W22 HydrophobicContact CD2-CE3 3.83Å; F19-W22 HydrophobicContact CD2-CZ3 4.26Å; F19-W22 AromaticContact CE2-CE3 3.58Å; F19-W22 HydrophobicContact CE2-CE3 3.58Å; F19-W22 AromaticContact CE2-CZ3 3.54Å; F19-W22 HydrophobicContact CE2-CZ3 3.54Å; F19-W22 HydrophobicContact CZ-CE3 4.32Å; F19-W22 HydrophobicContact CZ-CZ3 4.11Å; F19-W22 WeakPolarHBondContact O-CB 3.31Å; F19-W22 PolarHBondContact O-N 2.97Å; M20-W22 VanDerWaalsContact C-N 3.34Å; M20-W22 PolarHBondContact O-N 3.06Å; W22-A24 PolarHBondContact O-N 2.89Å; W22-G25 PolarHBondContact O-N 2.93Å; W22-T26 PolarHBondContact O-N 3.09Å; W22-T26 PolarHBondContact O-OG1 2.93Å; W22-T26 VanDerWaalsContact O-OG1 3.12Å; W22-M69 VanDerWaalsContact CD1-O 3.31Å |
| 23 | L | 97.2 | Very high | 93.5 | Very high | 80 Ų | 80 | 59.9 Ų | 59.9 | 42% | 0.419 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -60 | -44.8 | 176.5 | -70 | 177.1 | 0 | 0 | 0 | 112.1 | F19 M20 T26 A27 | F19-L23 HydrophobicContact CD1-CD1 4.06Å; F19-L23 HydrophobicContact CE1-CD1 3.61Å; F19-L23 HydrophobicContact CE1-CG 4.19Å; F19-L23 HydrophobicContact CZ-CD1 4.14Å; F19-L23 HydrophobicContact CZ-CD2 4.41Å; F19-L23 HydrophobicContact CZ-CG 4.33Å; F19-L23 WeakPolarHBondContact O-CG 3.44Å; F19-L23 PolarHBondContact O-N 3.49Å; M20-L23 PolarHBondContact O-N 3.11Å; L23-T26 PolarHBondContact O-N 3.44Å; L23-A27 PolarHBondContact O-N 3.43Å |
| 24 | A | 96.3 | Very high | 93.2 | Very high | 44 Ų | 44 | 63.7 Ų | 63.7 | 36% | 0.364 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -61.3 | -44.9 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | M20 F21 W22 T26 A27 V28 M68 | M20-A24 WeakPolarHBondContact O-CB 3.23Å; M20-A24 PolarHBondContact O-N 3.32Å; F21-A24 PolarHBondContact O-N 3.31Å; W22-A24 PolarHBondContact O-N 2.89Å; A24-T26 PolarHBondContact O-N 3.46Å; A24-A27 PolarHBondContact O-N 3.37Å; A24-V28 WeakPolarHBondContact O-CG2 3.35Å; A24-V28 PolarHBondContact O-N 3.05Å; A24-M68 HydrophobicContact CB-CE 4.2Å |
| 25 | G | 97.1 | Very high | 92.7 | Very high | 0 Ų | 0 | 65 Ų | 65 | 0% | 0 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -60.3 | -42.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | F21 W22 V28 L29 | F21-G25 PolarHBondContact O-N 3.24Å; W22-G25 PolarHBondContact O-N 2.93Å; G25-V28 PolarHBondContact O-N 3Å; G25-L29 VanDerWaalsContact O-CB 3.26Å; G25-L29 WeakPolarHBondContact O-CB 3.15Å; G25-L29 PolarHBondContact O-N 3.44Å |
| 26 | T | 97 | Very high | 92 | Very high | 55 Ų | 55 | 65.2 Ų | 65.2 | 34% | 0.337 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -62.5 | -42.5 | 174.6 | -60 | 0 | 0 | 0 | 0 | 111.9 | W22 L23 A24 L29 A30 | W22-T26 PolarHBondContact O-N 3.09Å; W22-T26 PolarHBondContact O-OG1 2.93Å; W22-T26 VanDerWaalsContact O-OG1 3.12Å; L23-T26 PolarHBondContact O-N 3.44Å; A24-T26 PolarHBondContact O-N 3.46Å; T26-L29 PolarHBondContact O-N 2.85Å; T26-A30 WeakPolarHBondContact O-CB 3.26Å; T26-A30 PolarHBondContact O-N 3.33Å |
| 27 | A | 95.6 | Very high | 91.3 | Very high | 58 Ų | 58 | 65.9 Ų | 65.9 | 48% | 0.479 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -63.5 | -47.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | L23 A24 L29 A30 V31 | L23-A27 PolarHBondContact O-N 3.43Å; A24-A27 PolarHBondContact O-N 3.37Å; A27-L29 PolarHBondContact O-N 2.9Å; A27-A30 PolarHBondContact O-N 3.47Å; A27-V31 WeakPolarHBondContact O-CG2 3.28Å; A27-V31 PolarHBondContact O-N 2.97Å |
| 28 | V | 93.9 | Very high | 90.6 | Very high | 42 Ų | 42 | 63.4 Ų | 63.4 | 26% | 0.255 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -61.4 | -44.1 | 177.5 | 172.4 | 0 | 0 | 0 | 0 | 111.2 | A24 G25 A30 V31 G32 L61 | A24-V28 WeakPolarHBondContact O-CG2 3.35Å; A24-V28 PolarHBondContact O-N 3.05Å; G25-V28 PolarHBondContact O-N 3Å; V28-A30 VanDerWaalsContact C-N 3.35Å; V28-A30 PolarHBondContact O-N 3.35Å; V28-V31 PolarHBondContact O-N 3.04Å; V28-G32 PolarHBondContact O-N 2.97Å; V28-L61 HydrophobicContact CG1-CD1 3.59Å; V28-L61 HydrophobicContact CG1-CG 3.93Å |
| 29 | L | 95.3 | Very high | 89.1 | Confident | 27 Ų | 27 | 67.2 Ų | 67.2 | 14% | 0.141 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -62.9 | -41.5 | 176.6 | -179.4 | 60.8 | 0 | 0 | 0 | 111.7 | G25 T26 A27 G32 L33 I62 A66 M69 | G25-L29 VanDerWaalsContact O-CB 3.26Å; G25-L29 WeakPolarHBondContact O-CB 3.15Å; G25-L29 PolarHBondContact O-N 3.44Å; T26-L29 PolarHBondContact O-N 2.85Å; A27-L29 PolarHBondContact O-N 2.9Å; L29-G32 PolarHBondContact O-N 3.21Å; L29-L33 HydrophobicContact CD1-CD1 4.21Å; L29-L33 HydrophobicContact CD1-CG 4.22Å; L29-L33 HydrophobicContact CG-CD1 4.07Å; L29-L33 HydrophobicContact CG-CG 4.49Å; L29-L33 WeakPolarHBondContact O-CB 3.13Å; L29-L33 WeakPolarHBondContact O-CG 3.41Å; L29-L33 PolarHBondContact O-N 3.43Å; L29-I62 HydrophobicContact CD1-CB 4.46Å; L29-I62 HydrophobicContact CD1-CG2 3.87Å; L29-A66 HydrophobicContact CD1-CB 4.22Å; L29-M69 HydrophobicContact CD2-CE 4Å; L29-M69 HydrophobicContact CD2-SD 4.01Å |
| 30 | A | 92.8 | Very high | 87.6 | Confident | 56 Ų | 56 | 70.1 Ų | 70.1 | 46% | 0.463 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -62.1 | -43.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.6 | T26 A27 V28 L33 W34 | T26-A30 WeakPolarHBondContact O-CB 3.26Å; T26-A30 PolarHBondContact O-N 3.33Å; A27-A30 PolarHBondContact O-N 3.47Å; V28-A30 VanDerWaalsContact C-N 3.35Å; V28-A30 PolarHBondContact O-N 3.35Å; A30-L33 PolarHBondContact O-N 3.43Å; A30-W34 VanDerWaalsContact O-CB 3.28Å; A30-W34 WeakPolarHBondContact O-CB 3.26Å; A30-W34 PolarHBondContact O-N 3.45Å |
| 31 | V | 87.8 | Confident | 85.9 | Confident | 81 Ų | 81 | 65 Ų | 65 | 49% | 0.491 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -63.3 | -45.4 | 174.9 | 174.7 | 0 | 0 | 0 | 0 | 111 | A27 V28 L33 W34 L35 L61 | A27-V31 WeakPolarHBondContact O-CG2 3.28Å; A27-V31 PolarHBondContact O-N 2.97Å; V28-V31 PolarHBondContact O-N 3.04Å; V31-L33 PolarHBondContact O-N 3.41Å; V31-W34 WeakPolarHBondContact O-CB 3.31Å; V31-W34 PolarHBondContact O-N 3.39Å; V31-L35 HydrophobicContact CG1-CD1 4.11Å; V31-L35 HydrophobicContact CG1-CG 4.42Å; V31-L35 WeakPolarHBondContact O-CG 3.3Å; V31-L35 PolarHBondContact O-N 2.81Å; V31-L61 HydrophobicContact CG1-CD2 4.11Å |
| 32 | G | 87.3 | Confident | 84.3 | Confident | 0 Ų | 0 | 62.8 Ų | 62.8 | 0% | 0 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -60.6 | -43.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | V28 L29 K36 V58 | V28-G32 PolarHBondContact O-N 2.97Å; L29-G32 PolarHBondContact O-N 3.21Å; G32-K36 WeakPolarHBondContact O-CB 3.15Å; G32-K36 PolarHBondContact O-N 3.4Å; G32-V58 WeakPolarHBondContact O-CG1 3.32Å |
| 33 | L | 89 | Confident | 82.3 | Confident | 73 Ų | 73 | 63 Ų | 63 | 38% | 0.382 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -67.9 | -38.1 | 175.3 | -72.6 | 173.3 | 0 | 0 | 0 | 112.2 | L29 A30 V31 K36 L37 I62 | L29-L33 HydrophobicContact CD1-CD1 4.21Å; L29-L33 HydrophobicContact CD1-CG 4.22Å; L29-L33 HydrophobicContact CG-CD1 4.07Å; L29-L33 HydrophobicContact CG-CG 4.49Å; L29-L33 WeakPolarHBondContact O-CB 3.13Å; L29-L33 WeakPolarHBondContact O-CG 3.41Å; L29-L33 PolarHBondContact O-N 3.43Å; A30-L33 PolarHBondContact O-N 3.43Å; V31-L33 PolarHBondContact O-N 3.41Å; L33-K36 PolarHBondContact O-N 2.88Å; L33-L37 VanDerWaalsContact O-CB 3.3Å; L33-L37 WeakPolarHBondContact O-CB 3.49Å; L33-L37 VanDerWaalsContact O-CG 3.25Å; L33-L37 WeakPolarHBondContact O-CG 3.36Å; L33-L37 PolarHBondContact O-N 2.63Å; L33-I62 HydrophobicContact CD2-CD1 4.38Å |
| 34 | W | 84.3 | Confident | 80.3 | Confident | 188 Ų | 188 | 61.7 Ų | 61.7 | 71% | 0.712 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -59.8 | -50.7 | 174.7 | -178.7 | -90.6 | 0 | 0 | 0 | 111 | A30 V31 K36 L37 D38 | A30-W34 VanDerWaalsContact O-CB 3.28Å; A30-W34 WeakPolarHBondContact O-CB 3.26Å; A30-W34 PolarHBondContact O-N 3.45Å; V31-W34 WeakPolarHBondContact O-CB 3.31Å; V31-W34 PolarHBondContact O-N 3.39Å; W34-K36 VanDerWaalsContact C-N 3.26Å; W34-K36 PolarHBondContact O-N 3.26Å; W34-L37 PolarHBondContact O-N 2.95Å; W34-L37 VanDerWaalsContact O-N 3.13Å; W34-D38 PolarHBondContact O-N 3.46Å |
| 35 | L | 77.5 | Confident | 78.4 | Confident | 39 Ų | 39 | 60.1 Ų | 60.1 | 20% | 0.204 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -59.3 | -37.5 | 176.6 | -69.1 | 173.4 | 0 | 0 | 0 | 111.9 | V31 T41 V58 L61 | V31-L35 HydrophobicContact CG1-CD1 4.11Å; V31-L35 HydrophobicContact CG1-CG 4.42Å; V31-L35 WeakPolarHBondContact O-CG 3.3Å; V31-L35 PolarHBondContact O-N 2.81Å; L35-T41 WeakPolarHBondContact O-CB 3.32Å; L35-T41 WeakPolarHBondContact O-CG2 3.42Å; L35-V58 HydrophobicContact CB-CG1 4.17Å; L35-V58 HydrophobicContact CB-CG2 4.04Å; L35-V58 HydrophobicContact CD1-CG2 4.32Å; L35-L61 HydrophobicContact CD1-CD2 4.13Å |
| 36 | K | 79.9 | Confident | 76.4 | Confident | 62 Ų | 62 | 67.3 Ų | 67.3 | 27% | 0.27 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -71.5 | -35.5 | 176.3 | -179 | 176.9 | -178.7 | -66.1 | 0 | 113 | G32 L33 W34 N42 V58 Y59 I62 | G32-K36 WeakPolarHBondContact O-CB 3.15Å; G32-K36 PolarHBondContact O-N 3.4Å; L33-K36 PolarHBondContact O-N 2.88Å; W34-K36 VanDerWaalsContact C-N 3.26Å; W34-K36 PolarHBondContact O-N 3.26Å; K36-N42 PolarHBondContact O-ND2 3.3Å; K36-N42 PolarHBondContact O-OD1 2.82Å; K36-V58 HydrophobicContact CB-CG1 4Å; K36-Y59 WeakPolarHBondContact CE-OH 3.4Å; K36-I62 HydrophobicContact CB-CD1 4.05Å; K36-I62 HydrophobicContact CD-CD1 3.8Å |
| 37 | L | 79.4 | Confident | 74.2 | Confident | 114 Ų | 114 | 66.3 Ų | 66.3 | 60% | 0.597 | 37% | 0.366 | S | S | * | . | H | α-helix | trans | -91.1 | -20 | -171.7 | -70.6 | 172.5 | 0 | 0 | 0 | 113.4 | L33 W34 S39 N42 | L33-L37 VanDerWaalsContact O-CB 3.3Å; L33-L37 WeakPolarHBondContact O-CB 3.49Å; L33-L37 VanDerWaalsContact O-CG 3.25Å; L33-L37 WeakPolarHBondContact O-CG 3.36Å; L33-L37 PolarHBondContact O-N 2.63Å; W34-L37 PolarHBondContact O-N 2.95Å; W34-L37 VanDerWaalsContact O-N 3.13Å; L37-S39 PolarHBondContact O-N 3.48Å; L37-N42 WeakPolarHBondContact CA-ND2 3.48Å; L37-N42 PolarHBondContact O-ND2 3.04Å |
| 38 | D | 76.5 | Confident | 71.9 | Confident | 46 Ų | 46 | 71.6 Ų | 71.6 | 25% | 0.246 | 39% | 0.386 | C | S | . | . | trans | -58.3 | 133.7 | 178.5 | -171.8 | 35.6 | 0 | 0 | 0 | 111.3 | W34 K40 T41 N42 | W34-D38 PolarHBondContact O-N 3.46Å; D38-K40 VanDerWaalsContact C-N 3.29Å; D38-K40 PolarHBondContact O-N 3.33Å; D38-T41 PolarHBondContact O-N 3.01Å; D38-N42 WeakPolarHBondContact O-CB 3.48Å; D38-N42 PolarHBondContact O-N 3Å | ||
| 39 | S | 61.7 | Low | 69.8 | Low | 91 Ų | 91 | 77.4 Ų | 77.4 | 64% | 0.636 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -68.5 | -31.4 | -169.4 | 57.7 | 0 | 0 | 0 | 0 | 112.3 | L37 S43 | L37-S39 PolarHBondContact O-N 3.48Å; S39-S43 PolarHBondContact O-N 3.35Å |
| 40 | K | 63.7 | Low | 67.6 | Low | 138 Ų | 138 | 77.3 Ų | 77.3 | 60% | 0.6 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -66 | -49.2 | 173.2 | -62.4 | -178.7 | -179.4 | -179.9 | 0 | 110.2 | D38 S43 L44 | D38-K40 VanDerWaalsContact C-N 3.29Å; D38-K40 PolarHBondContact O-N 3.33Å; K40-S43 PolarHBondContact O-N 3.06Å; K40-S43 PolarHBondContact O-OG 2.92Å; K40-L44 WeakPolarHBondContact O-CD1 3.33Å; K40-L44 WeakPolarHBondContact O-CG 3.22Å; K40-L44 PolarHBondContact O-N 3.47Å |
| 41 | T | 61.2 | Low | 65.9 | Low | 11 Ų | 11 | 75.4 Ų | 75.4 | 7% | 0.067 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -69 | -41.3 | 179.9 | -40.3 | 0 | 0 | 0 | 0 | 112.7 | L35 D38 S43 L44 L45 L54 | L35-T41 WeakPolarHBondContact O-CB 3.32Å; L35-T41 WeakPolarHBondContact O-CG2 3.42Å; D38-T41 PolarHBondContact O-N 3.01Å; T41-S43 VanDerWaalsContact C-N 3.3Å; T41-S43 PolarHBondContact O-N 3.2Å; T41-L44 WeakPolarHBondContact O-CB 3.46Å; T41-L44 PolarHBondContact O-N 3.35Å; T41-L44 VanDerWaalsContact O-N 3.07Å; T41-L45 HydrophobicContact CG2-CD1 4.03Å; T41-L45 HydrophobicContact CG2-CG 4.27Å; T41-L45 VanDerWaalsContact O-CG 3.22Å; T41-L45 WeakPolarHBondContact O-CG 3.33Å; T41-L45 PolarHBondContact O-N 2.93Å; T41-L54 HydrophobicContact CG2-CD2 4.15Å |
| 42 | N | 59.1 | Low | 64.5 | Low | 38 Ų | 38 | 80.1 Ų | 80.1 | 20% | 0.203 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -58.8 | -38.7 | 177.1 | -101.7 | -45 | 0 | 0 | 0 | 113.1 | K36 L37 D38 L44 L45 Q46 | K36-N42 PolarHBondContact O-ND2 3.3Å; K36-N42 PolarHBondContact O-OD1 2.82Å; L37-N42 WeakPolarHBondContact CA-ND2 3.48Å; L37-N42 PolarHBondContact O-ND2 3.04Å; D38-N42 WeakPolarHBondContact O-CB 3.48Å; D38-N42 PolarHBondContact O-N 3Å; N42-L44 VanDerWaalsContact C-N 3.28Å; N42-L44 PolarHBondContact O-N 3.42Å; N42-L45 PolarHBondContact O-N 3.31Å; N42-Q46 WeakPolarHBondContact O-CG 3.48Å; N42-Q46 PolarHBondContact O-N 2.94Å; N42-Q46 VanDerWaalsContact O-N 3.12Å |
| 43 | S | 55.8 | Low | 63.2 | Low | 79 Ų | 79 | 81.6 Ų | 81.6 | 55% | 0.552 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -66.8 | -31.6 | 177.4 | 72.3 | 0 | 0 | 0 | 0 | 112.6 | S39 K40 T41 G47 | S39-S43 PolarHBondContact O-N 3.35Å; K40-S43 PolarHBondContact O-N 3.06Å; K40-S43 PolarHBondContact O-OG 2.92Å; T41-S43 VanDerWaalsContact C-N 3.3Å; T41-S43 PolarHBondContact O-N 3.2Å; S43-G47 PolarHBondContact O-N 3.39Å |
| 44 | L | 55.1 | Low | 62 | Low | 54 Ų | 54 | 78.8 Ų | 78.8 | 28% | 0.283 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -79.1 | -28.8 | 175.5 | -61 | 162.8 | 0 | 0 | 0 | 112.6 | K40 T41 N42 S50 P51 T133 | K40-L44 WeakPolarHBondContact O-CD1 3.33Å; K40-L44 WeakPolarHBondContact O-CG 3.22Å; K40-L44 PolarHBondContact O-N 3.47Å; T41-L44 WeakPolarHBondContact O-CB 3.46Å; T41-L44 PolarHBondContact O-N 3.35Å; T41-L44 VanDerWaalsContact O-N 3.07Å; N42-L44 VanDerWaalsContact C-N 3.28Å; N42-L44 PolarHBondContact O-N 3.42Å; L44-S50 VanDerWaalsContact O-CA 3.31Å; L44-S50 WeakPolarHBondContact O-CA 3.34Å; L44-S50 WeakPolarHBondContact O-CB 3.43Å; L44-P51 WeakPolarHBondContact O-CD 3.29Å; L44-T133 HydrophobicContact CD1-CG2 3.25Å; L44-T133 HydrophobicContact CD2-CG2 3.59Å; L44-T133 HydrophobicContact CG-CG2 4.02Å |
| 45 | L | 56 | Low | 61.4 | Low | 10 Ų | 10 | 74.2 Ų | 74.2 | 5% | 0.052 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -78.2 | -22.1 | 177.2 | -68.1 | 170.7 | 0 | 0 | 0 | 113.1 | T41 N42 L54 Y55 | T41-L45 HydrophobicContact CG2-CD1 4.03Å; T41-L45 HydrophobicContact CG2-CG 4.27Å; T41-L45 VanDerWaalsContact O-CG 3.22Å; T41-L45 WeakPolarHBondContact O-CG 3.33Å; T41-L45 PolarHBondContact O-N 2.93Å; N42-L45 PolarHBondContact O-N 3.31Å; L45-L54 HydrophobicContact CD2-CD2 3.91Å; L45-Y55 HydrophobicContact CB-CD2 4.01Å; L45-Y55 VanDerWaalsContact CD2-CA 3.49Å; L45-Y55 HydrophobicContact CD2-CD2 3.58Å; L45-Y55 HydrophobicContact CD2-CG 4.04Å; L45-Y55 HydrophobicContact CG-CD2 4.31Å |
| 46 | Q | 55.3 | Low | 61.3 | Low | 152 Ų | 152 | 76.1 Ų | 76.1 | 71% | 0.71 | 40% | 0.402 | S | S | * | . | H | α-helix | trans | -109.9 | -12.3 | -176.4 | -67.1 | -178.2 | 37.1 | 0 | 0 | 114.8 | N42 | N42-Q46 WeakPolarHBondContact O-CG 3.48Å; N42-Q46 PolarHBondContact O-N 2.94Å; N42-Q46 VanDerWaalsContact O-N 3.12Å |
| 47 | G | 51.3 | Low | 61.2 | Low | 34 Ų | 34 | 74.3 Ų | 74.3 | 35% | 0.351 | 40% | 0.4 | S | S | . | . | S | Bend | trans | -67.3 | 148.6 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.6 | S43 N49 S50 | S43-G47 PolarHBondContact O-N 3.39Å; G47-N49 PolarHBondContact O-N 2.94Å; G47-S50 WeakPolarHBondContact O-CA 3.47Å; G47-S50 WeakPolarHBondContact O-CB 3.43Å; G47-S50 PolarHBondContact O-N 3.17Å; G47-S50 PolarHBondContact O-OG 3.26Å |
| 48 | D | 47.4 | Very low | 61.4 | Low | 168 Ų | 168 | 69.3 Ų | 69.3 | 90% | 0.898 | 38% | 0.375 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -57.2 | -10.2 | -178.4 | -89.5 | -31.1 | 0 | 0 | 0 | 115.2 | ||
| 49 | N | 49.3 | Very low | 61.8 | Low | 164 Ų | 164 | 71.5 Ų | 71.5 | 88% | 0.877 | 38% | 0.38 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -120.1 | 34.1 | 173.6 | -73.6 | -33.7 | 0 | 0 | 0 | 111.9 | G47 | G47-N49 PolarHBondContact O-N 2.94Š|
| 50 | S | 49.9 | Very low | 63.2 | Low | 26 Ų | 26 | 71 Ų | 71 | 18% | 0.182 | 37% | 0.373 | C | S | . | . | trans | -64.1 | 132.2 | -176.1 | 33.1 | 0 | 0 | 0 | 0 | 110.4 | L44 G47 Y52 | L44-S50 VanDerWaalsContact O-CA 3.31Å; L44-S50 WeakPolarHBondContact O-CA 3.34Å; L44-S50 WeakPolarHBondContact O-CB 3.43Å; G47-S50 WeakPolarHBondContact O-CA 3.47Å; G47-S50 WeakPolarHBondContact O-CB 3.43Å; G47-S50 PolarHBondContact O-N 3.17Å; G47-S50 PolarHBondContact O-OG 3.26Å; S50-Y52 PolarHBondContact O-N 2.99Å | ||
| 51 | P | 56 | Low | 64.4 | Low | 15 Ų | 15 | 67.2 Ų | 67.2 | 10% | 0.097 | 36% | 0.359 | C | S | . | . | trans | -65.9 | 97.8 | 178.1 | 25.4 | -33.3 | 0 | 0 | 0 | 109.9 | L44 V53 L54 Y55 Q125 D129 | L44-P51 WeakPolarHBondContact O-CD 3.29Å; P51-V53 PolarHBondContact O-N 3.36Å; P51-L54 HydrophobicContact CB-CB 4.42Å; P51-L54 HydrophobicContact CG-CB 4.22Å; P51-L54 PolarHBondContact O-N 3.26Å; P51-Y55 PolarHBondContact O-N 2.87Å; P51-Q125 HydrophobicContact CB-CG 3.7Å; P51-D129 WeakPolarHBondContact CB-OD2 3.42Å; P51-D129 VanDerWaalsContact CG-CG 3.48Å; P51-D129 WeakPolarHBondContact CG-OD1 3.33Å; P51-D129 WeakPolarHBondContact CG-OD2 3.26Å | ||
| 52 | Y | 59.9 | Low | 65.9 | Low | 180 Ų | 180 | 68.1 Ų | 68.1 | 71% | 0.706 | 36% | 0.363 | S | S | * | . | H | α-helix | trans | -46 | -29.7 | -179.8 | -66.1 | -76.3 | 0 | 0 | 0 | 113.9 | S50 T56 Q125 | S50-Y52 PolarHBondContact O-N 2.99Å; Y52-T56 WeakPolarHBondContact O-CB 3.48Å; Y52-T56 PolarHBondContact O-N 3.11Å; Y52-T56 PolarHBondContact O-OG1 3.46Å; Y52-Q125 VanDerWaalsContact N-NE2 3.19Å |
| 53 | V | 59.9 | Low | 67.6 | Low | 32 Ų | 32 | 68.8 Ų | 68.8 | 19% | 0.194 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -88 | -33.7 | -172.6 | -176.8 | 0 | 0 | 0 | 0 | 113.3 | P51 Y55 T56 G57 F122 Q125 | P51-V53 PolarHBondContact O-N 3.36Å; V53-Y55 VanDerWaalsContact C-N 3.35Å; V53-T56 PolarHBondContact O-N 3Å; V53-G57 PolarHBondContact O-N 3.28Å; V53-F122 HydrophobicContact CG1-CB 3.68Å; V53-F122 HydrophobicContact CG1-CD2 3.4Å; V53-F122 VanDerWaalsContact CG1-CD2 3.4Å; V53-F122 HydrophobicContact CG1-CE2 4.37Å; V53-F122 HydrophobicContact CG1-CG 3.95Å; V53-Q125 HydrophobicContact CB-CB 4.4Å; V53-Q125 VanDerWaalsContact CB-CD 3.45Å; V53-Q125 HydrophobicContact CB-CG 4.23Å |
| 54 | L | 63.6 | Low | 69.5 | Low | 13 Ų | 13 | 68.5 Ų | 68.5 | 7% | 0.068 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -67.6 | -41.6 | 169.5 | -170.1 | 160.9 | 0 | 0 | 0 | 109.8 | T41 L45 P51 T56 G57 V58 D129 L138 | T41-L54 HydrophobicContact CG2-CD2 4.15Å; L45-L54 HydrophobicContact CD2-CD2 3.91Å; P51-L54 HydrophobicContact CB-CB 4.42Å; P51-L54 HydrophobicContact CG-CB 4.22Å; P51-L54 PolarHBondContact O-N 3.26Å; L54-T56 VanDerWaalsContact C-N 3.35Å; L54-T56 PolarHBondContact O-N 2.98Å; L54-G57 PolarHBondContact O-N 2.82Å; L54-V58 HydrophobicContact CD2-CG2 3.99Å; L54-V58 WeakPolarHBondContact O-CG2 3.2Å; L54-V58 PolarHBondContact O-N 3.03Å; L54-D129 HydrophobicContact CD1-CB 4.12Å; L54-D129 WeakPolarHBondContact CD1-OD2 3.43Å; L54-L138 HydrophobicContact CD1-CD1 3.99Å; L54-L138 HydrophobicContact CD1-CD2 3.71Å; L54-L138 HydrophobicContact CD1-CG 4.49Å |
| 55 | Y | 71.3 | Confident | 71.5 | Confident | 93 Ų | 93 | 66 Ų | 66 | 37% | 0.365 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -54.9 | -51.4 | 170.2 | -173.8 | -83.9 | 0 | 0 | 0 | 110.6 | L45 P51 V53 G57 V58 Y59 | L45-Y55 HydrophobicContact CB-CD2 4.01Å; L45-Y55 VanDerWaalsContact CD2-CA 3.49Å; L45-Y55 HydrophobicContact CD2-CD2 3.58Å; L45-Y55 HydrophobicContact CD2-CG 4.04Å; L45-Y55 HydrophobicContact CG-CD2 4.31Å; P51-Y55 PolarHBondContact O-N 2.87Å; V53-Y55 VanDerWaalsContact C-N 3.35Å; Y55-G57 PolarHBondContact O-N 2.91Å; Y55-V58 PolarHBondContact O-N 3.37Å; Y55-Y59 AromaticContact CD1-CD2 3.98Å; Y55-Y59 HydrophobicContact CD1-CD2 3.98Å; Y55-Y59 HydrophobicContact CD1-CE2 4.06Å; Y55-Y59 HydrophobicContact CD2-CD2 4.49Å; Y55-Y59 AromaticContact CD2-CE2 3.96Å; Y55-Y59 HydrophobicContact CD2-CE2 3.96Å; Y55-Y59 AromaticContact CE1-CD2 3.79Å; Y55-Y59 HydrophobicContact CE1-CD2 3.79Å; Y55-Y59 AromaticContact CE1-CE2 3.59Å; Y55-Y59 HydrophobicContact CE1-CE2 3.59Å; Y55-Y59 HydrophobicContact CE1-CG 4.46Å; Y55-Y59 HydrophobicContact CE2-CD2 4.31Å; Y55-Y59 AromaticContact CE2-CE2 3.45Å; Y55-Y59 HydrophobicContact CE2-CE2 3.45Å; Y55-Y59 VanDerWaalsContact CE2-CE2 3.45Å; Y55-Y59 HydrophobicContact CG-CD2 4.32Å; Y55-Y59 HydrophobicContact CG-CE2 4.23Å; Y55-Y59 AromaticContact CZ-CD2 3.96Å; Y55-Y59 AromaticContact CZ-CE2 3.24Å; Y55-Y59 AromaticContact CZ-CZ 3.56Å; Y55-Y59 WeakPolarHBondContact O-CD2 3.16Å; Y55-Y59 PolarHBondContact O-N 3.39Å; Y55-Y59 PolarHBondContact OH-OH 3.46Å; Y55-Y59 VanDerWaalsContact OH-OH 3.12Å |
| 56 | T | 74.3 | Confident | 73.5 | Confident | 79 Ų | 79 | 67 Ų | 67 | 49% | 0.485 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -60.8 | -43.1 | 178.7 | -58.5 | 0 | 0 | 0 | 0 | 112 | Y52 V53 L54 Y59 V60 | Y52-T56 WeakPolarHBondContact O-CB 3.48Å; Y52-T56 PolarHBondContact O-N 3.11Å; Y52-T56 PolarHBondContact O-OG1 3.46Å; V53-T56 PolarHBondContact O-N 3Å; L54-T56 VanDerWaalsContact C-N 3.35Å; L54-T56 PolarHBondContact O-N 2.98Å; T56-Y59 PolarHBondContact O-N 3.5Å; T56-V60 HydrophobicContact CG2-CG2 4.35Å; T56-V60 VanDerWaalsContact O-CG2 3.27Å; T56-V60 WeakPolarHBondContact O-CG2 3.38Å; T56-V60 PolarHBondContact O-N 3.01Å |
| 57 | G | 78.9 | Confident | 75.4 | Confident | 23 Ų | 23 | 63.2 Ų | 63.2 | 24% | 0.237 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -61.9 | -44.9 | 179.7 | 0 | 0 | 0 | 0 | 0 | 114 | V53 L54 Y55 Y59 V60 L61 | V53-G57 PolarHBondContact O-N 3.28Å; L54-G57 PolarHBondContact O-N 2.82Å; Y55-G57 PolarHBondContact O-N 2.91Å; G57-Y59 PolarHBondContact O-N 3.02Å; G57-V60 PolarHBondContact O-N 3.45Å; G57-L61 WeakPolarHBondContact O-CB 3.2Å; G57-L61 PolarHBondContact O-N 2.92Å |
| 58 | V | 82.4 | Confident | 77.6 | Confident | 9 Ų | 9 | 64 Ų | 64 | 6% | 0.055 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -64.2 | -41.8 | 178.4 | 173.1 | 0 | 0 | 0 | 0 | 111.2 | G32 L35 K36 L54 Y55 L61 I62 | G32-V58 WeakPolarHBondContact O-CG1 3.32Å; L35-V58 HydrophobicContact CB-CG1 4.17Å; L35-V58 HydrophobicContact CB-CG2 4.04Å; L35-V58 HydrophobicContact CD1-CG2 4.32Å; K36-V58 HydrophobicContact CB-CG1 4Å; L54-V58 HydrophobicContact CD2-CG2 3.99Å; L54-V58 WeakPolarHBondContact O-CG2 3.2Å; L54-V58 PolarHBondContact O-N 3.03Å; Y55-V58 PolarHBondContact O-N 3.37Å; V58-L61 PolarHBondContact O-N 2.96Å; V58-I62 HydrophobicContact CG1-CD1 4.02Å; V58-I62 VanDerWaalsContact O-CG1 3.32Å; V58-I62 WeakPolarHBondContact O-CG1 3.47Å; V58-I62 PolarHBondContact O-N 3.36Å |
| 59 | Y | 86.7 | Confident | 79.9 | Confident | 93 Ų | 93 | 58.8 Ų | 58.8 | 37% | 0.365 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -67.8 | -37.4 | 176.9 | -83.5 | -100.1 | 0 | 0 | 0 | 112.4 | K36 Y55 T56 G57 I62 A63 | K36-Y59 WeakPolarHBondContact CE-OH 3.4Å; Y55-Y59 AromaticContact CD1-CD2 3.98Å; Y55-Y59 HydrophobicContact CD1-CD2 3.98Å; Y55-Y59 HydrophobicContact CD1-CE2 4.06Å; Y55-Y59 HydrophobicContact CD2-CD2 4.49Å; Y55-Y59 AromaticContact CD2-CE2 3.96Å; Y55-Y59 HydrophobicContact CD2-CE2 3.96Å; Y55-Y59 AromaticContact CE1-CD2 3.79Å; Y55-Y59 HydrophobicContact CE1-CD2 3.79Å; Y55-Y59 AromaticContact CE1-CE2 3.59Å; Y55-Y59 HydrophobicContact CE1-CE2 3.59Å; Y55-Y59 HydrophobicContact CE1-CG 4.46Å; Y55-Y59 HydrophobicContact CE2-CD2 4.31Å; Y55-Y59 AromaticContact CE2-CE2 3.45Å; Y55-Y59 HydrophobicContact CE2-CE2 3.45Å; Y55-Y59 VanDerWaalsContact CE2-CE2 3.45Å; Y55-Y59 HydrophobicContact CG-CD2 4.32Å; Y55-Y59 HydrophobicContact CG-CE2 4.23Å; Y55-Y59 AromaticContact CZ-CD2 3.96Å; Y55-Y59 AromaticContact CZ-CE2 3.24Å; Y55-Y59 AromaticContact CZ-CZ 3.56Å; Y55-Y59 WeakPolarHBondContact O-CD2 3.16Å; Y55-Y59 PolarHBondContact O-N 3.39Å; Y55-Y59 PolarHBondContact OH-OH 3.46Å; Y55-Y59 VanDerWaalsContact OH-OH 3.12Å; T56-Y59 PolarHBondContact O-N 3.5Å; G57-Y59 PolarHBondContact O-N 3.02Å; Y59-I62 PolarHBondContact O-N 2.84Å; Y59-A63 WeakPolarHBondContact O-CB 3.37Å; Y59-A63 PolarHBondContact O-N 3.22Å |
| 60 | V | 89.9 | Confident | 82.2 | Confident | 80 Ų | 80 | 54.2 Ų | 54.2 | 49% | 0.485 | 30% | 0.296 | S | S | . | . | H | α-helix | trans | -61.8 | -44.7 | 171.8 | 169.5 | 0 | 0 | 0 | 0 | 110.4 | T56 G57 I62 A63 V64 | T56-V60 HydrophobicContact CG2-CG2 4.35Å; T56-V60 VanDerWaalsContact O-CG2 3.27Å; T56-V60 WeakPolarHBondContact O-CG2 3.38Å; T56-V60 PolarHBondContact O-N 3.01Å; G57-V60 PolarHBondContact O-N 3.45Å; V60-I62 PolarHBondContact O-N 3.25Å; V60-A63 PolarHBondContact O-N 3.29Å; V60-V64 HydrophobicContact CG1-CG2 4.22Å; V60-V64 WeakPolarHBondContact O-CB 3.37Å; V60-V64 WeakPolarHBondContact O-CG2 3.22Å; V60-V64 PolarHBondContact O-N 2.93Å |
| 61 | L | 89.2 | Confident | 84.4 | Confident | 58 Ų | 58 | 53.7 Ų | 53.7 | 30% | 0.304 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -60.6 | -44.6 | 177.8 | -168.1 | 70.1 | 0 | 0 | 0 | 111.9 | V28 V31 L35 G57 V58 G65 | V28-L61 HydrophobicContact CG1-CD1 3.59Å; V28-L61 HydrophobicContact CG1-CG 3.93Å; V31-L61 HydrophobicContact CG1-CD2 4.11Å; L35-L61 HydrophobicContact CD1-CD2 4.13Å; G57-L61 WeakPolarHBondContact O-CB 3.2Å; G57-L61 PolarHBondContact O-N 2.92Å; V58-L61 PolarHBondContact O-N 2.96Å; L61-G65 PolarHBondContact O-N 3.43Å |
| 62 | I | 93.1 | Very high | 86.3 | Confident | 30 Ų | 30 | 53 Ų | 53 | 15% | 0.154 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -60.8 | -47.3 | 174.5 | -69.7 | 166.9 | 0 | 0 | 0 | 110.6 | L29 L33 K36 V58 Y59 V60 G65 A66 | L29-I62 HydrophobicContact CD1-CB 4.46Å; L29-I62 HydrophobicContact CD1-CG2 3.87Å; L33-I62 HydrophobicContact CD2-CD1 4.38Å; K36-I62 HydrophobicContact CB-CD1 4.05Å; K36-I62 HydrophobicContact CD-CD1 3.8Å; V58-I62 HydrophobicContact CG1-CD1 4.02Å; V58-I62 VanDerWaalsContact O-CG1 3.32Å; V58-I62 WeakPolarHBondContact O-CG1 3.47Å; V58-I62 PolarHBondContact O-N 3.36Å; Y59-I62 PolarHBondContact O-N 2.84Å; V60-I62 PolarHBondContact O-N 3.25Å; I62-G65 PolarHBondContact O-N 3.15Å; I62-A66 VanDerWaalsContact O-CB 3.29Å; I62-A66 WeakPolarHBondContact O-CB 3.35Å; I62-A66 PolarHBondContact O-N 3.07Å |
| 63 | A | 94.9 | Very high | 88 | Confident | 53 Ų | 53 | 49 Ų | 49 | 44% | 0.438 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -62.5 | -48.4 | -178.9 | 0 | 0 | 0 | 0 | 0 | 111.7 | Y59 V60 A66 V67 | Y59-A63 WeakPolarHBondContact O-CB 3.37Å; Y59-A63 PolarHBondContact O-N 3.22Å; V60-A63 PolarHBondContact O-N 3.29Å; A63-A66 PolarHBondContact O-N 3.35Å; A63-V67 WeakPolarHBondContact O-CG2 3.46Å; A63-V67 PolarHBondContact O-N 3.35Å |
| 64 | V | 95.1 | Very high | 89.7 | Confident | 73 Ų | 73 | 48.4 Ų | 48.4 | 44% | 0.442 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -62.2 | -47.6 | 178.1 | 172.4 | 0 | 0 | 0 | 0 | 110.7 | V60 A66 V67 M68 | V60-V64 HydrophobicContact CG1-CG2 4.22Å; V60-V64 WeakPolarHBondContact O-CB 3.37Å; V60-V64 WeakPolarHBondContact O-CG2 3.22Å; V60-V64 PolarHBondContact O-N 2.93Å; V64-A66 VanDerWaalsContact C-N 3.35Å; V64-A66 PolarHBondContact O-N 3.46Å; V64-V67 PolarHBondContact O-N 3.45Å; V64-M68 HydrophobicContact CG1-CG 4.33Å; V64-M68 HydrophobicContact CG1-SD 3.84Å; V64-M68 WeakPolarHBondContact O-CB 3.35Å; V64-M68 VanDerWaalsContact O-CG 3.31Å; V64-M68 WeakPolarHBondContact O-CG 3.47Å; V64-M68 PolarHBondContact O-N 2.89Å |
| 65 | G | 97.1 | Very high | 91.1 | Very high | 0 Ų | 0 | 47.8 Ų | 47.8 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -59.5 | -43.1 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | L61 I62 M68 M69 | L61-G65 PolarHBondContact O-N 3.43Å; I62-G65 PolarHBondContact O-N 3.15Å; G65-M68 PolarHBondContact O-N 2.89Å; G65-M69 WeakPolarHBondContact O-CB 3.35Å; G65-M69 PolarHBondContact O-N 3.43Å |
| 66 | A | 97.3 | Very high | 92.2 | Very high | 32 Ų | 32 | 43.7 Ų | 43.7 | 26% | 0.264 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -64.3 | -45.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | L29 I62 A63 V64 M69 V70 | L29-A66 HydrophobicContact CD1-CB 4.22Å; I62-A66 VanDerWaalsContact O-CB 3.29Å; I62-A66 WeakPolarHBondContact O-CB 3.35Å; I62-A66 PolarHBondContact O-N 3.07Å; A63-A66 PolarHBondContact O-N 3.35Å; V64-A66 VanDerWaalsContact C-N 3.35Å; V64-A66 PolarHBondContact O-N 3.46Å; A66-M69 PolarHBondContact O-N 2.95Å; A66-V70 WeakPolarHBondContact O-CG2 3.43Å; A66-V70 PolarHBondContact O-N 3.49Å |
| 67 | V | 96.4 | Very high | 93 | Very high | 72 Ų | 72 | 40.8 Ų | 40.8 | 44% | 0.436 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -62 | -47.2 | 177.1 | 170.9 | 0 | 0 | 0 | 0 | 110.6 | A63 V64 M69 V70 V71 I97 | A63-V67 WeakPolarHBondContact O-CG2 3.46Å; A63-V67 PolarHBondContact O-N 3.35Å; V64-V67 PolarHBondContact O-N 3.45Å; V67-M69 VanDerWaalsContact C-N 3.32Å; V67-M69 PolarHBondContact O-N 3.32Å; V67-V70 PolarHBondContact O-N 3.22Å; V67-V71 HydrophobicContact CG1-CG2 4.17Å; V67-V71 WeakPolarHBondContact O-CB 3.23Å; V67-V71 VanDerWaalsContact O-CG2 3.27Å; V67-V71 WeakPolarHBondContact O-CG2 3.11Å; V67-V71 PolarHBondContact O-N 2.91Å; V67-I97 HydrophobicContact CG1-CD1 4.06Å |
| 68 | M | 96.5 | Very high | 93.6 | Very high | 52 Ų | 52 | 39.7 Ų | 39.7 | 26% | 0.256 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -58.3 | -44 | 176.5 | -73.1 | 176.7 | 66.9 | 0 | 0 | 111.9 | F21 A24 V64 G65 G72 | F21-M68 HydrophobicContact CD1-CE 4.11Å; F21-M68 HydrophobicContact CE1-CE 4.49Å; A24-M68 HydrophobicContact CB-CE 4.2Å; V64-M68 HydrophobicContact CG1-CG 4.33Å; V64-M68 HydrophobicContact CG1-SD 3.84Å; V64-M68 WeakPolarHBondContact O-CB 3.35Å; V64-M68 VanDerWaalsContact O-CG 3.31Å; V64-M68 WeakPolarHBondContact O-CG 3.47Å; V64-M68 PolarHBondContact O-N 2.89Å; G65-M68 PolarHBondContact O-N 2.89Å; M68-G72 PolarHBondContact O-N 2.99Å |
| 69 | M | 97.3 | Very high | 94 | Very high | 58 Ų | 58 | 39.2 Ų | 39.2 | 29% | 0.286 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -62.5 | -48.4 | 177.5 | -173.3 | -175.6 | 74.4 | 0 | 0 | 111.5 | W22 L29 G65 A66 V67 F73 | W22-M69 VanDerWaalsContact CD1-O 3.31Å; L29-M69 HydrophobicContact CD2-CE 4Å; L29-M69 HydrophobicContact CD2-SD 4.01Å; G65-M69 WeakPolarHBondContact O-CB 3.35Å; G65-M69 PolarHBondContact O-N 3.43Å; A66-M69 PolarHBondContact O-N 2.95Å; V67-M69 VanDerWaalsContact C-N 3.32Å; V67-M69 PolarHBondContact O-N 3.32Å; M69-F73 VanDerWaalsContact O-CB 3.27Å; M69-F73 WeakPolarHBondContact O-CB 3.27Å; M69-F73 PolarHBondContact O-N 2.86Å |
| 70 | V | 96.5 | Very high | 94.1 | Very high | 67 Ų | 67 | 39.2 Ų | 39.2 | 41% | 0.406 | 23% | 0.226 | S | C | . | . | H | α-helix | trans | -64.2 | -47.1 | -179.5 | 171.3 | 0 | 0 | 0 | 0 | 111.2 | A66 V67 F73 L74 | A66-V70 WeakPolarHBondContact O-CG2 3.43Å; A66-V70 PolarHBondContact O-N 3.49Å; V67-V70 PolarHBondContact O-N 3.22Å; V70-F73 PolarHBondContact O-N 3.47Å; V70-L74 HydrophobicContact CG1-CD1 4.02Å; V70-L74 HydrophobicContact CG1-CG 4.49Å; V70-L74 VanDerWaalsContact O-CG 3.32Å; V70-L74 WeakPolarHBondContact O-CG 3.46Å; V70-L74 PolarHBondContact O-N 2.94Å |
| 71 | V | 96.1 | Very high | 94.1 | Very high | 15 Ų | 15 | 41.1 Ų | 41.1 | 9% | 0.091 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -64.6 | -45.1 | -179.4 | 171.8 | 0 | 0 | 0 | 0 | 110.8 | V67 F73 L74 G75 F90 F93 L94 I97 | V67-V71 HydrophobicContact CG1-CG2 4.17Å; V67-V71 WeakPolarHBondContact O-CB 3.23Å; V67-V71 VanDerWaalsContact O-CG2 3.27Å; V67-V71 WeakPolarHBondContact O-CG2 3.11Å; V67-V71 PolarHBondContact O-N 2.91Å; V71-F73 PolarHBondContact O-N 3.05Å; V71-L74 PolarHBondContact O-N 3.3Å; V71-G75 PolarHBondContact O-N 3.26Å; V71-F90 HydrophobicContact CG1-CD2 3.81Å; V71-F90 HydrophobicContact CG1-CE2 3.54Å; V71-F90 VanDerWaalsContact O-CD2 3.29Å; V71-F90 WeakPolarHBondContact O-CD2 3.41Å; V71-F90 WeakPolarHBondContact O-CE2 3.21Å; V71-F93 HydrophobicContact CG2-CB 3.92Å; V71-F93 HydrophobicContact CG2-CG 4.2Å; V71-L94 HydrophobicContact CG1-CD2 4.25Å; V71-I97 HydrophobicContact CG2-CD1 4.05Å |
| 72 | G | 95.9 | Very high | 94.1 | Very high | 1 Ų | 1 | 41.5 Ų | 41.5 | 1% | 0.01 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -60.9 | -42.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | M68 G75 C76 | M68-G72 PolarHBondContact O-N 2.99Å; G72-G75 PolarHBondContact O-N 3.22Å; G72-C76 PolarHBondContact O-N 3.19Å; G72-C76 PolarHBondContact O-SG 2.93Å; G72-C76 VanDerWaalsContact O-SG 3.35Å |
| 73 | F | 95.6 | Very high | 94 | Very high | 96 Ų | 96 | 41.5 Ų | 41.5 | 42% | 0.421 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -62.2 | -46.6 | 176.3 | 179 | -98.9 | 0 | 0 | 0 | 112.2 | M69 V70 V71 G75 C76 C77 M86 | M69-F73 VanDerWaalsContact O-CB 3.27Å; M69-F73 WeakPolarHBondContact O-CB 3.27Å; M69-F73 PolarHBondContact O-N 2.86Å; V70-F73 PolarHBondContact O-N 3.47Å; V71-F73 PolarHBondContact O-N 3.05Å; F73-G75 VanDerWaalsContact C-N 3.33Å; F73-G75 PolarHBondContact O-N 3.44Å; F73-C76 PolarHBondContact O-N 3.3Å; F73-C76 PolarHBondContact O-SG 3.49Å; F73-C77 WeakPolarHBondContact CE2-SG 3.44Å; F73-C77 HydrophobicContact CZ-CB 4.49Å; F73-C77 VanDerWaalsContact CZ-SG 3.55Å; F73-C77 VanDerWaalsContact O-CB 3.24Å; F73-C77 WeakPolarHBondContact O-CB 3.47Å; F73-C77 PolarHBondContact O-N 2.97Å; F73-M86 HydrophobicContact CE1-CE 4.43Å |
| 74 | L | 95.1 | Very high | 93.7 | Very high | 19 Ų | 19 | 40.8 Ų | 40.8 | 10% | 0.099 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -62.7 | -40.7 | 177.1 | -69.6 | 172.8 | 0 | 0 | 0 | 111.7 | V70 V71 G78 L89 F90 F93 | V70-L74 HydrophobicContact CG1-CD1 4.02Å; V70-L74 HydrophobicContact CG1-CG 4.49Å; V70-L74 VanDerWaalsContact O-CG 3.32Å; V70-L74 WeakPolarHBondContact O-CG 3.46Å; V70-L74 PolarHBondContact O-N 2.94Å; V71-L74 PolarHBondContact O-N 3.3Å; L74-G78 WeakPolarHBondContact O-CA 3.21Å; L74-G78 PolarHBondContact O-N 3.38Å; L74-L89 HydrophobicContact CD1-CB 4.18Å; L74-L89 HydrophobicContact CD2-CD1 4.46Å; L74-F90 HydrophobicContact CB-CB 4.13Å; L74-F93 HydrophobicContact CD1-CD2 3.64Å; L74-F93 HydrophobicContact CD1-CE2 3.64Å |
| 75 | G | 93.9 | Very high | 93.6 | Very high | 0 Ų | 0 | 43.4 Ų | 43.4 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -64.1 | -48 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | V71 G72 F73 A79 | V71-G75 PolarHBondContact O-N 3.26Å; G72-G75 PolarHBondContact O-N 3.22Å; F73-G75 VanDerWaalsContact C-N 3.33Å; F73-G75 PolarHBondContact O-N 3.44Å; G75-A79 VanDerWaalsContact O-CB 3.28Å; G75-A79 WeakPolarHBondContact O-CB 3.33Å; G75-A79 PolarHBondContact O-N 3.11Å; G75-A79 VanDerWaalsContact O-N 3.07Å |
| 76 | C | 93.3 | Very high | 93.4 | Very high | 8 Ų | 8 | 45.3 Ų | 45.3 | 5% | 0.054 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -71 | -46.4 | -178.6 | 72 | 0 | 0 | 0 | 0 | 112.3 | F15 N18 G72 F73 A79 I80 | F15-C76 HydrophobicContact CD2-CB 3.95Å; F15-C76 HydrophobicContact CE2-CB 4.1Å; N18-C76 HydrophobicContact CB-CB 4.25Å; G72-C76 PolarHBondContact O-N 3.19Å; G72-C76 PolarHBondContact O-SG 2.93Å; G72-C76 VanDerWaalsContact O-SG 3.35Å; F73-C76 PolarHBondContact O-N 3.3Å; F73-C76 PolarHBondContact O-SG 3.49Å; C76-A79 PolarHBondContact O-N 3.46Å; C76-I80 WeakPolarHBondContact O-CG2 3.24Å; C76-I80 PolarHBondContact O-N 3.2Å |
| 77 | C | 92.3 | Very high | 93.1 | Very high | 17 Ų | 17 | 43.9 Ų | 43.9 | 12% | 0.115 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -68.6 | -40.4 | 178.7 | -71.9 | 0 | 0 | 0 | 0 | 111.6 | F73 A79 I80 Q81 M86 | F73-C77 WeakPolarHBondContact CE2-SG 3.44Å; F73-C77 HydrophobicContact CZ-CB 4.49Å; F73-C77 VanDerWaalsContact CZ-SG 3.55Å; F73-C77 VanDerWaalsContact O-CB 3.24Å; F73-C77 WeakPolarHBondContact O-CB 3.47Å; F73-C77 PolarHBondContact O-N 2.97Å; C77-A79 VanDerWaalsContact C-N 3.33Å; C77-A79 PolarHBondContact O-N 3.37Å; C77-I80 PolarHBondContact O-N 2.91Å; C77-Q81 WeakPolarHBondContact O-CB 3.45Å; C77-Q81 WeakPolarHBondContact O-CG 3.48Å; C77-Q81 PolarHBondContact O-N 3.48Å; C77-M86 HydrophobicContact CB-CE 4.17Å; C77-M86 HydrophobicContact CB-SD 3.89Å |
| 78 | G | 90.7 | Very high | 93 | Very high | 0 Ų | 0 | 41.8 Ų | 41.8 | 0% | 0 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -60.2 | -42.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | L74 E82 S83 | L74-G78 WeakPolarHBondContact O-CA 3.21Å; L74-G78 PolarHBondContact O-N 3.38Å; G78-E82 PolarHBondContact O-N 3.3Å; G78-S83 PolarHBondContact O-N 3.47Å |
| 79 | A | 90.7 | Very high | 92.9 | Very high | 0 Ų | 0 | 43 Ų | 43 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -66.9 | -48 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | K11 I14 F15 G75 C76 C77 L216 | K11-A79 WeakPolarHBondContact CE-O 3.36Å; I14-A79 HydrophobicContact CG2-CB 3.99Å; F15-A79 HydrophobicContact CB-CB 4.44Å; G75-A79 VanDerWaalsContact O-CB 3.28Å; G75-A79 WeakPolarHBondContact O-CB 3.33Å; G75-A79 PolarHBondContact O-N 3.11Å; G75-A79 VanDerWaalsContact O-N 3.07Å; C76-A79 PolarHBondContact O-N 3.46Å; C77-A79 VanDerWaalsContact C-N 3.33Å; C77-A79 PolarHBondContact O-N 3.37Å; A79-L216 HydrophobicContact CB-CD2 4.18Å |
| 80 | I | 90.3 | Very high | 92.8 | Very high | 93 Ų | 93 | 40.5 Ų | 40.5 | 48% | 0.477 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -73.9 | -42.3 | -174.6 | -159.2 | 168 | 0 | 0 | 0 | 112.9 | K11 F15 C76 C77 E82 | K11-I80 PolarHBondContact NZ-O 3.15Å; F15-I80 HydrophobicContact CD2-CB 4.21Å; F15-I80 HydrophobicContact CE2-CB 4.36Å; F15-I80 HydrophobicContact CE2-CD1 4.05Å; F15-I80 HydrophobicContact CZ-CD1 4.39Å; C76-I80 WeakPolarHBondContact O-CG2 3.24Å; C76-I80 PolarHBondContact O-N 3.2Å; C77-I80 PolarHBondContact O-N 2.91Å; I80-E82 PolarHBondContact O-N 3.32Å |
| 81 | Q | 89.8 | Confident | 92.8 | Very high | 120 Ų | 120 | 40.2 Ų | 40.2 | 56% | 0.561 | 21% | 0.212 | S | C | * | . | H | α-helix | trans | -79 | -6.3 | -179.6 | -61 | -179.1 | 9.3 | 0 | 0 | 112.7 | C77 S83 | C77-Q81 WeakPolarHBondContact O-CB 3.45Å; C77-Q81 WeakPolarHBondContact O-CG 3.48Å; C77-Q81 PolarHBondContact O-N 3.48Å; Q81-S83 PolarHBondContact O-N 3.43Å; Q81-S83 VanDerWaalsContact O-N 3.15Å |
| 82 | E | 89.1 | Confident | 92.8 | Very high | 65 Ų | 65 | 42.3 Ų | 42.3 | 30% | 0.304 | 23% | 0.227 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 51.7 | 37.7 | -176.1 | -60.2 | -179.9 | 178.7 | 0 | 0 | 111.6 | K11 G78 I80 P84 I220 | K11-E82 IonicContact NZ-OE1 3.17Å; K11-E82 PolarHBondContact NZ-OE1 2.98Å; G78-E82 PolarHBondContact O-N 3.3Å; I80-E82 PolarHBondContact O-N 3.32Å; E82-P84 VanDerWaalsContact O-CD 3.31Å; E82-P84 WeakPolarHBondContact O-CD 3.4Å; E82-I220 HydrophobicContact CB-CD1 3.95Å; E82-I220 HydrophobicContact CB-CG1 4.17Å; E82-I220 HydrophobicContact CB-CG2 4.29Å; E82-I220 HydrophobicContact CG-CD1 4.28Å; E82-I220 HydrophobicContact CG-CG1 4.44Å; E82-I220 WeakPolarHBondContact O-CG2 3.49Å |
| 83 | S | 90.7 | Very high | 92.8 | Very high | 30 Ų | 30 | 46.1 Ų | 46.1 | 21% | 0.21 | 24% | 0.244 | C | C | . | . | trans | -90.5 | 109.3 | -176.3 | 177.1 | 0 | 0 | 0 | 0 | 110.1 | G78 Q81 L85 M86 L87 | G78-S83 PolarHBondContact O-N 3.47Å; Q81-S83 PolarHBondContact O-N 3.43Å; Q81-S83 VanDerWaalsContact O-N 3.15Å; S83-L85 PolarHBondContact O-N 3.31Å; S83-M86 PolarHBondContact O-N 3.16Å; S83-L87 PolarHBondContact O-N 2.91Å | ||
| 84 | P | 88.6 | Confident | 92.8 | Very high | 38 Ų | 38 | 42.3 Ų | 42.3 | 25% | 0.247 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -64.2 | -26.5 | -177.8 | 25.9 | -34.5 | 0 | 0 | 0 | 112.6 | E82 G88 R221 | E82-P84 VanDerWaalsContact O-CD 3.31Å; E82-P84 WeakPolarHBondContact O-CD 3.4Å; P84-G88 PolarHBondContact O-N 3.34Å; P84-R221 HydrophobicContact CB-CG 4.4Å |
| 85 | L | 92.3 | Very high | 92.8 | Very high | 128 Ų | 128 | 45 Ų | 45 | 67% | 0.67 | 24% | 0.242 | S | C | * | . | H | α-helix | trans | -68.7 | -49.7 | 176 | -179.1 | 66.2 | 0 | 0 | 0 | 111.5 | S83 L87 G88 L89 | S83-L85 PolarHBondContact O-N 3.31Å; L85-L87 VanDerWaalsContact C-N 3.32Å; L85-L87 PolarHBondContact O-N 2.84Å; L85-G88 PolarHBondContact O-N 3.06Å; L85-L89 WeakPolarHBondContact O-CG 3.28Å; L85-L89 PolarHBondContact O-N 3.42Å |
| 86 | M | 92.9 | Very high | 93 | Very high | 41 Ų | 41 | 50 Ų | 50 | 20% | 0.202 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -63.3 | -40.8 | 178 | -76.6 | -178.5 | 145.4 | 0 | 0 | 111.7 | F73 C77 S83 G88 L89 F90 | F73-M86 HydrophobicContact CE1-CE 4.43Å; C77-M86 HydrophobicContact CB-CE 4.17Å; C77-M86 HydrophobicContact CB-SD 3.89Å; S83-M86 PolarHBondContact O-N 3.16Å; M86-G88 VanDerWaalsContact C-N 3.31Å; M86-G88 PolarHBondContact O-N 2.89Å; M86-L89 PolarHBondContact O-N 2.82Å; M86-F90 PolarHBondContact O-N 3.2Å |
| 87 | L | 92.2 | Very high | 93.1 | Very high | 1 Ų | 1 | 51.8 Ų | 51.8 | 1% | 0.005 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -65.4 | -36.5 | 176.2 | -136.2 | 74.3 | 0 | 0 | 0 | 111.9 | S83 L85 F91 T213 L216 C217 I220 | S83-L87 PolarHBondContact O-N 2.91Å; L85-L87 VanDerWaalsContact C-N 3.32Å; L85-L87 PolarHBondContact O-N 2.84Å; L87-F91 WeakPolarHBondContact O-CB 3.47Å; L87-F91 PolarHBondContact O-N 3.26Å; L87-T213 HydrophobicContact CD2-CG2 4.41Å; L87-T213 HydrophobicContact CG-CG2 3.91Å; L87-T213 WeakPolarHBondContact O-CG2 3.45Å; L87-L216 HydrophobicContact CD1-CD2 4.25Å; L87-L216 HydrophobicContact CD2-CB 3.95Å; L87-L216 HydrophobicContact CD2-CD2 3.95Å; L87-L216 HydrophobicContact CD2-CG 3.87Å; L87-C217 HydrophobicContact CD2-CB 3.87Å; L87-I220 HydrophobicContact CD2-CD1 4.25Å |
| 88 | G | 93.3 | Very high | 93.3 | Very high | 28 Ų | 28 | 53.7 Ų | 53.7 | 29% | 0.289 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -64 | -44.3 | 172.1 | 0 | 0 | 0 | 0 | 0 | 112.7 | P84 L85 M86 F91 S92 | P84-G88 PolarHBondContact O-N 3.34Å; L85-G88 PolarHBondContact O-N 3.06Å; M86-G88 VanDerWaalsContact C-N 3.31Å; M86-G88 PolarHBondContact O-N 2.89Å; G88-F91 WeakPolarHBondContact O-CB 3.29Å; G88-F91 PolarHBondContact O-N 3.23Å; G88-S92 PolarHBondContact O-N 3.46Å; G88-S92 PolarHBondContact O-OG 2.95Å |
| 89 | L | 95 | Very high | 93.6 | Very high | 77 Ų | 77 | 56.5 Ų | 56.5 | 40% | 0.403 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -62.1 | -45.5 | 175 | -69.7 | 174.7 | 0 | 0 | 0 | 111.5 | L74 L85 M86 F91 S92 F93 | L74-L89 HydrophobicContact CD1-CB 4.18Å; L74-L89 HydrophobicContact CD2-CD1 4.46Å; L85-L89 WeakPolarHBondContact O-CG 3.28Å; L85-L89 PolarHBondContact O-N 3.42Å; M86-L89 PolarHBondContact O-N 2.82Å; L89-F91 VanDerWaalsContact C-N 3.33Å; L89-F91 PolarHBondContact O-N 3.23Å; L89-S92 PolarHBondContact O-N 3.46Å; L89-F93 WeakPolarHBondContact O-CD2 3.37Å; L89-F93 PolarHBondContact O-N 3.12Å |
| 90 | F | 95.3 | Very high | 93.9 | Very high | 6 Ų | 6 | 60.8 Ų | 60.8 | 3% | 0.026 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -55.7 | -47.5 | 174.4 | 176.6 | -114.6 | 0 | 0 | 0 | 111.7 | N18 V71 L74 M86 S92 F93 L94 T213 | N18-F90 WeakPolarHBondContact OD1-CE2 3.32Å; N18-F90 WeakPolarHBondContact OD1-CZ 3.34Å; V71-F90 HydrophobicContact CG1-CD2 3.81Å; V71-F90 HydrophobicContact CG1-CE2 3.54Å; V71-F90 VanDerWaalsContact O-CD2 3.29Å; V71-F90 WeakPolarHBondContact O-CD2 3.41Å; V71-F90 WeakPolarHBondContact O-CE2 3.21Å; L74-F90 HydrophobicContact CB-CB 4.13Å; M86-F90 PolarHBondContact O-N 3.2Å; F90-S92 PolarHBondContact O-N 2.97Å; F90-F93 PolarHBondContact O-N 2.74Å; F90-L94 HydrophobicContact CD1-CD1 4.16Å; F90-L94 HydrophobicContact CD2-CG 4.48Å; F90-L94 HydrophobicContact CE1-CD1 3.56Å; F90-L94 HydrophobicContact CE1-CG 4.32Å; F90-L94 HydrophobicContact CE2-CD1 4.15Å; F90-L94 HydrophobicContact CE2-CD2 4.27Å; F90-L94 HydrophobicContact CE2-CG 4.12Å; F90-L94 HydrophobicContact CZ-CD1 3.54Å; F90-L94 HydrophobicContact CZ-CD2 4.3Å; F90-L94 HydrophobicContact CZ-CG 4.02Å; F90-L94 WeakPolarHBondContact O-CG 3.27Å; F90-L94 PolarHBondContact O-N 2.84Å; F90-T213 HydrophobicContact CD1-CG2 3.69Å; F90-T213 WeakPolarHBondContact CD1-OG1 3.47Å; F90-T213 HydrophobicContact CE1-CG2 4.29Å; F90-T213 WeakPolarHBondContact CE1-OG1 3.41Å |
| 91 | F | 95.6 | Very high | 94.1 | Very high | 61 Ų | 61 | 58.5 Ų | 58.5 | 27% | 0.268 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -59.2 | -45.4 | 175.4 | -177.3 | -97.4 | 0 | 0 | 0 | 112.5 | L87 G88 L89 F93 L94 L95 L210 T213 M214 | L87-F91 WeakPolarHBondContact O-CB 3.47Å; L87-F91 PolarHBondContact O-N 3.26Å; G88-F91 WeakPolarHBondContact O-CB 3.29Å; G88-F91 PolarHBondContact O-N 3.23Å; L89-F91 VanDerWaalsContact C-N 3.33Å; L89-F91 PolarHBondContact O-N 3.23Å; F91-F93 PolarHBondContact O-N 3.46Å; F91-L94 PolarHBondContact O-N 2.94Å; F91-L95 HydrophobicContact CD1-CD1 3.83Å; F91-L95 HydrophobicContact CD1-CG 4.28Å; F91-L95 HydrophobicContact CE1-CD1 3.26Å; F91-L95 HydrophobicContact CE1-CG 3.91Å; F91-L95 HydrophobicContact CZ-CD1 3.82Å; F91-L95 HydrophobicContact CZ-CD2 4.38Å; F91-L95 HydrophobicContact CZ-CG 4.13Å; F91-L95 PolarHBondContact O-N 3.12Å; F91-L210 HydrophobicContact CD2-CB 4.46Å; F91-L210 HydrophobicContact CD2-CD2 3.59Å; F91-L210 HydrophobicContact CE2-CB 4.04Å; F91-L210 HydrophobicContact CE2-CD2 3.56Å; F91-L210 HydrophobicContact CE2-CG 4.42Å; F91-L210 HydrophobicContact CG-CD2 4.26Å; F91-L210 HydrophobicContact CZ-CD2 4.22Å; F91-T213 HydrophobicContact CB-CG2 3.86Å; F91-T213 HydrophobicContact CD2-CG2 4.29Å; F91-M214 HydrophobicContact CE2-CB 4.39Å |
| 92 | S | 96.3 | Very high | 94.4 | Very high | 59 Ų | 59 | 57.6 Ų | 57.6 | 41% | 0.413 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -61.1 | -43 | 177.3 | -65.2 | 0 | 0 | 0 | 0 | 112.3 | G88 L89 F90 L95 I96 | G88-S92 PolarHBondContact O-N 3.46Å; G88-S92 PolarHBondContact O-OG 2.95Å; L89-S92 PolarHBondContact O-N 3.46Å; F90-S92 PolarHBondContact O-N 2.97Å; S92-L95 PolarHBondContact O-N 3.45Å; S92-I96 VanDerWaalsContact O-CG1 3.32Å; S92-I96 WeakPolarHBondContact O-CG1 3.36Å; S92-I96 PolarHBondContact O-N 3.34Å |
| 93 | F | 96.1 | Very high | 94.7 | Very high | 82 Ų | 82 | 57.3 Ų | 57.3 | 36% | 0.36 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -63.6 | -45.1 | 175.3 | -82.2 | -69.6 | 0 | 0 | 0 | 112 | V71 L74 L89 F90 F91 L95 I96 I97 | V71-F93 HydrophobicContact CG2-CB 3.92Å; V71-F93 HydrophobicContact CG2-CG 4.2Å; L74-F93 HydrophobicContact CD1-CD2 3.64Å; L74-F93 HydrophobicContact CD1-CE2 3.64Å; L89-F93 WeakPolarHBondContact O-CD2 3.37Å; L89-F93 PolarHBondContact O-N 3.12Å; F90-F93 PolarHBondContact O-N 2.74Å; F91-F93 PolarHBondContact O-N 3.46Å; F93-L95 VanDerWaalsContact C-N 3.29Å; F93-L95 PolarHBondContact O-N 3.41Å; F93-I96 PolarHBondContact O-N 2.89Å; F93-I97 VanDerWaalsContact O-CG1 3.25Å; F93-I97 WeakPolarHBondContact O-CG1 3.29Å; F93-I97 PolarHBondContact O-N 3.2Å |
| 94 | L | 95.2 | Very high | 94.8 | Very high | 16 Ų | 16 | 58.5 Ų | 58.5 | 8% | 0.084 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -59.3 | -40.3 | 176.4 | -73.1 | -174.6 | 0 | 0 | 0 | 112.2 | V71 F90 F91 I97 F98 L210 | V71-L94 HydrophobicContact CG1-CD2 4.25Å; F90-L94 HydrophobicContact CD1-CD1 4.16Å; F90-L94 HydrophobicContact CD2-CG 4.48Å; F90-L94 HydrophobicContact CE1-CD1 3.56Å; F90-L94 HydrophobicContact CE1-CG 4.32Å; F90-L94 HydrophobicContact CE2-CD1 4.15Å; F90-L94 HydrophobicContact CE2-CD2 4.27Å; F90-L94 HydrophobicContact CE2-CG 4.12Å; F90-L94 HydrophobicContact CZ-CD1 3.54Å; F90-L94 HydrophobicContact CZ-CD2 4.3Å; F90-L94 HydrophobicContact CZ-CG 4.02Å; F90-L94 WeakPolarHBondContact O-CG 3.27Å; F90-L94 PolarHBondContact O-N 2.84Å; F91-L94 PolarHBondContact O-N 2.94Å; L94-I97 PolarHBondContact O-N 3.34Å; L94-F98 VanDerWaalsContact O-CB 3.27Å; L94-F98 WeakPolarHBondContact O-CB 3.45Å; L94-F98 PolarHBondContact O-N 3.2Å; L94-L210 HydrophobicContact CB-CD2 3.52Å; L94-L210 HydrophobicContact CB-CG 4.12Å; L94-L210 HydrophobicContact CD1-CD2 4.31Å; L94-L210 HydrophobicContact CD1-CG 4.47Å |
| 95 | L | 96.4 | Very high | 95 | Very high | 76 Ų | 76 | 58.9 Ų | 58.9 | 40% | 0.398 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -63.8 | -43.9 | 175.7 | -79 | -178 | 0 | 0 | 0 | 112.5 | F91 S92 F93 F98 A99 L210 | F91-L95 HydrophobicContact CD1-CD1 3.83Å; F91-L95 HydrophobicContact CD1-CG 4.28Å; F91-L95 HydrophobicContact CE1-CD1 3.26Å; F91-L95 HydrophobicContact CE1-CG 3.91Å; F91-L95 HydrophobicContact CZ-CD1 3.82Å; F91-L95 HydrophobicContact CZ-CD2 4.38Å; F91-L95 HydrophobicContact CZ-CG 4.13Å; F91-L95 PolarHBondContact O-N 3.12Å; S92-L95 PolarHBondContact O-N 3.45Å; F93-L95 VanDerWaalsContact C-N 3.29Å; F93-L95 PolarHBondContact O-N 3.41Å; L95-F98 PolarHBondContact O-N 3.01Å; L95-A99 PolarHBondContact O-N 2.95Å; L95-L210 HydrophobicContact CD2-CD1 3.78Å; L95-L210 HydrophobicContact CD2-CD2 3.77Å; L95-L210 HydrophobicContact CD2-CG 4.44Å; L95-L210 HydrophobicContact CG-CD2 3.74Å |
| 96 | I | 96.9 | Very high | 95.1 | Very high | 103 Ų | 103 | 60 Ų | 60 | 53% | 0.528 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -63.8 | -46 | 178.5 | -68.2 | 166 | 0 | 0 | 0 | 110.1 | S92 F93 F98 A99 V100 | S92-I96 VanDerWaalsContact O-CG1 3.32Å; S92-I96 WeakPolarHBondContact O-CG1 3.36Å; S92-I96 PolarHBondContact O-N 3.34Å; F93-I96 PolarHBondContact O-N 2.89Å; I96-F98 VanDerWaalsContact C-N 3.34Å; I96-F98 PolarHBondContact O-N 3.04Å; I96-A99 PolarHBondContact O-N 3.46Å; I96-V100 HydrophobicContact CG2-CG2 4.48Å; I96-V100 WeakPolarHBondContact O-CG2 3.49Å; I96-V100 PolarHBondContact O-N 2.87Å |
| 97 | I | 95.8 | Very high | 95.2 | Very high | 47 Ų | 47 | 65 Ų | 65 | 24% | 0.241 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -61.4 | -44.6 | 178.8 | -66.4 | 167.7 | 0 | 0 | 0 | 110.3 | V67 V71 F93 L94 A99 V100 E101 M206 | V67-I97 HydrophobicContact CG1-CD1 4.06Å; V71-I97 HydrophobicContact CG2-CD1 4.05Å; F93-I97 VanDerWaalsContact O-CG1 3.25Å; F93-I97 WeakPolarHBondContact O-CG1 3.29Å; F93-I97 PolarHBondContact O-N 3.2Å; L94-I97 PolarHBondContact O-N 3.34Å; I97-A99 VanDerWaalsContact C-N 3.35Å; I97-A99 PolarHBondContact O-N 3.31Å; I97-V100 PolarHBondContact O-N 2.92Å; I97-E101 WeakPolarHBondContact O-CB 3.31Å; I97-E101 PolarHBondContact O-N 3.47Å; I97-M206 HydrophobicContact CB-SD 4.5Å; I97-M206 HydrophobicContact CG2-CE 3.4Å; I97-M206 VanDerWaalsContact CG2-CE 3.4Å; I97-M206 HydrophobicContact CG2-SD 3.81Å |
| 98 | F | 96.5 | Very high | 95.1 | Very high | 56 Ų | 56 | 65.9 Ų | 65.9 | 25% | 0.246 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -61.3 | -41.2 | 177.7 | -175.7 | -109.1 | 0 | 0 | 0 | 112.6 | L94 L95 I96 E101 I102 M206 V207 | L94-F98 VanDerWaalsContact O-CB 3.27Å; L94-F98 WeakPolarHBondContact O-CB 3.45Å; L94-F98 PolarHBondContact O-N 3.2Å; L95-F98 PolarHBondContact O-N 3.01Å; I96-F98 VanDerWaalsContact C-N 3.34Å; I96-F98 PolarHBondContact O-N 3.04Å; F98-E101 PolarHBondContact O-N 3.44Å; F98-I102 HydrophobicContact CD1-CD1 3.94Å; F98-I102 HydrophobicContact CE1-CD1 3.46Å; F98-I102 VanDerWaalsContact CE1-CD1 3.46Å; F98-I102 HydrophobicContact CE2-CD1 4.36Å; F98-I102 HydrophobicContact CZ-CD1 3.71Å; F98-I102 HydrophobicContact CZ-CG1 4.45Å; F98-I102 WeakPolarHBondContact O-CG1 3.32Å; F98-I102 PolarHBondContact O-N 2.89Å; F98-M206 HydrophobicContact CB-SD 4.33Å; F98-M206 HydrophobicContact CD2-CB 4.28Å; F98-M206 HydrophobicContact CD2-SD 4.46Å; F98-V207 HydrophobicContact CE2-CG2 3.93Å; F98-V207 HydrophobicContact CZ-CG2 3.99Å |
| 99 | A | 97 | Very high | 94.9 | Very high | 59 Ų | 59 | 70.9 Ų | 70.9 | 49% | 0.488 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -64.9 | -41.1 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | L95 I96 I97 I102 A103 | L95-A99 PolarHBondContact O-N 2.95Å; I96-A99 PolarHBondContact O-N 3.46Å; I97-A99 VanDerWaalsContact C-N 3.35Å; I97-A99 PolarHBondContact O-N 3.31Å; A99-I102 PolarHBondContact O-N 3.38Å; A99-A103 WeakPolarHBondContact O-CB 3.35Å; A99-A103 PolarHBondContact O-N 2.91Å |
| 100 | V | 96.3 | Very high | 94.8 | Very high | 91 Ų | 91 | 71 Ų | 71 | 55% | 0.552 | 40% | 0.395 | S | S | * | . | H | α-helix | trans | -64.4 | -40.4 | 174.9 | 171.2 | 0 | 0 | 0 | 0 | 111 | I96 I97 A103 A104 | I96-V100 HydrophobicContact CG2-CG2 4.48Å; I96-V100 WeakPolarHBondContact O-CG2 3.49Å; I96-V100 PolarHBondContact O-N 2.87Å; I97-V100 PolarHBondContact O-N 2.92Å; V100-A103 PolarHBondContact O-N 3.35Å; V100-A104 WeakPolarHBondContact O-CB 3.46Å; V100-A104 PolarHBondContact O-N 2.96Å |
| 101 | E | 94.3 | Very high | 94.7 | Very high | 45 Ų | 45 | 72.5 Ų | 72.5 | 21% | 0.21 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -62.6 | -44.4 | 178.1 | -173.6 | 176.6 | -174 | 0 | 0 | 111.7 | I97 F98 A104 G105 I202 M206 | I97-E101 WeakPolarHBondContact O-CB 3.31Å; I97-E101 PolarHBondContact O-N 3.47Å; F98-E101 PolarHBondContact O-N 3.44Å; E101-A104 PolarHBondContact O-N 3.35Å; E101-G105 PolarHBondContact O-N 2.96Å; E101-I202 WeakPolarHBondContact OE1-CB 3.43Å; E101-I202 VanDerWaalsContact OE1-CG2 3.22Å; E101-I202 WeakPolarHBondContact OE1-CG2 3.46Å; E101-M206 WeakPolarHBondContact OE2-CE 3.27Å |
| 102 | I | 95.8 | Very high | 94.4 | Very high | 100 Ų | 100 | 72.4 Ų | 72.4 | 51% | 0.513 | 40% | 0.404 | S | S | . | . | H | α-helix | trans | -62.8 | -45.8 | 174.8 | -67.4 | 170.7 | 0 | 0 | 0 | 110.7 | F98 A99 G105 F106 | F98-I102 HydrophobicContact CD1-CD1 3.94Å; F98-I102 HydrophobicContact CE1-CD1 3.46Å; F98-I102 VanDerWaalsContact CE1-CD1 3.46Å; F98-I102 HydrophobicContact CE2-CD1 4.36Å; F98-I102 HydrophobicContact CZ-CD1 3.71Å; F98-I102 HydrophobicContact CZ-CG1 4.45Å; F98-I102 WeakPolarHBondContact O-CG1 3.32Å; F98-I102 PolarHBondContact O-N 2.89Å; A99-I102 PolarHBondContact O-N 3.38Å; I102-G105 PolarHBondContact O-N 2.93Å; I102-F106 WeakPolarHBondContact O-CB 3.27Å; I102-F106 PolarHBondContact O-N 2.72Å |
| 103 | A | 96.4 | Very high | 94.1 | Very high | 59 Ų | 59 | 74.9 Ų | 74.9 | 49% | 0.488 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -63.9 | -44.2 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112 | A99 V100 F106 W107 | A99-A103 WeakPolarHBondContact O-CB 3.35Å; A99-A103 PolarHBondContact O-N 2.91Å; V100-A103 PolarHBondContact O-N 3.35Å; A103-F106 PolarHBondContact O-N 3.46Å; A103-W107 WeakPolarHBondContact O-CB 3.2Å; A103-W107 PolarHBondContact O-N 2.85Å |
| 104 | A | 93.3 | Very high | 93.8 | Very high | 55 Ų | 55 | 77 Ų | 77 | 46% | 0.455 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -66.6 | -41.4 | 177 | 0 | 0 | 0 | 0 | 0 | 111.6 | V100 E101 W107 G108 | V100-A104 WeakPolarHBondContact O-CB 3.46Å; V100-A104 PolarHBondContact O-N 2.96Å; E101-A104 PolarHBondContact O-N 3.35Å; A104-W107 PolarHBondContact O-N 3.25Å; A104-G108 PolarHBondContact O-N 3.05Å |
| 105 | G | 92.9 | Very high | 93.5 | Very high | 46 Ų | 46 | 77.7 Ų | 77.7 | 47% | 0.474 | 43% | 0.426 | S | S | . | . | H | α-helix | trans | -61 | -46.2 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112 | E101 I102 F109 | E101-G105 PolarHBondContact O-N 2.96Å; I102-G105 PolarHBondContact O-N 2.93Å; G105-F109 VanDerWaalsContact O-CB 3.29Å; G105-F109 WeakPolarHBondContact O-CB 3.25Å; G105-F109 PolarHBondContact O-N 3.41Å |
| 106 | F | 93.4 | Very high | 93.2 | Very high | 152 Ų | 152 | 74.7 Ų | 74.7 | 67% | 0.667 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -63.1 | -46.7 | 175.1 | 179.9 | -98.9 | 0 | 0 | 0 | 112.1 | I102 A103 F109 S110 | I102-F106 WeakPolarHBondContact O-CB 3.27Å; I102-F106 PolarHBondContact O-N 2.72Å; A103-F106 PolarHBondContact O-N 3.46Å; F106-F109 PolarHBondContact O-N 3.05Å; F106-S110 WeakPolarHBondContact O-CB 3.32Å; F106-S110 PolarHBondContact O-N 2.93Å |
| 107 | W | 94.6 | Very high | 92.8 | Very high | 147 Ų | 147 | 75 Ų | 75 | 56% | 0.557 | 41% | 0.414 | S | S | * | . | H | α-helix | trans | -63.7 | -43.8 | 179.7 | -177.9 | 81 | 0 | 0 | 0 | 112.3 | A103 A104 S110 N111 V115 | A103-W107 WeakPolarHBondContact O-CB 3.2Å; A103-W107 PolarHBondContact O-N 2.85Å; A104-W107 PolarHBondContact O-N 3.25Å; W107-S110 PolarHBondContact O-N 2.9Å; W107-N111 WeakPolarHBondContact O-CB 3.47Å; W107-N111 PolarHBondContact O-N 3.21Å; W107-N111 PolarHBondContact O-ND2 2.93Å; W107-V115 HydrophobicContact CZ3-CG2 4.36Å |
| 108 | G | 91.6 | Very high | 92.4 | Very high | 19 Ų | 19 | 78.4 Ų | 78.4 | 20% | 0.196 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -64.9 | -39.9 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | A104 S110 N111 Q112 | A104-G108 PolarHBondContact O-N 3.05Å; G108-S110 VanDerWaalsContact C-N 3.34Å; G108-N111 CarbonylContact O-C 3.58Å; G108-N111 PolarHBondContact O-N 3.2Å; G108-Q112 WeakPolarHBondContact O-CA 3.3Å; G108-Q112 PolarHBondContact O-N 2.94Å |
| 109 | F | 89.3 | Confident | 92 | Very high | 133 Ų | 133 | 78.6 Ų | 78.6 | 58% | 0.583 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -67.7 | -32.7 | 173.3 | -174.4 | -94.9 | 0 | 0 | 0 | 112.9 | G105 F106 Q112 L192 | G105-F109 VanDerWaalsContact O-CB 3.29Å; G105-F109 WeakPolarHBondContact O-CB 3.25Å; G105-F109 PolarHBondContact O-N 3.41Å; F106-F109 PolarHBondContact O-N 3.05Å; F109-Q112 WeakPolarHBondContact O-CG 3.33Å; F109-Q112 PolarHBondContact O-NE2 3.43Å; F109-Q112 VanDerWaalsContact O-NE2 3.14Å; F109-L192 HydrophobicContact CD2-CD2 4.26Å; F109-L192 HydrophobicContact CE2-CD2 4.31Å |
| 110 | S | 92.4 | Very high | 91.6 | Very high | 80 Ų | 80 | 76.6 Ų | 76.6 | 56% | 0.559 | 42% | 0.417 | S | S | * | . | H | α-helix | trans | -76.1 | -29.3 | 176.6 | -177.2 | 0 | 0 | 0 | 0 | 112.7 | F106 W107 G108 | F106-S110 WeakPolarHBondContact O-CB 3.32Å; F106-S110 PolarHBondContact O-N 2.93Å; W107-S110 PolarHBondContact O-N 2.9Å; G108-S110 VanDerWaalsContact C-N 3.34Å |
| 111 | N | 92.6 | Very high | 91.2 | Very high | 36 Ų | 36 | 73.4 Ų | 73.4 | 19% | 0.193 | 40% | 0.403 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -120 | 43.2 | -174.6 | -66.7 | -96.9 | 0 | 0 | 0 | 112.4 | W107 G108 N113 K114 V115 | W107-N111 WeakPolarHBondContact O-CB 3.47Å; W107-N111 PolarHBondContact O-N 3.21Å; W107-N111 PolarHBondContact O-ND2 2.93Å; G108-N111 CarbonylContact O-C 3.58Å; G108-N111 PolarHBondContact O-N 3.2Å; N111-N113 VanDerWaalsContact C-N 3.31Å; N111-N113 PolarHBondContact O-N 2.99Å; N111-K114 HydrophobicContact CB-CB 4.29Å; N111-K114 HydrophobicContact CB-CD 4.17Å; N111-K114 HydrophobicContact CB-CG 4.43Å; N111-K114 WeakPolarHBondContact O-CB 3.41Å; N111-K114 PolarHBondContact O-N 2.81Å; N111-K114 PolarHBondContact OD1-NZ 3.42Å; N111-V115 PolarHBondContact O-N 2.82Å; N111-V115 VanDerWaalsContact O-N 3.13Å |
| 112 | Q | 88.8 | Confident | 90.7 | Very high | 59 Ų | 59 | 74.7 Ų | 74.7 | 28% | 0.276 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -53.2 | -45 | -172.8 | -56.7 | 176.3 | -9.5 | 0 | 0 | 112.8 | G108 F109 K114 V115 L116 L192 | G108-Q112 WeakPolarHBondContact O-CA 3.3Å; G108-Q112 PolarHBondContact O-N 2.94Å; F109-Q112 WeakPolarHBondContact O-CG 3.33Å; F109-Q112 PolarHBondContact O-NE2 3.43Å; F109-Q112 VanDerWaalsContact O-NE2 3.14Å; Q112-K114 VanDerWaalsContact C-N 3.29Å; Q112-K114 PolarHBondContact O-N 3.49Å; Q112-V115 WeakPolarHBondContact O-CB 3.38Å; Q112-V115 PolarHBondContact O-N 3.3Å; Q112-V115 VanDerWaalsContact O-N 3.12Å; Q112-L116 WeakPolarHBondContact O-CB 3.42Å; Q112-L116 PolarHBondContact O-N 2.96Å; Q112-L192 HydrophobicContact CG-CD1 4.38Å |
| 113 | N | 89.8 | Confident | 90.4 | Very high | 112 Ų | 112 | 70.1 Ų | 70.1 | 60% | 0.599 | 38% | 0.384 | S | S | * | . | H | α-helix | trans | -59.8 | -39.3 | 178.7 | -61.9 | -13.2 | 0 | 0 | 0 | 112.2 | N111 L116 D117 | N111-N113 VanDerWaalsContact C-N 3.31Å; N111-N113 PolarHBondContact O-N 2.99Å; N113-L116 PolarHBondContact O-N 3.43Å; N113-D117 WeakPolarHBondContact O-CB 3.34Å; N113-D117 VanDerWaalsContact O-CG 3.28Å; N113-D117 PolarHBondContact O-N 3.46Å |
| 114 | K | 90.6 | Very high | 90 | Very high | 127 Ų | 127 | 74.4 Ų | 74.4 | 55% | 0.552 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -69.7 | -35.6 | 177.6 | -63 | -177 | -174.9 | 158.3 | 0 | 111.9 | N111 Q112 L118 | N111-K114 HydrophobicContact CB-CB 4.29Å; N111-K114 HydrophobicContact CB-CD 4.17Å; N111-K114 HydrophobicContact CB-CG 4.43Å; N111-K114 WeakPolarHBondContact O-CB 3.41Å; N111-K114 PolarHBondContact O-N 2.81Å; N111-K114 PolarHBondContact OD1-NZ 3.42Å; Q112-K114 VanDerWaalsContact C-N 3.29Å; Q112-K114 PolarHBondContact O-N 3.49Å; K114-L118 WeakPolarHBondContact O-CB 3.15Å; K114-L118 PolarHBondContact O-N 3.44Å |
| 115 | V | 88.9 | Confident | 89.4 | Confident | 29 Ų | 29 | 73.8 Ų | 73.8 | 18% | 0.176 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -66.1 | -43.8 | 175.5 | 175.9 | 0 | 0 | 0 | 0 | 110.1 | W107 N111 Q112 L118 I119 F188 | W107-V115 HydrophobicContact CZ3-CG2 4.36Å; N111-V115 PolarHBondContact O-N 2.82Å; N111-V115 VanDerWaalsContact O-N 3.13Å; Q112-V115 WeakPolarHBondContact O-CB 3.38Å; Q112-V115 PolarHBondContact O-N 3.3Å; Q112-V115 VanDerWaalsContact O-N 3.12Å; V115-L118 WeakPolarHBondContact O-CB 3.21Å; V115-L118 PolarHBondContact O-N 2.79Å; V115-I119 HydrophobicContact CG1-CD1 3.83Å; V115-I119 WeakPolarHBondContact O-CG1 3.44Å; V115-I119 PolarHBondContact O-N 3.21Å; V115-F188 HydrophobicContact CG1-CE1 3.91Å; V115-F188 HydrophobicContact CG1-CZ 4.33Å |
| 116 | L | 89.4 | Confident | 88.9 | Confident | 14 Ų | 14 | 71.8 Ų | 71.8 | 7% | 0.073 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -61.3 | -49.7 | 176 | 177.2 | 161.8 | 0 | 0 | 0 | 111.1 | Q112 N113 L118 I119 S120 D185 F188 | Q112-L116 WeakPolarHBondContact O-CB 3.42Å; Q112-L116 PolarHBondContact O-N 2.96Å; N113-L116 PolarHBondContact O-N 3.43Å; L116-L118 VanDerWaalsContact C-N 3.26Å; L116-L118 PolarHBondContact O-N 3.28Å; L116-I119 PolarHBondContact O-N 3Å; L116-I119 VanDerWaalsContact O-N 3.16Å; L116-S120 WeakPolarHBondContact O-CB 3.33Å; L116-S120 PolarHBondContact O-N 3.39Å; L116-S120 PolarHBondContact O-OG 3.4Å; L116-D185 HydrophobicContact CD1-CB 4.01Å; L116-D185 WeakPolarHBondContact CD2-OD1 3.41Å; L116-D185 HydrophobicContact CG-CB 4.49Å; L116-D185 WeakPolarHBondContact CG-OD1 3.4Å; L116-F188 HydrophobicContact CD1-CB 3.95Å |
| 117 | D | 89.5 | Confident | 88.5 | Confident | 110 Ų | 110 | 65.6 Ų | 65.6 | 59% | 0.588 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -58.1 | -38.3 | 176.4 | -74.2 | -25.3 | 0 | 0 | 0 | 112.2 | N113 G121 | N113-D117 WeakPolarHBondContact O-CB 3.34Å; N113-D117 VanDerWaalsContact O-CG 3.28Å; N113-D117 PolarHBondContact O-N 3.46Å; D117-G121 WeakPolarHBondContact O-CA 3.42Å; D117-G121 PolarHBondContact O-N 3.18Å |
| 118 | L | 87.1 | Confident | 88 | Confident | 118 Ų | 118 | 62.5 Ų | 62.5 | 62% | 0.618 | 32% | 0.318 | S | S | * | . | H | α-helix | trans | -65.6 | -44.1 | 177.8 | -174.9 | 70.7 | 0 | 0 | 0 | 111.7 | K114 V115 L116 F122 | K114-L118 WeakPolarHBondContact O-CB 3.15Å; K114-L118 PolarHBondContact O-N 3.44Å; V115-L118 WeakPolarHBondContact O-CB 3.21Å; V115-L118 PolarHBondContact O-N 2.79Å; L116-L118 VanDerWaalsContact C-N 3.26Å; L116-L118 PolarHBondContact O-N 3.28Å; L118-F122 WeakPolarHBondContact O-CB 3.43Å; L118-F122 PolarHBondContact O-N 3.38Å |
| 119 | I | 88.3 | Confident | 87.3 | Confident | 59 Ų | 59 | 62.1 Ų | 62.1 | 30% | 0.303 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -73.1 | -46.5 | -178.3 | -65.4 | 167.7 | 0 | 0 | 0 | 110.8 | V115 L116 G121 F122 Y123 I184 F188 | V115-I119 HydrophobicContact CG1-CD1 3.83Å; V115-I119 WeakPolarHBondContact O-CG1 3.44Å; V115-I119 PolarHBondContact O-N 3.21Å; L116-I119 PolarHBondContact O-N 3Å; L116-I119 VanDerWaalsContact O-N 3.16Å; I119-G121 VanDerWaalsContact C-N 3.27Å; I119-G121 PolarHBondContact O-N 2.8Å; I119-F122 WeakPolarHBondContact O-CB 3.29Å; I119-F122 PolarHBondContact O-N 2.93Å; I119-F122 VanDerWaalsContact O-N 3.15Å; I119-Y123 PolarHBondContact O-N 3.43Å; I119-I184 HydrophobicContact CB-CG2 4.3Å; I119-I184 HydrophobicContact CG2-CD1 4.36Å; I119-I184 HydrophobicContact CG2-CG2 3.75Å; I119-F188 HydrophobicContact CD1-CE1 4.08Å; I119-F188 HydrophobicContact CD1-CE2 3.43Å; I119-F188 VanDerWaalsContact CD1-CE2 3.43Å; I119-F188 HydrophobicContact CD1-CZ 3.16Å |
| 120 | S | 89 | Confident | 86.9 | Confident | 17 Ų | 17 | 56.4 Ų | 56.4 | 12% | 0.119 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -62.6 | -37.3 | 175.8 | -67.6 | 0 | 0 | 0 | 0 | 110.9 | L116 Y123 R124 I184 D185 | L116-S120 WeakPolarHBondContact O-CB 3.33Å; L116-S120 PolarHBondContact O-N 3.39Å; L116-S120 PolarHBondContact O-OG 3.4Å; S120-Y123 PolarHBondContact O-N 3.03Å; S120-R124 PolarHBondContact O-N 3.24Å; S120-I184 WeakPolarHBondContact OG-CG2 3.33Å; S120-D185 PolarHBondContact OG-OD1 2.75Å; S120-D185 VanDerWaalsContact OG-OD1 3.1Å |
| 121 | G | 87.1 | Confident | 86.4 | Confident | 25 Ų | 25 | 54.8 Ų | 54.8 | 26% | 0.258 | 28% | 0.275 | S | S | . | . | H | α-helix | trans | -62.8 | -44 | 171 | 0 | 0 | 0 | 0 | 0 | 113.2 | D117 I119 Y123 R124 Q125 | D117-G121 WeakPolarHBondContact O-CA 3.42Å; D117-G121 PolarHBondContact O-N 3.18Å; I119-G121 VanDerWaalsContact C-N 3.27Å; I119-G121 PolarHBondContact O-N 2.8Å; G121-Y123 PolarHBondContact O-N 3.49Å; G121-R124 PolarHBondContact O-N 2.9Å; G121-Q125 WeakPolarHBondContact O-CB 3.08Å; G121-Q125 PolarHBondContact O-N 3.35Å |
| 122 | F | 84.6 | Confident | 85.9 | Confident | 71 Ų | 71 | 60.7 Ų | 60.7 | 31% | 0.311 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -58.1 | -46 | 175 | 177.3 | -84.1 | 0 | 0 | 0 | 112 | V53 L118 I119 Q125 T126 | V53-F122 HydrophobicContact CG1-CB 3.68Å; V53-F122 HydrophobicContact CG1-CD2 3.4Å; V53-F122 VanDerWaalsContact CG1-CD2 3.4Å; V53-F122 HydrophobicContact CG1-CE2 4.37Å; V53-F122 HydrophobicContact CG1-CG 3.95Å; L118-F122 WeakPolarHBondContact O-CB 3.43Å; L118-F122 PolarHBondContact O-N 3.38Å; I119-F122 WeakPolarHBondContact O-CB 3.29Å; I119-F122 PolarHBondContact O-N 2.93Å; I119-F122 VanDerWaalsContact O-N 3.15Å; F122-Q125 PolarHBondContact O-N 2.91Å; F122-T126 WeakPolarHBondContact O-CB 3.4Å; F122-T126 PolarHBondContact O-N 3.49Å; F122-T126 PolarHBondContact O-OG1 2.92Å |
| 123 | Y | 88.4 | Confident | 85.3 | Confident | 4 Ų | 4 | 59.9 Ų | 59.9 | 2% | 0.016 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -61.3 | -49.7 | 177.2 | -178.2 | -95.2 | 0 | 0 | 0 | 111.8 | I119 S120 G121 Q125 T126 Y127 L142 I145 Q146 G153 L154 C180 P181 I184 | I119-Y123 PolarHBondContact O-N 3.43Å; S120-Y123 PolarHBondContact O-N 3.03Å; G121-Y123 PolarHBondContact O-N 3.49Å; Y123-Q125 VanDerWaalsContact C-N 3.29Å; Y123-Q125 PolarHBondContact O-N 3.14Å; Y123-T126 PolarHBondContact O-N 2.92Å; Y123-Y127 PolarHBondContact O-N 3.11Å; Y123-L142 HydrophobicContact CD2-CD2 4.42Å; Y123-L142 HydrophobicContact CE2-CD2 3.88Å; Y123-I145 HydrophobicContact CD2-CG2 3.87Å; Y123-I145 HydrophobicContact CE2-CB 4.47Å; Y123-I145 HydrophobicContact CE2-CG2 3.82Å; Y123-Q146 WeakPolarHBondContact OH-CG 3.49Å; Y123-G153 VanDerWaalsContact OH-CA 3.22Å; Y123-G153 WeakPolarHBondContact OH-CA 3.47Å; Y123-G153 PolarHBondContact OH-N 2.97Å; Y123-L154 HydrophobicContact CD1-CD2 3.79Å; Y123-L154 HydrophobicContact CE1-CD2 3.68Å; Y123-C180 HydrophobicContact CD1-CB 3.9Å; Y123-C180 HydrophobicContact CD2-CB 4.3Å; Y123-C180 HydrophobicContact CE1-CB 3.41Å; Y123-C180 VanDerWaalsContact CE1-CB 3.41Å; Y123-C180 HydrophobicContact CE2-CB 3.85Å; Y123-C180 HydrophobicContact CG-CB 4.32Å; Y123-C180 VanDerWaalsContact CZ-SG 3.53Å; Y123-C180 PolarHBondContact OH-SG 2.88Å; Y123-P181 HydrophobicContact CD1-CG 4.23Å; Y123-I184 HydrophobicContact CG-CD1 4.29Å |
| 124 | R | 87.8 | Confident | 84.8 | Confident | 149 Ų | 149 | 60.6 Ų | 60.6 | 56% | 0.562 | 29% | 0.292 | S | S | * | . | H | α-helix | trans | -57.6 | -44.7 | -179.1 | -172.3 | 174.5 | 77.6 | -162 | 0.7 | 112 | S120 G121 Y127 E128 L154 | S120-R124 PolarHBondContact O-N 3.24Å; G121-R124 PolarHBondContact O-N 2.9Å; R124-Y127 PolarHBondContact O-N 3.46Å; R124-E128 IonicContact NE-OE1 3.34Å; R124-E128 WeakPolarHBondContact O-CG 3.42Å; R124-E128 PolarHBondContact O-N 3.49Å; R124-L154 HydrophobicContact CB-CD2 4.08Å; R124-L154 HydrophobicContact CG-CD1 4.07Å; R124-L154 HydrophobicContact CG-CD2 3.98Å |
| 125 | Q | 82.1 | Confident | 84.2 | Confident | 43 Ų | 43 | 55.5 Ų | 55.5 | 20% | 0.201 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -66.6 | -44.2 | -179.4 | -168.9 | 151.3 | -2.4 | 0 | 0 | 112.2 | P51 Y52 V53 G121 F122 Y123 Y127 E128 D129 | P51-Q125 HydrophobicContact CB-CG 3.7Å; Y52-Q125 VanDerWaalsContact N-NE2 3.19Å; V53-Q125 HydrophobicContact CB-CB 4.4Å; V53-Q125 VanDerWaalsContact CB-CD 3.45Å; V53-Q125 HydrophobicContact CB-CG 4.23Å; G121-Q125 WeakPolarHBondContact O-CB 3.08Å; G121-Q125 PolarHBondContact O-N 3.35Å; F122-Q125 PolarHBondContact O-N 2.91Å; Y123-Q125 VanDerWaalsContact C-N 3.29Å; Y123-Q125 PolarHBondContact O-N 3.14Å; Q125-Y127 VanDerWaalsContact C-N 3.28Å; Q125-Y127 PolarHBondContact O-N 2.94Å; Q125-E128 PolarHBondContact O-N 3.44Å; Q125-D129 WeakPolarHBondContact O-CB 3.31Å; Q125-D129 PolarHBondContact O-N 2.99Å |
| 126 | T | 81.3 | Confident | 83.6 | Confident | 4 Ų | 4 | 60 Ų | 60 | 3% | 0.025 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -58.8 | -41.4 | 175.6 | -54.7 | 0 | 0 | 0 | 0 | 111.4 | F122 Y123 Y130 L138 L142 | F122-T126 WeakPolarHBondContact O-CB 3.4Å; F122-T126 PolarHBondContact O-N 3.49Å; F122-T126 PolarHBondContact O-OG1 2.92Å; Y123-T126 PolarHBondContact O-N 2.92Å; T126-Y130 WeakPolarHBondContact O-CB 3.17Å; T126-Y130 PolarHBondContact O-N 3.24Å; T126-L138 HydrophobicContact CG2-CD2 4.21Å; T126-L142 HydrophobicContact CG2-CD2 3.93Å; T126-L142 HydrophobicContact CG2-CG 4.04Å |
| 127 | Y | 85.3 | Confident | 82.9 | Confident | 22 Ų | 22 | 60.7 Ų | 60.7 | 9% | 0.086 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -65.4 | -46.3 | 176.5 | -175 | -80.4 | 0 | 0 | 0 | 112.3 | Y123 R124 Q125 D129 Y130 S131 L154 E160 | Y123-Y127 PolarHBondContact O-N 3.11Å; R124-Y127 PolarHBondContact O-N 3.46Å; Q125-Y127 VanDerWaalsContact C-N 3.28Å; Q125-Y127 PolarHBondContact O-N 2.94Å; Y127-D129 VanDerWaalsContact C-N 3.35Å; Y127-D129 PolarHBondContact O-N 3.27Å; Y127-Y130 PolarHBondContact O-N 2.88Å; Y127-S131 PolarHBondContact O-N 3.45Å; Y127-L154 HydrophobicContact CD1-CD1 3.52Å; Y127-L154 HydrophobicContact CD1-CG 3.75Å; Y127-L154 HydrophobicContact CD2-CG 4.4Å; Y127-L154 HydrophobicContact CE1-CD1 4.01Å; Y127-L154 HydrophobicContact CE1-CG 4.16Å; Y127-L154 HydrophobicContact CG-CD1 4.09Å; Y127-L154 HydrophobicContact CG-CD2 4.28Å; Y127-L154 HydrophobicContact CG-CG 3.9Å; Y127-E160 VanDerWaalsContact CE2-OE2 3.29Å; Y127-E160 WeakPolarHBondContact CE2-OE2 3.43Å; Y127-E160 VanDerWaalsContact CZ-OE2 3.26Å; Y127-E160 PolarHBondContact OH-OE2 3.34Å |
| 128 | E | 84 | Confident | 82.3 | Confident | 82 Ų | 82 | 56.4 Ų | 56.4 | 38% | 0.383 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -62.3 | -41.6 | 177.8 | -75.5 | 179.6 | -161.1 | 0 | 0 | 112.2 | R124 Q125 S131 K132 | R124-E128 IonicContact NE-OE1 3.34Å; R124-E128 WeakPolarHBondContact O-CG 3.42Å; R124-E128 PolarHBondContact O-N 3.49Å; Q125-E128 PolarHBondContact O-N 3.44Å; E128-S131 PolarHBondContact O-N 3.47Å; E128-K132 WeakPolarHBondContact O-CG 3.46Å; E128-K132 PolarHBondContact O-N 2.91Å; E128-K132 VanDerWaalsContact O-N 3.13Å |
| 129 | D | 77.6 | Confident | 82.2 | Confident | 10 Ų | 10 | 53.6 Ų | 53.6 | 5% | 0.053 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -65.4 | -43.9 | 178.3 | -67.7 | -25.5 | 0 | 0 | 0 | 110.9 | P51 L54 Q125 Y127 S131 K132 T133 L138 | P51-D129 WeakPolarHBondContact CB-OD2 3.42Å; P51-D129 VanDerWaalsContact CG-CG 3.48Å; P51-D129 WeakPolarHBondContact CG-OD1 3.33Å; P51-D129 WeakPolarHBondContact CG-OD2 3.26Å; L54-D129 HydrophobicContact CD1-CB 4.12Å; L54-D129 WeakPolarHBondContact CD1-OD2 3.43Å; Q125-D129 WeakPolarHBondContact O-CB 3.31Å; Q125-D129 PolarHBondContact O-N 2.99Å; Y127-D129 VanDerWaalsContact C-N 3.35Å; Y127-D129 PolarHBondContact O-N 3.27Å; D129-S131 VanDerWaalsContact C-N 3.32Å; D129-S131 PolarHBondContact O-N 2.89Å; D129-K132 PolarHBondContact O-N 2.02Å; D129-T133 VanDerWaalsContact O-CB 3.29Å; D129-T133 WeakPolarHBondContact O-CB 3.47Å; D129-T133 WeakPolarHBondContact O-CG2 3.26Å; D129-T133 PolarHBondContact O-N 2.99Å; D129-T133 PolarHBondContact O-OG1 3.02Å; D129-L138 HydrophobicContact CB-CD1 4.06Å |
| 130 | Y | 80.2 | Confident | 81.9 | Confident | 13 Ų | 13 | 55.5 Ų | 55.5 | 5% | 0.051 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -58.1 | -44.4 | 172.2 | 173.2 | -110.4 | 0 | 0 | 0 | 111.9 | T126 Y127 K132 T133 R134 D135 L138 K139 L142 Y162 L165 | T126-Y130 WeakPolarHBondContact O-CB 3.17Å; T126-Y130 PolarHBondContact O-N 3.24Å; Y127-Y130 PolarHBondContact O-N 2.88Å; Y130-K132 PolarHBondContact O-N 3.47Å; Y130-T133 PolarHBondContact O-N 2.99Å; Y130-R134 WeakPolarHBondContact O-CA 3.49Å; Y130-R134 PolarHBondContact O-N 2.98Å; Y130-D135 WeakPolarHBondContact CD2-O 3.43Å; Y130-D135 WeakPolarHBondContact CE2-O 3.23Å; Y130-L138 HydrophobicContact CD2-CB 4.13Å; Y130-K139 HydrophobicContact CD2-CB 4.1Å; Y130-K139 HydrophobicContact CE2-CB 3.5Å; Y130-K139 VanDerWaalsContact CE2-CB 3.5Å; Y130-K139 HydrophobicContact CE2-CD 4.42Å; Y130-K139 HydrophobicContact CE2-CG 3.94Å; Y130-L142 VanDerWaalsContact CB-CD1 3.44Å; Y130-L142 HydrophobicContact CD1-CD1 3.77Å; Y130-L142 HydrophobicContact CG-CD1 3.66Å; Y130-Y162 HydrophobicContact CD1-CD2 4.43Å; Y130-Y162 HydrophobicContact CE1-CD2 4.03Å; Y130-Y162 HydrophobicContact CE1-CE2 4.4Å; Y130-Y162 HydrophobicContact CE1-CG 4.36Å; Y130-L165 HydrophobicContact CD1-CD2 4.33Å; Y130-L165 HydrophobicContact CE1-CD1 3.69Å; Y130-L165 HydrophobicContact CE1-CD2 4Å |
| 131 | S | 83.1 | Confident | 81.6 | Confident | 47 Ų | 47 | 57.4 Ų | 57.4 | 33% | 0.329 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -61.9 | -31.3 | -179.9 | -172.5 | 0 | 0 | 0 | 0 | 112.9 | Y127 E128 D129 Y162 | Y127-S131 PolarHBondContact O-N 3.45Å; E128-S131 PolarHBondContact O-N 3.47Å; D129-S131 VanDerWaalsContact C-N 3.32Å; D129-S131 PolarHBondContact O-N 2.89Å; S131-Y162 PolarHBondContact OG-OH 3.04Å; S131-Y162 VanDerWaalsContact OG-OH 3.09Å |
| 132 | K | 81.6 | Confident | 81.6 | Confident | 160 Ų | 160 | 56.2 Ų | 56.2 | 70% | 0.696 | 27% | 0.267 | S | S | * | . | H | α-helix | trans | -81.7 | -38.1 | 177.5 | -68.6 | 171.4 | -170.5 | 164.3 | 0 | 112.6 | E128 D129 Y130 | E128-K132 WeakPolarHBondContact O-CG 3.46Å; E128-K132 PolarHBondContact O-N 2.91Å; E128-K132 VanDerWaalsContact O-N 3.13Å; D129-K132 PolarHBondContact O-N 2.02Å; Y130-K132 PolarHBondContact O-N 3.47Å |
| 133 | T | 75.5 | Confident | 81.8 | Confident | 42 Ų | 42 | 59.4 Ų | 59.4 | 26% | 0.258 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -103.6 | -25.4 | -163.1 | 62.5 | 0 | 0 | 0 | 0 | 113.2 | L44 D129 Y130 D135 | L44-T133 HydrophobicContact CD1-CG2 3.25Å; L44-T133 HydrophobicContact CD2-CG2 3.59Å; L44-T133 HydrophobicContact CG-CG2 4.02Å; D129-T133 VanDerWaalsContact O-CB 3.29Å; D129-T133 WeakPolarHBondContact O-CB 3.47Å; D129-T133 WeakPolarHBondContact O-CG2 3.26Å; D129-T133 PolarHBondContact O-N 2.99Å; D129-T133 PolarHBondContact O-OG1 3.02Å; Y130-T133 PolarHBondContact O-N 2.99Å; T133-D135 PolarHBondContact O-N 2.92Å; T133-D135 PolarHBondContact OG1-N 3.42Å |
| 134 | R | 79.9 | Confident | 81.7 | Confident | 126 Ų | 126 | 63.7 Ų | 63.7 | 48% | 0.475 | 30% | 0.3 | S | S | . | . | trans | 54 | 34.2 | -173.4 | -55.2 | -58 | -164.9 | 138.4 | 9.5 | 112.9 | Y130 Y162 | Y130-R134 WeakPolarHBondContact O-CA 3.49Å; Y130-R134 PolarHBondContact O-N 2.98Å; R134-Y162 VanDerWaalsContact CZ-OH 3.22Å; R134-Y162 VanDerWaalsContact NH1-CD1 3.31Å; R134-Y162 VanDerWaalsContact NH1-CZ 3.3Å; R134-Y162 PolarHBondContact NH2-OH 3.44Å | ||
| 135 | D | 77 | Confident | 81.8 | Confident | 20 Ų | 20 | 58.5 Ų | 58.5 | 11% | 0.107 | 28% | 0.283 | C | S | . | . | trans | -69 | 132.8 | 178.3 | -175.3 | -103.8 | 0 | 0 | 0 | 111.7 | Y130 T133 G137 L138 K139 | Y130-D135 WeakPolarHBondContact CD2-O 3.43Å; Y130-D135 WeakPolarHBondContact CE2-O 3.23Å; T133-D135 PolarHBondContact O-N 2.92Å; T133-D135 PolarHBondContact OG1-N 3.42Å; D135-G137 VanDerWaalsContact OD1-CA 3.24Å; D135-G137 WeakPolarHBondContact OD1-CA 3.31Å; D135-G137 PolarHBondContact OD1-N 3.49Å; D135-L138 HydrophobicContact CB-CB 4.21Å; D135-L138 HydrophobicContact CB-CD1 4.04Å; D135-L138 HydrophobicContact CB-CG 4Å; D135-L138 PolarHBondContact O-N 3.4Å; D135-L138 PolarHBondContact OD1-N 2.95Å; D135-K139 WeakPolarHBondContact O-CB 3.19Å; D135-K139 PolarHBondContact O-N 3.4Å | ||
| 136 | E | 77.7 | Confident | 82.3 | Confident | 123 Ų | 123 | 56.5 Ų | 56.5 | 58% | 0.575 | 27% | 0.273 | S | S | * | . | H | α-helix | trans | -73.1 | -27.6 | -178.9 | -71.6 | -67 | 145.3 | 0 | 0 | 112 | K139 E140 | E136-K139 WeakPolarHBondContact O-CB 3.26Å; E136-K139 PolarHBondContact O-N 3.49Å; E136-K139 IonicContact OE1-NZ 2.68Å; E136-K139 PolarHBondContact OE1-NZ 3.03Å; E136-K139 VanDerWaalsContact OE2-CD 3.23Å; E136-K139 WeakPolarHBondContact OE2-CD 3.05Å; E136-K139 IonicContact OE2-NZ 2.72Å; E136-K139 PolarHBondContact OE2-NZ 3.23Å; E136-K139 VanDerWaalsContact OE2-NZ 3.17Å; E136-E140 PolarHBondContact O-N 2.94Å |
| 137 | G | 74.3 | Confident | 82.7 | Confident | 30 Ų | 30 | 60.3 Ų | 60.3 | 31% | 0.309 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -68.6 | -41.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | D135 E140 T141 | D135-G137 VanDerWaalsContact OD1-CA 3.24Å; D135-G137 WeakPolarHBondContact OD1-CA 3.31Å; D135-G137 PolarHBondContact OD1-N 3.49Å; G137-E140 PolarHBondContact O-N 2.03Å; G137-T141 PolarHBondContact O-N 2.9Å; G137-T141 PolarHBondContact O-OG1 2.93Å |
| 138 | L | 77.4 | Confident | 82.8 | Confident | 19 Ų | 19 | 66.7 Ų | 66.7 | 10% | 0.099 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -66.9 | -38.2 | 172.7 | -62.3 | -179.2 | 0 | 0 | 0 | 112 | L54 T126 D129 Y130 D135 E140 T141 L142 | L54-L138 HydrophobicContact CD1-CD1 3.99Å; L54-L138 HydrophobicContact CD1-CD2 3.71Å; L54-L138 HydrophobicContact CD1-CG 4.49Å; T126-L138 HydrophobicContact CG2-CD2 4.21Å; D129-L138 HydrophobicContact CB-CD1 4.06Å; Y130-L138 HydrophobicContact CD2-CB 4.13Å; D135-L138 HydrophobicContact CB-CB 4.21Å; D135-L138 HydrophobicContact CB-CD1 4.04Å; D135-L138 HydrophobicContact CB-CG 4Å; D135-L138 PolarHBondContact O-N 3.4Å; D135-L138 PolarHBondContact OD1-N 2.95Å; L138-E140 PolarHBondContact O-N 3.24Å; L138-T141 PolarHBondContact O-N 3.3Å; L138-L142 WeakPolarHBondContact O-CB 3.35Å; L138-L142 VanDerWaalsContact O-CG 3.3Å; L138-L142 WeakPolarHBondContact O-CG 3.37Å; L138-L142 PolarHBondContact O-N 3.34Å |
| 139 | K | 83.5 | Confident | 83 | Confident | 60 Ų | 60 | 65.6 Ų | 65.6 | 26% | 0.261 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -57.5 | -48.9 | 174.5 | -169.8 | -173.5 | 178.9 | -176.8 | 0 | 111.7 | Y130 D135 E136 L142 R143 L165 | Y130-K139 HydrophobicContact CD2-CB 4.1Å; Y130-K139 HydrophobicContact CE2-CB 3.5Å; Y130-K139 VanDerWaalsContact CE2-CB 3.5Å; Y130-K139 HydrophobicContact CE2-CD 4.42Å; Y130-K139 HydrophobicContact CE2-CG 3.94Å; D135-K139 WeakPolarHBondContact O-CB 3.19Å; D135-K139 PolarHBondContact O-N 3.4Å; E136-K139 WeakPolarHBondContact O-CB 3.26Å; E136-K139 PolarHBondContact O-N 3.49Å; E136-K139 IonicContact OE1-NZ 2.68Å; E136-K139 PolarHBondContact OE1-NZ 3.03Å; E136-K139 VanDerWaalsContact OE2-CD 3.23Å; E136-K139 WeakPolarHBondContact OE2-CD 3.05Å; E136-K139 IonicContact OE2-NZ 2.72Å; E136-K139 PolarHBondContact OE2-NZ 3.23Å; E136-K139 VanDerWaalsContact OE2-NZ 3.17Å; K139-L142 PolarHBondContact O-N 3.47Å; K139-R143 VanDerWaalsContact O-CB 3.31Å; K139-R143 WeakPolarHBondContact O-CB 3.37Å; K139-R143 PolarHBondContact O-N 2.87Å; K139-L165 HydrophobicContact CG-CD2 4.14Å; K139-L165 HydrophobicContact CG-CG 4.26Å |
| 140 | E | 82.7 | Confident | 83.6 | Confident | 99 Ų | 99 | 70.2 Ų | 70.2 | 46% | 0.463 | 34% | 0.338 | S | S | . | . | H | α-helix | trans | -67.2 | -40 | -178.9 | -167.6 | 63.7 | -173.4 | 0 | 0 | 111.2 | E136 G137 L138 L142 R143 L144 | E136-E140 PolarHBondContact O-N 2.94Å; G137-E140 PolarHBondContact O-N 2.03Å; L138-E140 PolarHBondContact O-N 3.24Å; E140-L142 PolarHBondContact O-N 2.95Å; E140-R143 PolarHBondContact O-N 2.97Å; E140-L144 WeakPolarHBondContact O-CG 3.01Å; E140-L144 PolarHBondContact O-N 3.34Å |
| 141 | T | 82.3 | Confident | 84.1 | Confident | 57 Ų | 57 | 69.6 Ų | 69.6 | 35% | 0.35 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -60.3 | -47.9 | 174.7 | -55.6 | 0 | 0 | 0 | 0 | 111.6 | G137 L138 R143 L144 I145 | G137-T141 PolarHBondContact O-N 2.9Å; G137-T141 PolarHBondContact O-OG1 2.93Å; L138-T141 PolarHBondContact O-N 3.3Å; T141-R143 VanDerWaalsContact C-N 3.32Å; T141-R143 PolarHBondContact O-N 2.6Å; T141-L144 PolarHBondContact O-N 3.27Å; T141-I145 HydrophobicContact CG2-CD1 3.94Å; T141-I145 VanDerWaalsContact O-CG1 3.31Å; T141-I145 WeakPolarHBondContact O-CG1 3.48Å; T141-I145 PolarHBondContact O-N 3.4Å |
| 142 | L | 87.1 | Confident | 84.5 | Confident | 0 Ų | 0 | 67.4 Ų | 67.4 | 0% | 0 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -63.9 | -37.4 | 177.4 | -76 | 170.4 | 0 | 0 | 0 | 112.1 | Y123 T126 Y130 L138 K139 E140 Q146 L165 | Y123-L142 HydrophobicContact CD2-CD2 4.42Å; Y123-L142 HydrophobicContact CE2-CD2 3.88Å; T126-L142 HydrophobicContact CG2-CD2 3.93Å; T126-L142 HydrophobicContact CG2-CG 4.04Å; Y130-L142 VanDerWaalsContact CB-CD1 3.44Å; Y130-L142 HydrophobicContact CD1-CD1 3.77Å; Y130-L142 HydrophobicContact CG-CD1 3.66Å; L138-L142 WeakPolarHBondContact O-CB 3.35Å; L138-L142 VanDerWaalsContact O-CG 3.3Å; L138-L142 WeakPolarHBondContact O-CG 3.37Å; L138-L142 PolarHBondContact O-N 3.34Å; K139-L142 PolarHBondContact O-N 3.47Å; E140-L142 PolarHBondContact O-N 2.95Å; L142-Q146 VanDerWaalsContact O-CB 3.26Å; L142-Q146 WeakPolarHBondContact O-CB 3.32Å; L142-Q146 VanDerWaalsContact O-CG 3.23Å; L142-Q146 WeakPolarHBondContact O-CG 3.39Å; L142-Q146 PolarHBondContact O-N 3.4Å; L142-Q146 PolarHBondContact O-NE2 3.29Å; L142-L165 HydrophobicContact CB-CD2 3.54Å; L142-L165 HydrophobicContact CD1-CD2 4.07Å; L142-L165 HydrophobicContact CG-CD2 4.48Å |
| 143 | R | 88.4 | Confident | 84.9 | Confident | 137 Ų | 137 | 59.8 Ų | 59.8 | 52% | 0.517 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -65 | -45.6 | 176.3 | -173.8 | -178.4 | -177.8 | 158.9 | 5 | 111.2 | K139 E140 T141 Q146 N147 | K139-R143 VanDerWaalsContact O-CB 3.31Å; K139-R143 WeakPolarHBondContact O-CB 3.37Å; K139-R143 PolarHBondContact O-N 2.87Å; E140-R143 PolarHBondContact O-N 2.97Å; T141-R143 VanDerWaalsContact C-N 3.32Å; T141-R143 PolarHBondContact O-N 2.6Å; R143-Q146 PolarHBondContact O-N 3.3Å; R143-N147 WeakPolarHBondContact O-CB 3.45Å; R143-N147 PolarHBondContact O-N 3.19Å |
| 144 | L | 87.8 | Confident | 85.6 | Confident | 94 Ų | 94 | 60 Ų | 60 | 49% | 0.492 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -59.9 | -49 | 176 | -72.3 | 171.2 | 0 | 0 | 0 | 111.2 | E140 T141 Q146 N147 E148 | E140-L144 WeakPolarHBondContact O-CG 3.01Å; E140-L144 PolarHBondContact O-N 3.34Å; T141-L144 PolarHBondContact O-N 3.27Å; L144-Q146 PolarHBondContact O-N 2.88Å; L144-N147 PolarHBondContact O-N 3.38Å; L144-E148 WeakPolarHBondContact O-CB 3.21Å; L144-E148 VanDerWaalsContact O-CG 3.29Å; L144-E148 WeakPolarHBondContact O-CG 3.38Å; L144-E148 PolarHBondContact O-N 3.04Å |
| 145 | I | 89.4 | Confident | 85.9 | Confident | 41 Ų | 41 | 62.7 Ų | 62.7 | 21% | 0.21 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -60.5 | -48.2 | 179.5 | -66 | 164.7 | 0 | 0 | 0 | 111.1 | Y123 T141 N147 E148 L149 | Y123-I145 HydrophobicContact CD2-CG2 3.87Å; Y123-I145 HydrophobicContact CE2-CB 4.47Å; Y123-I145 HydrophobicContact CE2-CG2 3.82Å; T141-I145 HydrophobicContact CG2-CD1 3.94Å; T141-I145 VanDerWaalsContact O-CG1 3.31Å; T141-I145 WeakPolarHBondContact O-CG1 3.48Å; T141-I145 PolarHBondContact O-N 3.4Å; I145-N147 VanDerWaalsContact C-N 3.3Å; I145-N147 PolarHBondContact O-N 2.89Å; I145-E148 PolarHBondContact O-N 3.31Å; I145-L149 HydrophobicContact CG2-CD1 3.83Å; I145-L149 WeakPolarHBondContact O-CB 3.33Å; I145-L149 PolarHBondContact O-N 3.24Å |
| 146 | Q | 91.4 | Very high | 86.3 | Confident | 0 Ų | 0 | 62 Ų | 62 | 0% | 0 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -63.6 | -36.2 | -179.3 | -78.4 | 174.1 | 90.1 | 0 | 0 | 112.5 | Y123 L142 R143 L144 Y150 C151 C152 C180 | Y123-Q146 WeakPolarHBondContact OH-CG 3.49Å; L142-Q146 VanDerWaalsContact O-CB 3.26Å; L142-Q146 WeakPolarHBondContact O-CB 3.32Å; L142-Q146 VanDerWaalsContact O-CG 3.23Å; L142-Q146 WeakPolarHBondContact O-CG 3.39Å; L142-Q146 PolarHBondContact O-N 3.4Å; L142-Q146 PolarHBondContact O-NE2 3.29Å; R143-Q146 PolarHBondContact O-N 3.3Å; L144-Q146 PolarHBondContact O-N 2.88Å; Q146-Y150 VanDerWaalsContact O-CA 3.28Å; Q146-Y150 WeakPolarHBondContact O-CA 3.33Å; Q146-Y150 PolarHBondContact O-N 2.97Å; Q146-C151 WeakPolarHBondContact CA-O 2.99Å; Q146-C151 VanDerWaalsContact CB-O 3.26Å; Q146-C151 WeakPolarHBondContact CB-O 3.21Å; Q146-C151 WeakPolarHBondContact CG-O 3.43Å; Q146-C151 PolarHBondContact O-N 3.1Å; Q146-C152 PolarHBondContact OE1-SG 3.33Å; Q146-C180 VanDerWaalsContact CG-SG 3.6Å |
| 147 | N | 89.6 | Confident | 86.5 | Confident | 85 Ų | 85 | 58 Ų | 58 | 46% | 0.455 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -75.1 | -41.9 | 178.6 | -161.3 | 58.5 | 0 | 0 | 0 | 112.2 | R143 L144 I145 Y150 | R143-N147 WeakPolarHBondContact O-CB 3.45Å; R143-N147 PolarHBondContact O-N 3.19Å; L144-N147 PolarHBondContact O-N 3.38Å; I145-N147 VanDerWaalsContact C-N 3.3Å; I145-N147 PolarHBondContact O-N 2.89Å; N147-Y150 PolarHBondContact O-N 3.41Å |
| 148 | E | 89.1 | Confident | 86.5 | Confident | 156 Ų | 156 | 62.1 Ų | 62.1 | 73% | 0.729 | 29% | 0.293 | S | S | * | . | H | α-helix | trans | -69.4 | -39.9 | 178.9 | -73.2 | -63.4 | 145.9 | 0 | 0 | 112.8 | L144 I145 Y150 | L144-E148 WeakPolarHBondContact O-CB 3.21Å; L144-E148 VanDerWaalsContact O-CG 3.29Å; L144-E148 WeakPolarHBondContact O-CG 3.38Å; L144-E148 PolarHBondContact O-N 3.04Å; I145-E148 PolarHBondContact O-N 3.31Å; E148-Y150 VanDerWaalsContact C-N 3.33Å |
| 149 | L | 88.3 | Confident | 86.1 | Confident | 58 Ų | 58 | 63.4 Ų | 63.4 | 30% | 0.304 | 31% | 0.311 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.6 | -4.3 | 177.8 | -65.7 | 177.5 | 0 | 0 | 0 | 113.1 | I145 C151 V183 I184 | I145-L149 HydrophobicContact CG2-CD1 3.83Å; I145-L149 WeakPolarHBondContact O-CB 3.33Å; I145-L149 PolarHBondContact O-N 3.24Å; L149-C151 VanDerWaalsContact C-N 3.32Å; L149-C151 HydrophobicContact CB-CB 4.49Å; L149-C151 PolarHBondContact O-N 3.12Å; L149-V183 HydrophobicContact CB-CG1 4.31Å; L149-I184 HydrophobicContact CD1-CG1 3.9Å |
| 150 | Y | 89.1 | Confident | 85.7 | Confident | 108 Ų | 108 | 61.7 Ų | 61.7 | 42% | 0.424 | 30% | 0.304 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 48.2 | 53 | -174.6 | -158.1 | -103 | 0 | 0 | 0 | 112.6 | Q146 N147 E148 P167 I177 | Q146-Y150 VanDerWaalsContact O-CA 3.28Å; Q146-Y150 WeakPolarHBondContact O-CA 3.33Å; Q146-Y150 PolarHBondContact O-N 2.97Å; N147-Y150 PolarHBondContact O-N 3.41Å; E148-Y150 VanDerWaalsContact C-N 3.33Å; Y150-P167 HydrophobicContact CD2-CB 4.19Å; Y150-P167 HydrophobicContact CD2-CG 4.18Å; Y150-P167 HydrophobicContact CE2-CB 4.19Å; Y150-P167 HydrophobicContact CE2-CG 4.34Å; Y150-I177 HydrophobicContact CE1-CG1 4.12Å |
| 151 | C | 91.1 | Very high | 85.3 | Confident | 0 Ų | 0 | 61.9 Ų | 61.9 | 0% | 0 | 31% | 0.311 | C | S | . | . | trans | -133.2 | 164.7 | -178.1 | 66.1 | 0 | 0 | 0 | 0 | 110.1 | Q146 L149 P167 C180 V183 | Q146-C151 WeakPolarHBondContact CA-O 2.99Å; Q146-C151 VanDerWaalsContact CB-O 3.26Å; Q146-C151 WeakPolarHBondContact CB-O 3.21Å; Q146-C151 WeakPolarHBondContact CG-O 3.43Å; Q146-C151 PolarHBondContact O-N 3.1Å; L149-C151 VanDerWaalsContact C-N 3.32Å; L149-C151 HydrophobicContact CB-CB 4.49Å; L149-C151 PolarHBondContact O-N 3.12Å; C151-P167 WeakPolarHBondContact O-CD 3.24Å; C151-C180 HydrophobicContact CB-CB 3.86Å; C151-C180 WeakPolarHBondContact CB-SG 3.29Å; C151-C180 WeakPolarHBondContact SG-CA 3.48Å; C151-C180 WeakPolarHBondContact SG-CB 3.29Å; C151-C180 CovalentContact SG-SG 2.03Å; C151-C180 PolarHBondContact SG-SG 3.21Å; C151-V183 HydrophobicContact CB-CB 4.14Å; C151-V183 HydrophobicContact CB-CG2 3.87Å | ||
| 152 | C | 91.6 | Very high | 85.1 | Confident | 0 Ų | 0 | 60.5 Ų | 60.5 | 0% | 0 | 30% | 0.3 | C | S | . | . | trans | -137.9 | 128.5 | 172.7 | -159.6 | 0 | 0 | 0 | 0 | 114 | Q146 G156 R157 E160 C166 I177 K178 | Q146-C152 PolarHBondContact OE1-SG 3.33Å; C152-G156 WeakPolarHBondContact O-CA 3.49Å; C152-G156 PolarHBondContact O-N 3.13Å; C152-R157 HydrophobicContact CB-CB 4.31Å; C152-E160 HydrophobicContact CB-CG 4.36Å; C152-C166 HydrophobicContact CB-CB 3.87Å; C152-C166 WeakPolarHBondContact CB-SG 3.35Å; C152-C166 WeakPolarHBondContact SG-CA 3.32Å; C152-C166 WeakPolarHBondContact SG-CB 3.48Å; C152-C166 CovalentContact SG-SG 2.02Å; C152-C166 PolarHBondContact SG-SG 3.49Å; C152-I177 HydrophobicContact CB-CG2 3.58Å; C152-I177 VanDerWaalsContact N-CG2 3.34Å; C152-K178 PolarHBondContact N-O 3.44Å | ||
| 153 | G | 89.8 | Confident | 84.4 | Confident | 0 Ų | 0 | 64 Ų | 64 | 0% | 0 | 32% | 0.323 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 30.7 | -143.2 | -174.7 | 0 | 0 | 0 | 0 | 0 | 116.9 | Y123 E160 C180 | Y123-G153 VanDerWaalsContact OH-CA 3.22Å; Y123-G153 WeakPolarHBondContact OH-CA 3.47Å; Y123-G153 PolarHBondContact OH-N 2.97Å; G153-E160 VanDerWaalsContact C-OE1 3.22Å; G153-E160 WeakPolarHBondContact CA-OE1 3.23Å; G153-C180 PolarHBondContact O-N 3.49Å |
| 154 | L | 89.8 | Confident | 83.9 | Confident | 46 Ų | 46 | 63.9 Ų | 63.9 | 24% | 0.241 | 33% | 0.333 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -94.2 | -22.6 | -167.1 | -61 | -179.8 | 0 | 0 | 0 | 113.9 | Y123 R124 Y127 E160 S179 P181 | Y123-L154 HydrophobicContact CD1-CD2 3.79Å; Y123-L154 HydrophobicContact CE1-CD2 3.68Å; R124-L154 HydrophobicContact CB-CD2 4.08Å; R124-L154 HydrophobicContact CG-CD1 4.07Å; R124-L154 HydrophobicContact CG-CD2 3.98Å; Y127-L154 HydrophobicContact CD1-CD1 3.52Å; Y127-L154 HydrophobicContact CD1-CG 3.75Å; Y127-L154 HydrophobicContact CD2-CG 4.4Å; Y127-L154 HydrophobicContact CE1-CD1 4.01Å; Y127-L154 HydrophobicContact CE1-CG 4.16Å; Y127-L154 HydrophobicContact CG-CD1 4.09Å; Y127-L154 HydrophobicContact CG-CD2 4.28Å; Y127-L154 HydrophobicContact CG-CG 3.9Å; L154-E160 PolarHBondContact N-OE1 3.06Å; L154-S179 WeakPolarHBondContact O-CB 3.42Å; L154-P181 HydrophobicContact CD2-CG 4.31Å |
| 155 | K | 87.4 | Confident | 83.6 | Confident | 183 Ų | 183 | 59.8 Ų | 59.8 | 80% | 0.796 | 31% | 0.311 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -126.1 | 11.7 | -176.6 | -64.6 | -174.6 | -179.4 | 178.2 | 0 | 113 | ||
| 156 | G | 84.8 | Confident | 83.5 | Confident | 6 Ų | 6 | 58.4 Ų | 58.4 | 6% | 0.062 | 31% | 0.305 | C | S | . | . | trans | 79.5 | 165 | -172.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | C152 I158 G159 E160 | C152-G156 WeakPolarHBondContact O-CA 3.49Å; C152-G156 PolarHBondContact O-N 3.13Å; G156-I158 VanDerWaalsContact C-N 3.28Å; G156-I158 PolarHBondContact O-N 3.19Å; G156-I158 VanDerWaalsContact O-N 3.07Å; G156-G159 PolarHBondContact O-N 2.93Å; G156-E160 WeakPolarHBondContact O-CG 3.49Å | ||
| 157 | R | 80.7 | Confident | 83.1 | Confident | 38 Ų | 38 | 58.6 Ų | 58.6 | 14% | 0.143 | 31% | 0.306 | C | S | . | . | G | 310 helix | trans | -53.9 | -37 | -165.4 | -173.2 | 171.5 | -140.8 | 172.8 | 11.6 | 115.5 | C152 G159 E160 P167 M174 I177 | C152-R157 HydrophobicContact CB-CB 4.31Å; R157-G159 PolarHBondContact O-N 3.22Å; R157-E160 WeakPolarHBondContact O-CB 3.48Å; R157-E160 PolarHBondContact O-N 3.22Å; R157-P167 PolarHBondContact NH2-O 3.39Å; R157-M174 HydrophobicContact CG-CG 4.43Å; R157-I177 HydrophobicContact CB-CB 4.21Å; R157-I177 HydrophobicContact CB-CG2 4.31Å; R157-I177 PolarHBondContact N-O 3.23Å |
| 158 | I | 74.6 | Confident | 82.5 | Confident | 118 Ų | 118 | 59.7 Ų | 59.7 | 61% | 0.605 | 32% | 0.318 | S | S | * | . | G | 310 helix | trans | -67.9 | -26.1 | -176.5 | -58.6 | 166.9 | 0 | 0 | 0 | 111.6 | G156 F175 | G156-I158 VanDerWaalsContact C-N 3.28Å; G156-I158 PolarHBondContact O-N 3.19Å; G156-I158 VanDerWaalsContact O-N 3.07Å; I158-F175 HydrophobicContact CD1-CD1 3.36Å; I158-F175 HydrophobicContact CD1-CD2 4.48Å; I158-F175 HydrophobicContact CD1-CE1 3.44Å; I158-F175 VanDerWaalsContact CD1-CE1 3.44Å; I158-F175 HydrophobicContact CD1-CG 3.91Å; I158-F175 HydrophobicContact CD1-CZ 4.06Å |
| 159 | G | 69.8 | Low | 81.6 | Confident | 46 Ų | 46 | 54 Ų | 54 | 47% | 0.474 | 30% | 0.297 | S | S | . | . | G | 310 helix | trans | -95.5 | 5.3 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | G156 R157 | G156-G159 PolarHBondContact O-N 2.93Å; R157-G159 PolarHBondContact O-N 3.22Å |
| 160 | E | 75.4 | Confident | 80.7 | Confident | 24 Ų | 24 | 58.9 Ų | 58.9 | 11% | 0.112 | 32% | 0.319 | C | S | . | . | trans | -86.6 | 127.5 | -171.7 | -71.7 | -58 | 132.7 | 0 | 0 | 113.5 | Y127 C152 G153 L154 G156 R157 Y162 | Y127-E160 VanDerWaalsContact CE2-OE2 3.29Å; Y127-E160 WeakPolarHBondContact CE2-OE2 3.43Å; Y127-E160 VanDerWaalsContact CZ-OE2 3.26Å; Y127-E160 PolarHBondContact OH-OE2 3.34Å; C152-E160 HydrophobicContact CB-CG 4.36Å; G153-E160 VanDerWaalsContact C-OE1 3.22Å; G153-E160 WeakPolarHBondContact CA-OE1 3.23Å; L154-E160 PolarHBondContact N-OE1 3.06Å; G156-E160 WeakPolarHBondContact O-CG 3.49Å; R157-E160 WeakPolarHBondContact O-CB 3.48Å; R157-E160 PolarHBondContact O-N 3.22Å; E160-Y162 VanDerWaalsContact C-N 3.28Å | ||
| 161 | T | 74.4 | Confident | 79.6 | Confident | 102 Ų | 102 | 61.4 Ų | 61.4 | 63% | 0.626 | 34% | 0.339 | S | S | * | . | S | Bend | trans | -75.5 | -20 | 175.7 | -47.4 | 0 | 0 | 0 | 0 | 112.1 | ||
| 162 | Y | 77.3 | Confident | 78.3 | Confident | 29 Ų | 29 | 68.1 Ų | 68.1 | 11% | 0.114 | 37% | 0.374 | C | S | . | . | trans | -127.8 | 76.1 | -174.1 | -50.6 | -54.7 | 0 | 0 | 0 | 111.7 | Y130 S131 R134 E160 D164 L165 | Y130-Y162 HydrophobicContact CD1-CD2 4.43Å; Y130-Y162 HydrophobicContact CE1-CD2 4.03Å; Y130-Y162 HydrophobicContact CE1-CE2 4.4Å; Y130-Y162 HydrophobicContact CE1-CG 4.36Å; S131-Y162 PolarHBondContact OG-OH 3.04Å; S131-Y162 VanDerWaalsContact OG-OH 3.09Å; R134-Y162 VanDerWaalsContact CZ-OH 3.22Å; R134-Y162 VanDerWaalsContact NH1-CD1 3.31Å; R134-Y162 VanDerWaalsContact NH1-CZ 3.3Å; R134-Y162 PolarHBondContact NH2-OH 3.44Å; E160-Y162 VanDerWaalsContact C-N 3.28Å; Y162-D164 PolarHBondContact O-N 3.21Å; Y162-D164 VanDerWaalsContact O-N 3.13Å; Y162-L165 VanDerWaalsContact CB-CD1 3.41Å; Y162-L165 HydrophobicContact CG-CD1 4.29Å; Y162-L165 PolarHBondContact O-N 3.17Å | ||
| 163 | P | 72.1 | Confident | 77 | Confident | 74 Ų | 74 | 70.3 Ų | 70.3 | 48% | 0.481 | 39% | 0.386 | S | S | . | . | G | 310 helix | trans | -62.6 | -22.3 | -175.9 | 25.2 | -34 | 0 | 0 | 0 | 113.3 | L165 C166 | P163-L165 PolarHBondContact O-N 3.13Å; P163-C166 WeakPolarHBondContact O-CB 3.3Å; P163-C166 PolarHBondContact O-N 3.49Å; P163-C166 VanDerWaalsContact O-N 3.11Å |
| 164 | D | 77.7 | Confident | 75.8 | Confident | 134 Ų | 134 | 75.4 Ų | 75.4 | 72% | 0.717 | 41% | 0.411 | S | S | * | . | G | 310 helix | trans | -65.7 | -17.8 | 179.5 | -52.9 | -29.6 | 0 | 0 | 0 | 113.9 | Y162 | Y162-D164 PolarHBondContact O-N 3.21Å; Y162-D164 VanDerWaalsContact O-N 3.13Å |
| 165 | L | 82.3 | Confident | 74.7 | Confident | 7 Ų | 7 | 81.3 Ų | 81.3 | 4% | 0.037 | 44% | 0.435 | C | S | . | . | G | 310 helix | trans | -87.4 | -18.1 | 174.9 | -73.9 | 96.6 | 0 | 0 | 0 | 113.2 | Y130 K139 L142 Y162 P163 | Y130-L165 HydrophobicContact CD1-CD2 4.33Å; Y130-L165 HydrophobicContact CE1-CD1 3.69Å; Y130-L165 HydrophobicContact CE1-CD2 4Å; K139-L165 HydrophobicContact CG-CD2 4.14Å; K139-L165 HydrophobicContact CG-CG 4.26Å; L142-L165 HydrophobicContact CB-CD2 3.54Å; L142-L165 HydrophobicContact CD1-CD2 4.07Å; L142-L165 HydrophobicContact CG-CD2 4.48Å; Y162-L165 VanDerWaalsContact CB-CD1 3.41Å; Y162-L165 HydrophobicContact CG-CD1 4.29Å; Y162-L165 PolarHBondContact O-N 3.17Å; P163-L165 PolarHBondContact O-N 3.13Å |
| 166 | C | 86.4 | Confident | 74.1 | Confident | 13 Ų | 13 | 77.4 Ų | 77.4 | 9% | 0.088 | 42% | 0.422 | C | S | . | . | S | Bend | trans | -71.3 | 151.2 | -178.6 | -59.5 | 0 | 0 | 0 | 0 | 111.1 | C152 P163 | C152-C166 HydrophobicContact CB-CB 3.87Å; C152-C166 WeakPolarHBondContact CB-SG 3.35Å; C152-C166 WeakPolarHBondContact SG-CA 3.32Å; C152-C166 WeakPolarHBondContact SG-CB 3.48Å; C152-C166 CovalentContact SG-SG 2.02Å; C152-C166 PolarHBondContact SG-SG 3.49Å; P163-C166 WeakPolarHBondContact O-CB 3.3Å; P163-C166 PolarHBondContact O-N 3.49Å; P163-C166 VanDerWaalsContact O-N 3.11Å |
| 167 | P | 84.1 | Confident | 74.1 | Confident | 3 Ų | 3 | 77.5 Ų | 77.5 | 2% | 0.019 | 42% | 0.421 | C | S | . | . | P | Polyproline II helix | trans | -57.1 | 147 | 168.4 | 22.3 | -31.2 | 0 | 0 | 0 | 111.4 | Y150 C151 R157 A169 I177 | Y150-P167 HydrophobicContact CD2-CB 4.19Å; Y150-P167 HydrophobicContact CD2-CG 4.18Å; Y150-P167 HydrophobicContact CE2-CB 4.19Å; Y150-P167 HydrophobicContact CE2-CG 4.34Å; C151-P167 WeakPolarHBondContact O-CD 3.24Å; R157-P167 PolarHBondContact NH2-O 3.39Å; P167-A169 PolarHBondContact O-N 3.01Å; P167-I177 HydrophobicContact CG-CD1 4.23Å |
| 168 | P | 77.1 | Confident | 74.5 | Confident | 109 Ų | 109 | 80.8 Ų | 80.8 | 71% | 0.708 | 44% | 0.436 | S | S | * | . | P | Polyproline II helix | trans | -60.6 | 135.6 | 174 | 26.9 | -32.6 | 0 | 0 | 0 | 108.8 | ||
| 169 | A | 69.1 | Low | 75.3 | Confident | 35 Ų | 35 | 75.5 Ų | 75.5 | 29% | 0.289 | 41% | 0.41 | S | S | . | . | trans | -148.3 | 147.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 110.9 | P167 D173 I177 | P167-A169 PolarHBondContact O-N 3.01Å; A169-D173 HydrophobicContact CB-CB 3.29Å; A169-I177 HydrophobicContact CB-CD1 3.65Å | ||
| 170 | E | 71.1 | Confident | 76.4 | Confident | 162 Ų | 162 | 73.3 Ų | 73.3 | 76% | 0.757 | 39% | 0.387 | S | S | * | . | trans | -78.7 | 169.7 | 178.3 | -70.8 | -176.6 | 162.4 | 0 | 0 | 110.9 | L172 D173 | E170-L172 PolarHBondContact O-N 2.88Å; E170-D173 WeakPolarHBondContact O-CB 3.34Å; E170-D173 PolarHBondContact O-N 3.38Å | ||
| 171 | D | 65.3 | Low | 77.1 | Confident | 160 Ų | 160 | 73.4 Ų | 73.4 | 86% | 0.856 | 39% | 0.39 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -51.1 | -31.1 | -167.4 | -71.9 | -36.8 | 0 | 0 | 0 | 114.9 | ||
| 172 | L | 63.4 | Low | 78 | Confident | 141 Ų | 141 | 72.9 Ų | 72.9 | 74% | 0.738 | 38% | 0.384 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.6 | -28.9 | 179.2 | -148.8 | 78.2 | 0 | 0 | 0 | 113.4 | E170 M174 | E170-L172 PolarHBondContact O-N 2.88Å; L172-M174 PolarHBondContact O-N 3.07Å |
| 173 | D | 64.6 | Low | 78.6 | Confident | 47 Ų | 47 | 72.5 Ų | 72.5 | 25% | 0.251 | 38% | 0.384 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -75 | -14.8 | -177.5 | -68.6 | -38.1 | 0 | 0 | 0 | 112.6 | A169 E170 F175 I176 I177 | A169-D173 HydrophobicContact CB-CB 3.29Å; E170-D173 WeakPolarHBondContact O-CB 3.34Å; E170-D173 PolarHBondContact O-N 3.38Å; D173-F175 PolarHBondContact O-N 3.34Å; D173-I176 PolarHBondContact O-N 2.84Å; D173-I176 VanDerWaalsContact O-N 3.12Å; D173-I177 WeakPolarHBondContact O-CG1 3.35Å; D173-I177 PolarHBondContact O-N 2.92Å |
| 174 | M | 63.5 | Low | 79.5 | Confident | 107 Ų | 107 | 69.3 Ų | 69.3 | 53% | 0.527 | 36% | 0.363 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.1 | -29 | 176.6 | -145.9 | -176.1 | -171.2 | 0 | 0 | 112.6 | R157 L172 | R157-M174 HydrophobicContact CG-CG 4.43Å; L172-M174 PolarHBondContact O-N 3.07Å |
| 175 | F | 66.8 | Low | 80.1 | Confident | 169 Ų | 169 | 65.4 Ų | 65.4 | 74% | 0.741 | 34% | 0.342 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -94.7 | -16.7 | 176.2 | -85.2 | -91.6 | 0 | 0 | 0 | 114.4 | I158 D173 | I158-F175 HydrophobicContact CD1-CD1 3.36Å; I158-F175 HydrophobicContact CD1-CD2 4.48Å; I158-F175 HydrophobicContact CD1-CE1 3.44Å; I158-F175 VanDerWaalsContact CD1-CE1 3.44Å; I158-F175 HydrophobicContact CD1-CG 3.91Å; I158-F175 HydrophobicContact CD1-CZ 4.06Å; D173-F175 PolarHBondContact O-N 3.34Å |
| 176 | I | 76.5 | Confident | 80.4 | Confident | 102 Ų | 102 | 69 Ų | 69 | 52% | 0.523 | 36% | 0.359 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.3 | -27.3 | -173.4 | -59.5 | 175.1 | 0 | 0 | 0 | 111.4 | D173 K178 | D173-I176 PolarHBondContact O-N 2.84Å; D173-I176 VanDerWaalsContact O-N 3.12Å; I176-K178 PolarHBondContact O-N 2.92Å |
| 177 | I | 83.9 | Confident | 80.3 | Confident | 8 Ų | 8 | 70.2 Ų | 70.2 | 4% | 0.041 | 37% | 0.366 | C | S | . | . | trans | -66.1 | 104.7 | 179.8 | -66.6 | 166.5 | 0 | 0 | 0 | 110.4 | Y150 C152 R157 P167 A169 D173 | Y150-I177 HydrophobicContact CE1-CG1 4.12Å; C152-I177 HydrophobicContact CB-CG2 3.58Å; C152-I177 VanDerWaalsContact N-CG2 3.34Å; R157-I177 HydrophobicContact CB-CB 4.21Å; R157-I177 HydrophobicContact CB-CG2 4.31Å; R157-I177 PolarHBondContact N-O 3.23Å; P167-I177 HydrophobicContact CG-CD1 4.23Å; A169-I177 HydrophobicContact CB-CD1 3.65Å; D173-I177 WeakPolarHBondContact O-CG1 3.35Å; D173-I177 PolarHBondContact O-N 2.92Å | ||
| 178 | K | 89.4 | Confident | 80.3 | Confident | 106 Ų | 106 | 71.8 Ų | 71.8 | 46% | 0.461 | 37% | 0.372 | S | S | . | . | trans | -69.6 | 167.4 | 176.7 | -65.8 | -175 | -175.4 | 178.3 | 0 | 112 | C152 I176 V183 E186 | C152-K178 PolarHBondContact N-O 3.44Å; I176-K178 PolarHBondContact O-N 2.92Å; K178-V183 HydrophobicContact CB-CG2 3.8Å; K178-V183 HydrophobicContact CD-CG2 4.35Å; K178-E186 IonicContact NZ-OE2 3.92Å; K178-E186 PolarHBondContact NZ-OE2 3.32Å | ||
| 179 | S | 90.9 | Very high | 80.6 | Confident | 7 Ų | 7 | 71.5 Ų | 71.5 | 5% | 0.049 | 37% | 0.365 | C | S | . | . | trans | -65.8 | 147.1 | 169.1 | 85.4 | 0 | 0 | 0 | 0 | 110.6 | L154 D182 V183 | L154-S179 WeakPolarHBondContact O-CB 3.42Å; S179-D182 PolarHBondContact O-N 3.34Å; S179-D182 WeakPolarHBondContact OG-CB 3.03Å; S179-D182 PolarHBondContact OG-N 3.44Å; S179-D182 PolarHBondContact OG-OD2 2.96Å; S179-V183 WeakPolarHBondContact O-CG2 3.42Å; S179-V183 PolarHBondContact O-N 2.84Å | ||
| 180 | C | 91.9 | Very high | 81.2 | Confident | 0 Ų | 0 | 73.5 Ų | 73.5 | 0% | 0 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -64.2 | -39.1 | 178.3 | -69.1 | 0 | 0 | 0 | 0 | 114.2 | Y123 Q146 C151 G153 D182 V183 I184 | Y123-C180 HydrophobicContact CD1-CB 3.9Å; Y123-C180 HydrophobicContact CD2-CB 4.3Å; Y123-C180 HydrophobicContact CE1-CB 3.41Å; Y123-C180 VanDerWaalsContact CE1-CB 3.41Å; Y123-C180 HydrophobicContact CE2-CB 3.85Å; Y123-C180 HydrophobicContact CG-CB 4.32Å; Y123-C180 VanDerWaalsContact CZ-SG 3.53Å; Y123-C180 PolarHBondContact OH-SG 2.88Å; Q146-C180 VanDerWaalsContact CG-SG 3.6Å; C151-C180 HydrophobicContact CB-CB 3.86Å; C151-C180 WeakPolarHBondContact CB-SG 3.29Å; C151-C180 WeakPolarHBondContact SG-CA 3.48Å; C151-C180 WeakPolarHBondContact SG-CB 3.29Å; C151-C180 CovalentContact SG-SG 2.03Å; C151-C180 PolarHBondContact SG-SG 3.21Å; G153-C180 PolarHBondContact O-N 3.49Å; C180-D182 VanDerWaalsContact C-N 3.32Å; C180-D182 PolarHBondContact O-N 3.33Å; C180-V183 PolarHBondContact O-N 3.46Å; C180-I184 WeakPolarHBondContact O-CD1 3.46Å; C180-I184 WeakPolarHBondContact O-CG1 3.43Å; C180-I184 PolarHBondContact O-N 2.98Å |
| 181 | P | 92.1 | Very high | 81.7 | Confident | 27 Ų | 27 | 70.2 Ų | 70.2 | 18% | 0.175 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -55.9 | -44.3 | 172.5 | -26.6 | 36 | 0 | 0 | 0 | 112.9 | Y123 L154 V183 I184 D185 | Y123-P181 HydrophobicContact CD1-CG 4.23Å; L154-P181 HydrophobicContact CD2-CG 4.31Å; P181-V183 VanDerWaalsContact C-N 3.33Å; P181-V183 PolarHBondContact O-N 3.44Å; P181-I184 PolarHBondContact O-N 3.26Å; P181-D185 VanDerWaalsContact O-CG 3.25Å; P181-D185 PolarHBondContact O-N 3.07Å |
| 182 | D | 91.6 | Very high | 82.4 | Confident | 91 Ų | 91 | 65.2 Ų | 65.2 | 49% | 0.487 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -63.9 | -39.2 | 179.1 | -62.6 | -37.6 | 0 | 0 | 0 | 112 | S179 C180 D185 E186 | S179-D182 PolarHBondContact O-N 3.34Å; S179-D182 WeakPolarHBondContact OG-CB 3.03Å; S179-D182 PolarHBondContact OG-N 3.44Å; S179-D182 PolarHBondContact OG-OD2 2.96Å; C180-D182 VanDerWaalsContact C-N 3.32Å; C180-D182 PolarHBondContact O-N 3.33Å; D182-D185 PolarHBondContact O-N 2.56Å; D182-E186 WeakPolarHBondContact O-CB 3.33Å; D182-E186 PolarHBondContact O-N 3.49Å |
| 183 | V | 90.8 | Very high | 83.4 | Confident | 21 Ų | 21 | 64.6 Ų | 64.6 | 13% | 0.127 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -69.7 | -39.3 | 177.6 | 176.2 | 0 | 0 | 0 | 0 | 111.3 | L149 C151 K178 S179 C180 P181 D185 E186 V187 | L149-V183 HydrophobicContact CB-CG1 4.31Å; C151-V183 HydrophobicContact CB-CB 4.14Å; C151-V183 HydrophobicContact CB-CG2 3.87Å; K178-V183 HydrophobicContact CB-CG2 3.8Å; K178-V183 HydrophobicContact CD-CG2 4.35Å; S179-V183 WeakPolarHBondContact O-CG2 3.42Å; S179-V183 PolarHBondContact O-N 2.84Å; C180-V183 PolarHBondContact O-N 3.46Å; P181-V183 VanDerWaalsContact C-N 3.33Å; P181-V183 PolarHBondContact O-N 3.44Å; V183-D185 VanDerWaalsContact C-N 3.3Å; V183-D185 PolarHBondContact O-N 2.99Å; V183-E186 PolarHBondContact O-N 2.85Å; V183-V187 HydrophobicContact CG1-CG2 4.37Å; V183-V187 VanDerWaalsContact O-CG2 3.3Å; V183-V187 WeakPolarHBondContact O-CG2 3.22Å; V183-V187 PolarHBondContact O-N 3.44Å |
| 184 | I | 90.6 | Very high | 84.4 | Confident | 7 Ų | 7 | 66.5 Ų | 66.5 | 4% | 0.036 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -58 | -47.4 | 173.4 | -69.6 | 162 | 0 | 0 | 0 | 109.4 | I119 S120 Y123 L149 C180 P181 E186 V187 F188 | I119-I184 HydrophobicContact CB-CG2 4.3Å; I119-I184 HydrophobicContact CG2-CD1 4.36Å; I119-I184 HydrophobicContact CG2-CG2 3.75Å; S120-I184 WeakPolarHBondContact OG-CG2 3.33Å; Y123-I184 HydrophobicContact CG-CD1 4.29Å; L149-I184 HydrophobicContact CD1-CG1 3.9Å; C180-I184 WeakPolarHBondContact O-CD1 3.46Å; C180-I184 WeakPolarHBondContact O-CG1 3.43Å; C180-I184 PolarHBondContact O-N 2.98Å; P181-I184 PolarHBondContact O-N 3.26Å; I184-E186 VanDerWaalsContact C-N 3.33Å; I184-E186 PolarHBondContact O-N 2.9Å; I184-V187 PolarHBondContact O-N 3.23Å; I184-F188 HydrophobicContact CG2-CD2 4.11Å; I184-F188 HydrophobicContact CG2-CE2 4.37Å; I184-F188 WeakPolarHBondContact O-CD2 3.47Å; I184-F188 PolarHBondContact O-N 2.95Å |
| 185 | D | 89.9 | Confident | 85.4 | Confident | 51 Ų | 51 | 64.3 Ų | 64.3 | 27% | 0.273 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -63.5 | -39.1 | 178.9 | -66.1 | 0.1 | 0 | 0 | 0 | 111.9 | L116 S120 P181 D182 V183 F188 N189 | L116-D185 HydrophobicContact CD1-CB 4.01Å; L116-D185 WeakPolarHBondContact CD2-OD1 3.41Å; L116-D185 HydrophobicContact CG-CB 4.49Å; L116-D185 WeakPolarHBondContact CG-OD1 3.4Å; S120-D185 PolarHBondContact OG-OD1 2.75Å; S120-D185 VanDerWaalsContact OG-OD1 3.1Å; P181-D185 VanDerWaalsContact O-CG 3.25Å; P181-D185 PolarHBondContact O-N 3.07Å; D182-D185 PolarHBondContact O-N 2.56Å; V183-D185 VanDerWaalsContact C-N 3.3Å; V183-D185 PolarHBondContact O-N 2.99Å; D185-F188 PolarHBondContact O-N 3.33Å; D185-N189 WeakPolarHBondContact O-CB 3.39Å; D185-N189 PolarHBondContact O-N 3.02Å; D185-N189 PolarHBondContact O-ND2 3.5Å |
| 186 | E | 88.4 | Confident | 86.5 | Confident | 84 Ų | 84 | 57.8 Ų | 57.8 | 39% | 0.393 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -65.3 | -39.7 | 175.2 | -171.3 | 173 | 171.7 | 0 | 0 | 111.8 | K178 D182 V183 I184 S190 | K178-E186 IonicContact NZ-OE2 3.92Å; K178-E186 PolarHBondContact NZ-OE2 3.32Å; D182-E186 WeakPolarHBondContact O-CB 3.33Å; D182-E186 PolarHBondContact O-N 3.49Å; V183-E186 PolarHBondContact O-N 2.85Å; I184-E186 VanDerWaalsContact C-N 3.33Å; I184-E186 PolarHBondContact O-N 2.9Å; E186-S190 WeakPolarHBondContact O-CA 3.46Å; E186-S190 VanDerWaalsContact O-CB 3.23Å; E186-S190 WeakPolarHBondContact O-CB 3.28Å; E186-S190 PolarHBondContact O-N 2.9Å |
| 187 | V | 85.3 | Confident | 87.1 | Confident | 38 Ų | 38 | 54.4 Ų | 54.4 | 23% | 0.23 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -63.5 | -44.3 | 175.6 | 167.8 | 0 | 0 | 0 | 0 | 110.7 | V183 I184 K191 L192 V195 | V183-V187 HydrophobicContact CG1-CG2 4.37Å; V183-V187 VanDerWaalsContact O-CG2 3.3Å; V183-V187 WeakPolarHBondContact O-CG2 3.22Å; V183-V187 PolarHBondContact O-N 3.44Å; I184-V187 PolarHBondContact O-N 3.23Å; V187-K191 HydrophobicContact CG1-CB 4.3Å; V187-K191 CarbonylContact O-C 3.46Å; V187-K191 WeakPolarHBondContact O-CA 3.39Å; V187-K191 WeakPolarHBondContact O-CB 3.34Å; V187-K191 PolarHBondContact O-N 3.06Å; V187-L192 PolarHBondContact O-N 3.34Å; V187-V195 HydrophobicContact CG1-CG2 4.42Å |
| 188 | F | 83.5 | Confident | 87.5 | Confident | 36 Ų | 36 | 58.9 Ų | 58.9 | 16% | 0.158 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -73.6 | -35.6 | -179.1 | -87.1 | -88 | 0 | 0 | 0 | 113.3 | V115 L116 I119 I184 D185 L192 | V115-F188 HydrophobicContact CG1-CE1 3.91Å; V115-F188 HydrophobicContact CG1-CZ 4.33Å; L116-F188 HydrophobicContact CD1-CB 3.95Å; I119-F188 HydrophobicContact CD1-CE1 4.08Å; I119-F188 HydrophobicContact CD1-CE2 3.43Å; I119-F188 VanDerWaalsContact CD1-CE2 3.43Å; I119-F188 HydrophobicContact CD1-CZ 3.16Å; I184-F188 HydrophobicContact CG2-CD2 4.11Å; I184-F188 HydrophobicContact CG2-CE2 4.37Å; I184-F188 WeakPolarHBondContact O-CD2 3.47Å; I184-F188 PolarHBondContact O-N 2.95Å; D185-F188 PolarHBondContact O-N 3.33Å; F188-L192 WeakPolarHBondContact O-CB 3.19Å |
| 189 | N | 83.8 | Confident | 87.6 | Confident | 103 Ų | 103 | 55.2 Ų | 55.2 | 55% | 0.551 | 31% | 0.313 | S | S | * | . | H | α-helix | trans | -83.4 | -39.7 | 179.9 | -73.6 | -48.7 | 0 | 0 | 0 | 113.3 | D185 | D185-N189 WeakPolarHBondContact O-CB 3.39Å; D185-N189 PolarHBondContact O-N 3.02Å; D185-N189 PolarHBondContact O-ND2 3.5Å |
| 190 | S | 82.3 | Confident | 87.7 | Confident | 76 Ų | 76 | 60.7 Ų | 60.7 | 53% | 0.531 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -106.6 | -22.6 | -172.3 | -55.4 | 0 | 0 | 0 | 0 | 113.4 | E186 H193 | E186-S190 WeakPolarHBondContact O-CA 3.46Å; E186-S190 VanDerWaalsContact O-CB 3.23Å; E186-S190 WeakPolarHBondContact O-CB 3.28Å; E186-S190 PolarHBondContact O-N 2.9Å; S190-H193 PolarHBondContact O-CE1 3.47Å |
| 191 | K | 80.6 | Confident | 87.9 | Confident | 94 Ų | 94 | 64.5 Ų | 64.5 | 41% | 0.409 | 36% | 0.364 | S | S | . | . | trans | -117.7 | 22.2 | -176.2 | -50.8 | -75.6 | -172.4 | 175.6 | 0 | 113.2 | V187 H193 I194 | V187-K191 HydrophobicContact CG1-CB 4.3Å; V187-K191 CarbonylContact O-C 3.46Å; V187-K191 WeakPolarHBondContact O-CA 3.39Å; V187-K191 WeakPolarHBondContact O-CB 3.34Å; V187-K191 PolarHBondContact O-N 3.06Å; K191-H193 PolarHBondContact O-N 3.46Å; K191-I194 HydrophobicContact CB-CD1 3.95Å; K191-I194 HydrophobicContact CB-CG1 4.15Å; K191-I194 HydrophobicContact CD-CD1 3.99Å; K191-I194 HydrophobicContact CG-CD1 4.33Å; K191-I194 WeakPolarHBondContact O-CB 3.2Å; K191-I194 PolarHBondContact O-N 3.41Å | ||
| 192 | L | 81.4 | Confident | 88 | Confident | 54 Ų | 54 | 66.7 Ų | 66.7 | 28% | 0.283 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -53.9 | -30.6 | 177.9 | -158.3 | 149.9 | 0 | 0 | 0 | 112.3 | F109 Q112 V187 F188 I194 V195 G196 | F109-L192 HydrophobicContact CD2-CD2 4.26Å; F109-L192 HydrophobicContact CE2-CD2 4.31Å; Q112-L192 HydrophobicContact CG-CD1 4.38Å; V187-L192 PolarHBondContact O-N 3.34Å; F188-L192 WeakPolarHBondContact O-CB 3.19Å; L192-I194 VanDerWaalsContact C-N 3.25Å; L192-I194 PolarHBondContact O-N 2.88Å; L192-V195 PolarHBondContact O-N 2.91Å; L192-G196 PolarHBondContact O-N 2.89Å |
| 193 | H | 84.6 | Confident | 88.2 | Confident | 128 Ų | 128 | 62.9 Ų | 62.9 | 59% | 0.593 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -58.1 | -31.9 | 173.5 | 61.2 | -89.5 | 0 | 0 | 0 | 113.9 | S190 K191 G197 | S190-H193 PolarHBondContact O-CE1 3.47Å; K191-H193 PolarHBondContact O-N 3.46Å; H193-G197 PolarHBondContact O-N 2.98Å |
| 194 | I | 85.4 | Confident | 88.4 | Confident | 88 Ų | 88 | 65.2 Ų | 65.2 | 45% | 0.451 | 37% | 0.37 | S | S | . | . | H | α-helix | trans | -69.8 | -50.5 | 176.4 | -57.4 | -173.9 | 0 | 0 | 0 | 109.7 | K191 L192 G196 G197 I198 | K191-I194 HydrophobicContact CB-CD1 3.95Å; K191-I194 HydrophobicContact CB-CG1 4.15Å; K191-I194 HydrophobicContact CD-CD1 3.99Å; K191-I194 HydrophobicContact CG-CD1 4.33Å; K191-I194 WeakPolarHBondContact O-CB 3.2Å; K191-I194 PolarHBondContact O-N 3.41Å; L192-I194 VanDerWaalsContact C-N 3.25Å; L192-I194 PolarHBondContact O-N 2.88Å; I194-G196 VanDerWaalsContact C-N 3.32Å; I194-G196 PolarHBondContact O-N 2.87Å; I194-G197 PolarHBondContact O-N 3.15Å; I194-G197 VanDerWaalsContact O-N 3.11Å; I194-I198 PolarHBondContact O-N 2.97Å |
| 195 | V | 84.3 | Confident | 88.6 | Confident | 61 Ų | 61 | 68.7 Ų | 68.7 | 37% | 0.37 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -61.2 | -43.8 | 178.5 | -178.3 | 0 | 0 | 0 | 0 | 110.6 | V187 L192 G197 I198 G199 | V187-V195 HydrophobicContact CG1-CG2 4.42Å; L192-V195 PolarHBondContact O-N 2.91Å; V195-G197 VanDerWaalsContact C-N 3.33Å; V195-G197 PolarHBondContact O-N 3.27Å; V195-I198 PolarHBondContact O-N 2.86Å; V195-G199 PolarHBondContact O-N 3.02Å |
| 196 | G | 88.6 | Confident | 88.8 | Confident | 31 Ų | 31 | 67.8 Ų | 67.8 | 32% | 0.32 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -60.6 | -40.1 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | L192 I194 I198 G199 I200 | L192-G196 PolarHBondContact O-N 2.89Å; I194-G196 VanDerWaalsContact C-N 3.32Å; I194-G196 PolarHBondContact O-N 2.87Å; G196-I198 PolarHBondContact O-N 3.31Å; G196-G199 PolarHBondContact O-N 2.96Å; G196-I200 VanDerWaalsContact O-CG1 3.29Å; G196-I200 WeakPolarHBondContact O-CG1 3.46Å; G196-I200 PolarHBondContact O-N 3.16Å |
| 197 | G | 90.8 | Very high | 89.2 | Confident | 31 Ų | 31 | 66.4 Ų | 66.4 | 32% | 0.32 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -62.6 | -39.4 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | H193 I194 V195 I200 T201 | H193-G197 PolarHBondContact O-N 2.98Å; I194-G197 PolarHBondContact O-N 3.15Å; I194-G197 VanDerWaalsContact O-N 3.11Å; V195-G197 VanDerWaalsContact C-N 3.33Å; V195-G197 PolarHBondContact O-N 3.27Å; G197-I200 PolarHBondContact O-N 3.04Å; G197-T201 WeakPolarHBondContact O-CB 3.3Å; G197-T201 PolarHBondContact O-N 3.5Å; G197-T201 PolarHBondContact O-OG1 3.03Å |
| 198 | I | 90.8 | Very high | 89.6 | Confident | 102 Ų | 102 | 69.7 Ų | 69.7 | 52% | 0.523 | 39% | 0.391 | S | S | . | . | H | α-helix | trans | -62.6 | -48.4 | 174.5 | -64.3 | 168.1 | 0 | 0 | 0 | 109.9 | I194 V195 G196 I200 T201 I202 | I194-I198 PolarHBondContact O-N 2.97Å; V195-I198 PolarHBondContact O-N 2.86Å; G196-I198 PolarHBondContact O-N 3.31Å; I198-I200 PolarHBondContact O-N 3.29Å; I198-T201 WeakPolarHBondContact O-CB 3.49Å; I198-T201 PolarHBondContact O-N 2.86Å; I198-I202 HydrophobicContact CG2-CD1 3.89Å; I198-I202 WeakPolarHBondContact O-CG1 3.32Å; I198-I202 PolarHBondContact O-N 3.3Å |
| 199 | G | 92.3 | Very high | 90 | Very high | 29 Ų | 29 | 69 Ų | 69 | 30% | 0.299 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -60.3 | -43.5 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | V195 G196 T201 I202 G203 | V195-G199 PolarHBondContact O-N 3.02Å; G196-G199 PolarHBondContact O-N 2.96Å; G199-T201 VanDerWaalsContact C-N 3.31Å; G199-T201 PolarHBondContact O-N 2.97Å; G199-I202 PolarHBondContact O-N 3.23Å; G199-G203 PolarHBondContact O-N 2.97Å |
| 200 | I | 93.6 | Very high | 90.6 | Very high | 122 Ų | 122 | 65 Ų | 65 | 63% | 0.626 | 37% | 0.373 | S | S | * | . | H | α-helix | trans | -60.8 | -42.4 | 176 | -68.5 | 165 | 0 | 0 | 0 | 110.9 | G196 G197 I198 G203 V204 | G196-I200 VanDerWaalsContact O-CG1 3.29Å; G196-I200 WeakPolarHBondContact O-CG1 3.46Å; G196-I200 PolarHBondContact O-N 3.16Å; G197-I200 PolarHBondContact O-N 3.04Å; I198-I200 PolarHBondContact O-N 3.29Å; I200-G203 PolarHBondContact O-N 3.35Å; I200-V204 HydrophobicContact CG2-CG2 4.41Å; I200-V204 WeakPolarHBondContact O-CG2 3.25Å; I200-V204 PolarHBondContact O-N 3.13Å |
| 201 | T | 94.9 | Very high | 91.2 | Very high | 81 Ų | 81 | 65.3 Ų | 65.3 | 50% | 0.497 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -62.6 | -44.8 | 179.2 | -57.7 | 0 | 0 | 0 | 0 | 111.2 | G197 I198 G199 V204 I205 | G197-T201 WeakPolarHBondContact O-CB 3.3Å; G197-T201 PolarHBondContact O-N 3.5Å; G197-T201 PolarHBondContact O-OG1 3.03Å; I198-T201 WeakPolarHBondContact O-CB 3.49Å; I198-T201 PolarHBondContact O-N 2.86Å; G199-T201 VanDerWaalsContact C-N 3.31Å; G199-T201 PolarHBondContact O-N 2.97Å; T201-V204 PolarHBondContact O-N 3.48Å; T201-I205 HydrophobicContact CG2-CD1 4.07Å; T201-I205 WeakPolarHBondContact O-CG1 3.21Å; T201-I205 PolarHBondContact O-N 3.39Å |
| 202 | I | 94.2 | Very high | 91.7 | Very high | 72 Ų | 72 | 64.6 Ų | 64.6 | 37% | 0.369 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -60.5 | -48.7 | 176.2 | -66.5 | 168.3 | 0 | 0 | 0 | 110.2 | E101 I198 G199 V204 I205 M206 | E101-I202 WeakPolarHBondContact OE1-CB 3.43Å; E101-I202 VanDerWaalsContact OE1-CG2 3.22Å; E101-I202 WeakPolarHBondContact OE1-CG2 3.46Å; I198-I202 HydrophobicContact CG2-CD1 3.89Å; I198-I202 WeakPolarHBondContact O-CG1 3.32Å; I198-I202 PolarHBondContact O-N 3.3Å; G199-I202 PolarHBondContact O-N 3.23Å; I202-V204 VanDerWaalsContact C-N 3.35Å; I202-V204 PolarHBondContact O-N 3.01Å; I202-I205 PolarHBondContact O-N 3.01Å; I202-I205 VanDerWaalsContact O-N 3.17Å; I202-M206 HydrophobicContact CG2-CE 3.58Å; I202-M206 WeakPolarHBondContact O-CG 3.5Å; I202-M206 PolarHBondContact O-N 3.27Å |
| 203 | G | 95.6 | Very high | 92.2 | Very high | 11 Ų | 11 | 62.1 Ų | 62.1 | 11% | 0.113 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -57.8 | -42.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | G199 I200 M206 V207 | G199-G203 PolarHBondContact O-N 2.97Å; I200-G203 PolarHBondContact O-N 3.35Å; G203-M206 PolarHBondContact O-N 2.85Å; G203-V207 WeakPolarHBondContact O-CG2 3.42Å; G203-V207 PolarHBondContact O-N 3.36Å |
| 204 | V | 95.8 | Very high | 92.6 | Very high | 71 Ų | 71 | 61.4 Ų | 61.4 | 43% | 0.43 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -62.4 | -45.5 | 176 | 169.3 | 0 | 0 | 0 | 0 | 111.2 | I200 T201 I202 M206 V207 F208 | I200-V204 HydrophobicContact CG2-CG2 4.41Å; I200-V204 WeakPolarHBondContact O-CG2 3.25Å; I200-V204 PolarHBondContact O-N 3.13Å; T201-V204 PolarHBondContact O-N 3.48Å; I202-V204 VanDerWaalsContact C-N 3.35Å; I202-V204 PolarHBondContact O-N 3.01Å; V204-M206 VanDerWaalsContact C-N 3.31Å; V204-M206 PolarHBondContact O-N 3.39Å; V204-V207 PolarHBondContact O-N 3.18Å; V204-F208 HydrophobicContact CG1-CD2 3.77Å; V204-F208 HydrophobicContact CG1-CE2 3.59Å; V204-F208 VanDerWaalsContact O-CD2 3.23Å; V204-F208 WeakPolarHBondContact O-CD2 3.35Å; V204-F208 PolarHBondContact O-N 3.33Å |
| 205 | I | 93.9 | Very high | 92.8 | Very high | 79 Ų | 79 | 61.8 Ų | 61.8 | 41% | 0.405 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -60 | -42.6 | 177.1 | -69 | 168 | 0 | 0 | 0 | 110.7 | F17 T201 I202 F208 G209 | F17-I205 HydrophobicContact CE1-CG2 4.47Å; F17-I205 HydrophobicContact CZ-CG2 3.8Å; T201-I205 HydrophobicContact CG2-CD1 4.07Å; T201-I205 WeakPolarHBondContact O-CG1 3.21Å; T201-I205 PolarHBondContact O-N 3.39Å; I202-I205 PolarHBondContact O-N 3.01Å; I202-I205 VanDerWaalsContact O-N 3.17Å; I205-F208 PolarHBondContact O-N 2.94Å; I205-G209 PolarHBondContact O-N 3.44Å |
| 206 | M | 94.8 | Very high | 93.1 | Very high | 32 Ų | 32 | 59 Ų | 59 | 16% | 0.158 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -63.5 | -42.3 | 177 | -70.4 | -166.5 | -168.8 | 0 | 0 | 112.4 | I97 F98 E101 I202 G203 V204 F208 G209 L210 | I97-M206 HydrophobicContact CB-SD 4.5Å; I97-M206 HydrophobicContact CG2-CE 3.4Å; I97-M206 VanDerWaalsContact CG2-CE 3.4Å; I97-M206 HydrophobicContact CG2-SD 3.81Å; F98-M206 HydrophobicContact CB-SD 4.33Å; F98-M206 HydrophobicContact CD2-CB 4.28Å; F98-M206 HydrophobicContact CD2-SD 4.46Å; E101-M206 WeakPolarHBondContact OE2-CE 3.27Å; I202-M206 HydrophobicContact CG2-CE 3.58Å; I202-M206 WeakPolarHBondContact O-CG 3.5Å; I202-M206 PolarHBondContact O-N 3.27Å; G203-M206 PolarHBondContact O-N 2.85Å; V204-M206 VanDerWaalsContact C-N 3.31Å; V204-M206 PolarHBondContact O-N 3.39Å; M206-F208 VanDerWaalsContact C-N 3.34Å; M206-F208 PolarHBondContact O-N 3.22Å; M206-G209 CarbonylContact O-C 3.02Å; M206-G209 WeakPolarHBondContact O-CA 3.45Å; M206-G209 PolarHBondContact O-N 3.38Å; M206-G209 VanDerWaalsContact O-N 3.11Å; M206-L210 WeakPolarHBondContact O-CG 3.42Å; M206-L210 PolarHBondContact O-N 3.09Å |
| 207 | V | 95.9 | Very high | 93.1 | Very high | 56 Ų | 56 | 58.8 Ų | 58.8 | 34% | 0.339 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -60.8 | -44.2 | 176.9 | 170.1 | 0 | 0 | 0 | 0 | 110.9 | F98 G203 V204 G209 L210 I211 | F98-V207 HydrophobicContact CE2-CG2 3.93Å; F98-V207 HydrophobicContact CZ-CG2 3.99Å; G203-V207 WeakPolarHBondContact O-CG2 3.42Å; G203-V207 PolarHBondContact O-N 3.36Å; V204-V207 PolarHBondContact O-N 3.18Å; V207-G209 VanDerWaalsContact C-N 3.32Å; V207-G209 PolarHBondContact O-N 3.03Å; V207-L210 PolarHBondContact O-N 3.47Å; V207-I211 HydrophobicContact CG1-CD1 3.85Å; V207-I211 VanDerWaalsContact O-CG1 3.3Å; V207-I211 WeakPolarHBondContact O-CG1 3.39Å; V207-I211 PolarHBondContact O-N 3.47Å |
| 208 | F | 93.9 | Very high | 93.1 | Very high | 107 Ų | 107 | 60.7 Ų | 60.7 | 47% | 0.469 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -60.7 | -42.6 | 172.8 | -81.5 | -68.2 | 0 | 0 | 0 | 112 | V204 I205 M206 L210 I211 F212 | V204-F208 HydrophobicContact CG1-CD2 3.77Å; V204-F208 HydrophobicContact CG1-CE2 3.59Å; V204-F208 VanDerWaalsContact O-CD2 3.23Å; V204-F208 WeakPolarHBondContact O-CD2 3.35Å; V204-F208 PolarHBondContact O-N 3.33Å; I205-F208 PolarHBondContact O-N 2.94Å; M206-F208 VanDerWaalsContact C-N 3.34Å; M206-F208 PolarHBondContact O-N 3.22Å; F208-L210 VanDerWaalsContact C-N 3.35Å; F208-L210 PolarHBondContact O-N 3.39Å; F208-I211 PolarHBondContact O-N 3.23Å; F208-F212 HydrophobicContact CB-CD2 4.28Å; F208-F212 HydrophobicContact CB-CE2 3.95Å; F208-F212 HydrophobicContact CD1-CE1 4.42Å; F208-F212 HydrophobicContact CD1-CE2 4.08Å; F208-F212 AromaticContact CD1-CZ 3.8Å; F208-F212 HydrophobicContact CD1-CZ 3.8Å; F208-F212 HydrophobicContact CG-CE2 4.4Å; F208-F212 WeakPolarHBondContact O-CB 3.46Å; F208-F212 WeakPolarHBondContact O-CD2 3.46Å; F208-F212 WeakPolarHBondContact O-CG 3.42Å; F208-F212 PolarHBondContact O-N 2.66Å |
| 209 | G | 92.9 | Very high | 92.9 | Very high | 21 Ų | 21 | 56.8 Ų | 56.8 | 22% | 0.216 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -54.8 | -47.5 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | I205 M206 V207 T213 | I205-G209 PolarHBondContact O-N 3.44Å; M206-G209 CarbonylContact O-C 3.02Å; M206-G209 WeakPolarHBondContact O-CA 3.45Å; M206-G209 PolarHBondContact O-N 3.38Å; M206-G209 VanDerWaalsContact O-N 3.11Å; V207-G209 VanDerWaalsContact C-N 3.32Å; V207-G209 PolarHBondContact O-N 3.03Å; G209-T213 VanDerWaalsContact O-CB 3.22Å; G209-T213 WeakPolarHBondContact O-CB 3.22Å; G209-T213 PolarHBondContact O-N 3.24Å; G209-T213 PolarHBondContact O-OG1 3.38Å |
| 210 | L | 95.4 | Very high | 92.7 | Very high | 20 Ų | 20 | 55.7 Ų | 55.7 | 11% | 0.105 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -61.3 | -47.7 | 177.3 | -71.2 | 168.6 | 0 | 0 | 0 | 112 | F91 L94 L95 M206 V207 F208 T213 M214 | F91-L210 HydrophobicContact CD2-CB 4.46Å; F91-L210 HydrophobicContact CD2-CD2 3.59Å; F91-L210 HydrophobicContact CE2-CB 4.04Å; F91-L210 HydrophobicContact CE2-CD2 3.56Å; F91-L210 HydrophobicContact CE2-CG 4.42Å; F91-L210 HydrophobicContact CG-CD2 4.26Å; F91-L210 HydrophobicContact CZ-CD2 4.22Å; L94-L210 HydrophobicContact CB-CD2 3.52Å; L94-L210 HydrophobicContact CB-CG 4.12Å; L94-L210 HydrophobicContact CD1-CD2 4.31Å; L94-L210 HydrophobicContact CD1-CG 4.47Å; L95-L210 HydrophobicContact CD2-CD1 3.78Å; L95-L210 HydrophobicContact CD2-CD2 3.77Å; L95-L210 HydrophobicContact CD2-CG 4.44Å; L95-L210 HydrophobicContact CG-CD2 3.74Å; M206-L210 WeakPolarHBondContact O-CG 3.42Å; M206-L210 PolarHBondContact O-N 3.09Å; V207-L210 PolarHBondContact O-N 3.47Å; F208-L210 VanDerWaalsContact C-N 3.35Å; F208-L210 PolarHBondContact O-N 3.39Å; L210-T213 PolarHBondContact O-N 2.8Å; L210-M214 WeakPolarHBondContact O-CB 3.35Å; L210-M214 PolarHBondContact O-N 3.29Å |
| 211 | I | 94.4 | Very high | 92.3 | Very high | 82 Ų | 82 | 57 Ų | 57 | 42% | 0.421 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -61.1 | -51.5 | 179.3 | -66.8 | 165.7 | 0 | 0 | 0 | 110.2 | V207 F208 T213 M214 L215 | V207-I211 HydrophobicContact CG1-CD1 3.85Å; V207-I211 VanDerWaalsContact O-CG1 3.3Å; V207-I211 WeakPolarHBondContact O-CG1 3.39Å; V207-I211 PolarHBondContact O-N 3.47Å; F208-I211 PolarHBondContact O-N 3.23Å; I211-T213 VanDerWaalsContact C-N 3.32Å; I211-T213 PolarHBondContact O-N 3.23Å; I211-M214 PolarHBondContact O-N 2.83Å; I211-L215 HydrophobicContact CG2-CD1 3.93Å; I211-L215 HydrophobicContact CG2-CG 4.36Å; I211-L215 VanDerWaalsContact O-CG 3.3Å; I211-L215 WeakPolarHBondContact O-CG 3.29Å; I211-L215 PolarHBondContact O-N 2.66Å |
| 212 | F | 92.4 | Very high | 91.9 | Very high | 78 Ų | 78 | 60.3 Ų | 60.3 | 34% | 0.342 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -64 | -37.9 | -177.7 | -66.8 | -27.8 | 0 | 0 | 0 | 112.5 | L10 I14 F208 L215 L216 | L10-F212 HydrophobicContact CD1-CB 3.92Å; L10-F212 HydrophobicContact CD1-CD1 3.58Å; L10-F212 HydrophobicContact CD1-CD2 4.19Å; L10-F212 HydrophobicContact CD1-CE1 4.08Å; L10-F212 HydrophobicContact CD1-CG 3.65Å; I14-F212 HydrophobicContact CD1-CB 3.96Å; I14-F212 HydrophobicContact CG1-CB 4.25Å; F208-F212 HydrophobicContact CB-CD2 4.28Å; F208-F212 HydrophobicContact CB-CE2 3.95Å; F208-F212 HydrophobicContact CD1-CE1 4.42Å; F208-F212 HydrophobicContact CD1-CE2 4.08Å; F208-F212 AromaticContact CD1-CZ 3.8Å; F208-F212 HydrophobicContact CD1-CZ 3.8Å; F208-F212 HydrophobicContact CG-CE2 4.4Å; F208-F212 WeakPolarHBondContact O-CB 3.46Å; F208-F212 WeakPolarHBondContact O-CD2 3.46Å; F208-F212 WeakPolarHBondContact O-CG 3.42Å; F208-F212 PolarHBondContact O-N 2.66Å; F212-L215 HydrophobicContact CD1-CD1 4.5Å; F212-L215 PolarHBondContact O-N 3.28Å; F212-L216 WeakPolarHBondContact O-CB 3.15Å; F212-L216 PolarHBondContact O-N 2.94Å |
| 213 | T | 91.9 | Very high | 91.3 | Very high | 2 Ų | 2 | 59.1 Ų | 59.1 | 1% | 0.012 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -63.3 | -46 | 174.5 | -59.1 | 0 | 0 | 0 | 0 | 111.6 | L87 F90 F91 G209 L210 I211 L216 C217 | L87-T213 HydrophobicContact CD2-CG2 4.41Å; L87-T213 HydrophobicContact CG-CG2 3.91Å; L87-T213 WeakPolarHBondContact O-CG2 3.45Å; F90-T213 HydrophobicContact CD1-CG2 3.69Å; F90-T213 WeakPolarHBondContact CD1-OG1 3.47Å; F90-T213 HydrophobicContact CE1-CG2 4.29Å; F90-T213 WeakPolarHBondContact CE1-OG1 3.41Å; F91-T213 HydrophobicContact CB-CG2 3.86Å; F91-T213 HydrophobicContact CD2-CG2 4.29Å; G209-T213 VanDerWaalsContact O-CB 3.22Å; G209-T213 WeakPolarHBondContact O-CB 3.22Å; G209-T213 PolarHBondContact O-N 3.24Å; G209-T213 PolarHBondContact O-OG1 3.38Å; L210-T213 PolarHBondContact O-N 2.8Å; I211-T213 VanDerWaalsContact C-N 3.32Å; I211-T213 PolarHBondContact O-N 3.23Å; T213-L216 PolarHBondContact O-N 3.22Å; T213-C217 WeakPolarHBondContact O-CB 3.45Å; T213-C217 PolarHBondContact O-N 3.42Å |
| 214 | M | 92 | Very high | 90.4 | Very high | 113 Ų | 113 | 66.9 Ų | 66.9 | 56% | 0.557 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -62.9 | -46.3 | 178 | -173.4 | -177.4 | -179.8 | 0 | 0 | 111.2 | F91 L210 I211 L216 C217 C218 | F91-M214 HydrophobicContact CE2-CB 4.39Å; L210-M214 WeakPolarHBondContact O-CB 3.35Å; L210-M214 PolarHBondContact O-N 3.29Å; I211-M214 PolarHBondContact O-N 2.83Å; M214-L216 PolarHBondContact O-N 3.13Å; M214-C217 PolarHBondContact O-N 3.25Å; M214-C218 WeakPolarHBondContact O-CB 3.05Å; M214-C218 PolarHBondContact O-N 3.21Å; M214-C218 PolarHBondContact O-SG 2.76Å; M214-C218 VanDerWaalsContact O-SG 3.33Å |
| 215 | L | 91.3 | Very high | 89.5 | Confident | 97 Ų | 97 | 70.3 Ų | 70.3 | 51% | 0.508 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -59.2 | -45.2 | 177.3 | -70.2 | 175.8 | 0 | 0 | 0 | 111.9 | L10 I211 F212 A219 | L10-L215 HydrophobicContact CD2-CB 4.26Å; I211-L215 HydrophobicContact CG2-CD1 3.93Å; I211-L215 HydrophobicContact CG2-CG 4.36Å; I211-L215 VanDerWaalsContact O-CG 3.3Å; I211-L215 WeakPolarHBondContact O-CG 3.29Å; I211-L215 PolarHBondContact O-N 2.66Å; F212-L215 HydrophobicContact CD1-CD1 4.5Å; F212-L215 PolarHBondContact O-N 3.28Å; L215-A219 WeakPolarHBondContact O-CB 3.06Å; L215-A219 PolarHBondContact O-N 2.97Å |
| 216 | L | 89.9 | Confident | 88.3 | Confident | 2 Ų | 2 | 71 Ų | 71 | 1% | 0.01 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -66.1 | -41.6 | 177.8 | -175.7 | 64.9 | 0 | 0 | 0 | 111.3 | I7 K11 I14 A79 L87 F212 T213 M214 A219 I220 | I7-L216 HydrophobicContact CG2-CD1 4.01Å; K11-L216 HydrophobicContact CB-CD1 4.26Å; I14-L216 HydrophobicContact CD1-CB 4.2Å; I14-L216 HydrophobicContact CD1-CD2 3.81Å; A79-L216 HydrophobicContact CB-CD2 4.18Å; L87-L216 HydrophobicContact CD1-CD2 4.25Å; L87-L216 HydrophobicContact CD2-CB 3.95Å; L87-L216 HydrophobicContact CD2-CD2 3.95Å; L87-L216 HydrophobicContact CD2-CG 3.87Å; F212-L216 WeakPolarHBondContact O-CB 3.15Å; F212-L216 PolarHBondContact O-N 2.94Å; T213-L216 PolarHBondContact O-N 3.22Å; M214-L216 PolarHBondContact O-N 3.13Å; L216-A219 PolarHBondContact O-N 3.07Å; L216-I220 HydrophobicContact CD1-CD1 4.21Å; L216-I220 HydrophobicContact CD1-CG1 4.47Å; L216-I220 HydrophobicContact CG-CD1 3.88Å; L216-I220 WeakPolarHBondContact O-CD1 3.31Å; L216-I220 VanDerWaalsContact O-CG1 3.26Å; L216-I220 WeakPolarHBondContact O-CG1 3.49Å; L216-I220 PolarHBondContact O-N 2.85Å |
| 217 | C | 89.3 | Confident | 86.3 | Confident | 27 Ų | 27 | 78 Ų | 78 | 18% | 0.182 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -60.7 | -48.2 | 176.7 | -165.9 | 0 | 0 | 0 | 0 | 111.7 | L87 T213 M214 A219 I220 R221 | L87-C217 HydrophobicContact CD2-CB 3.87Å; T213-C217 WeakPolarHBondContact O-CB 3.45Å; T213-C217 PolarHBondContact O-N 3.42Å; M214-C217 PolarHBondContact O-N 3.25Å; C217-A219 VanDerWaalsContact C-N 3.34Å; C217-A219 PolarHBondContact O-N 2.89Å; C217-I220 PolarHBondContact O-N 2.77Å; C217-R221 WeakPolarHBondContact O-CG 3.4Å; C217-R221 PolarHBondContact O-N 3.5Å |
| 218 | C | 89.3 | Confident | 85.8 | Confident | 70 Ų | 70 | 79.1 Ų | 79.1 | 47% | 0.473 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -61.5 | -41.8 | 177.2 | -71.6 | 0 | 0 | 0 | 0 | 111.8 | M214 R221 K222 | M214-C218 WeakPolarHBondContact O-CB 3.05Å; M214-C218 PolarHBondContact O-N 3.21Å; M214-C218 PolarHBondContact O-SG 2.76Å; M214-C218 VanDerWaalsContact O-SG 3.33Å; C218-R221 PolarHBondContact O-N 2.9Å; C218-K222 VanDerWaalsContact O-CB 3.31Å; C218-K222 WeakPolarHBondContact O-CB 3.49Å; C218-K222 PolarHBondContact O-N 2.91Å |
| 219 | A | 87.6 | Confident | 85.4 | Confident | 20 Ų | 20 | 77.6 Ų | 77.6 | 17% | 0.165 | 40% | 0.397 | C | S | . | . | H | α-helix | trans | -63 | -44.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | I7 L215 L216 C217 S223 | I7-A219 HydrophobicContact CD1-CB 3.76Å; I7-A219 HydrophobicContact CG2-CB 3.99Å; L215-A219 WeakPolarHBondContact O-CB 3.06Å; L215-A219 PolarHBondContact O-N 2.97Å; L216-A219 PolarHBondContact O-N 3.07Å; C217-A219 VanDerWaalsContact C-N 3.34Å; C217-A219 PolarHBondContact O-N 2.89Å; A219-S223 WeakPolarHBondContact O-CB 3.16Å; A219-S223 PolarHBondContact O-N 3.12Å |
| 220 | I | 86.8 | Confident | 85 | Confident | 7 Ų | 7 | 80.7 Ų | 80.7 | 4% | 0.036 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -63.6 | -49.1 | 177.2 | -69.3 | 163.9 | 0 | 0 | 0 | 110.5 | E82 L87 L216 C217 K222 S223 R224 | E82-I220 HydrophobicContact CB-CD1 3.95Å; E82-I220 HydrophobicContact CB-CG1 4.17Å; E82-I220 HydrophobicContact CB-CG2 4.29Å; E82-I220 HydrophobicContact CG-CD1 4.28Å; E82-I220 HydrophobicContact CG-CG1 4.44Å; E82-I220 WeakPolarHBondContact O-CG2 3.49Å; L87-I220 HydrophobicContact CD2-CD1 4.25Å; L216-I220 HydrophobicContact CD1-CD1 4.21Å; L216-I220 HydrophobicContact CD1-CG1 4.47Å; L216-I220 HydrophobicContact CG-CD1 3.88Å; L216-I220 WeakPolarHBondContact O-CD1 3.31Å; L216-I220 VanDerWaalsContact O-CG1 3.26Å; L216-I220 WeakPolarHBondContact O-CG1 3.49Å; L216-I220 PolarHBondContact O-N 2.85Å; C217-I220 PolarHBondContact O-N 2.77Å; I220-K222 PolarHBondContact O-N 3.33Å; I220-S223 PolarHBondContact O-N 3.3Å; I220-S223 VanDerWaalsContact O-N 3.12Å; I220-S223 PolarHBondContact O-OG 3.32Å; I220-R224 PolarHBondContact O-N 3.46Å; I220-R224 VanDerWaalsContact O-N 3.11Å |
| 221 | R | 86.4 | Confident | 84.4 | Confident | 149 Ų | 149 | 84.3 Ų | 84.3 | 56% | 0.562 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -59 | -47.4 | 179.1 | -74.1 | -175.3 | 71.3 | 174.2 | 2.9 | 111.7 | P84 C217 C218 S223 R224 E225 | P84-R221 HydrophobicContact CB-CG 4.4Å; C217-R221 WeakPolarHBondContact O-CG 3.4Å; C217-R221 PolarHBondContact O-N 3.5Å; C218-R221 PolarHBondContact O-N 2.9Å; R221-S223 VanDerWaalsContact C-N 3.27Å; R221-S223 PolarHBondContact O-N 3.12Å; R221-R224 PolarHBondContact O-N 3.22Å; R221-E225 PolarHBondContact O-N 3.49Å; R221-E225 VanDerWaalsContact O-N 3.09Å |
| 222 | K | 86.4 | Confident | 83.7 | Confident | 151 Ų | 151 | 84.4 Ų | 84.4 | 66% | 0.657 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -59.3 | -38.1 | 176.2 | -173.8 | 173.5 | -177.7 | 175.2 | 0 | 112.2 | C218 I220 R224 V226 | C218-K222 VanDerWaalsContact O-CB 3.31Å; C218-K222 WeakPolarHBondContact O-CB 3.49Å; C218-K222 PolarHBondContact O-N 2.91Å; I220-K222 PolarHBondContact O-N 3.33Å; K222-R224 VanDerWaalsContact C-N 3.29Å; K222-R224 PolarHBondContact O-N 2.85Å; K222-V226 VanDerWaalsContact O-CG2 3.29Å; K222-V226 WeakPolarHBondContact O-CG2 2.99Å |
| 223 | S | 81.2 | Confident | 83.2 | Confident | 47 Ų | 47 | 84.9 Ų | 84.9 | 33% | 0.329 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -68 | -27.5 | 177.5 | 75 | 0 | 0 | 0 | 0 | 113.6 | A219 I220 R221 | A219-S223 WeakPolarHBondContact O-CB 3.16Å; A219-S223 PolarHBondContact O-N 3.12Å; I220-S223 PolarHBondContact O-N 3.3Å; I220-S223 VanDerWaalsContact O-N 3.12Å; I220-S223 PolarHBondContact O-OG 3.32Å; R221-S223 VanDerWaalsContact C-N 3.27Å; R221-S223 PolarHBondContact O-N 3.12Å |
| 224 | R | 77.9 | Confident | 82.5 | Confident | 173 Ų | 173 | 90.8 Ų | 90.8 | 65% | 0.653 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -82.3 | -32 | 178.1 | -171.8 | -178.7 | -82.3 | -165.4 | -4.2 | 112.8 | I220 R221 K222 V226 V227 | I220-R224 PolarHBondContact O-N 3.46Å; I220-R224 VanDerWaalsContact O-N 3.11Å; R221-R224 PolarHBondContact O-N 3.22Å; K222-R224 VanDerWaalsContact C-N 3.29Å; K222-R224 PolarHBondContact O-N 2.85Å; R224-V226 VanDerWaalsContact C-N 3.26Å; R224-V226 PolarHBondContact O-N 2.76Å; R224-V227 PolarHBondContact O-N 2.9Å |
| 225 | E | 76.6 | Confident | 81.8 | Confident | 144 Ų | 144 | 89.1 Ų | 89.1 | 67% | 0.673 | 45% | 0.453 | S | S | * | . | H | α-helix | trans | -72.8 | -17 | 177.7 | -71 | 174.3 | -173.7 | 0 | 0 | 113.7 | R221 | R221-E225 PolarHBondContact O-N 3.49Å; R221-E225 VanDerWaalsContact O-N 3.09Å |
| 226 | V | 68.2 | Low | 81 | Confident | 93 Ų | 93 | 88.4 Ų | 88.4 | 56% | 0.564 | 45% | 0.449 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -91.2 | -2.1 | -179.8 | 178 | 0 | 0 | 0 | 0 | 112.2 | M1 K222 R224 | M1-V226 HydrophobicContact CE-CG1 4.29Å; M1-V226 HydrophobicContact SD-CG1 4.01Å; K222-V226 VanDerWaalsContact O-CG2 3.29Å; K222-V226 WeakPolarHBondContact O-CG2 2.99Å; R224-V226 VanDerWaalsContact C-N 3.26Å; R224-V226 PolarHBondContact O-N 2.76Å |
| 227 | V | 52.8 | Low | 80.2 | Confident | 178 Ų | 178 | 96.3 Ų | 96.3 | 100% | 1.079 | 49% | 0.488 | S | S | * | . | trans | -108.5 | 0 | 177.8 | 179.3 | 0 | 0 | 0 | 0 | 109.5 | R224 | R224-V227 PolarHBondContact O-N 2.9Š|
Retrieved 227 of 227 residues in 79.1 ms
(Link to these results)