| 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 | 54.2 | Low | 61.1 | Low | 174 Ų | 174 | 111.5 Ų | 111.5 | 86% | 0.857 | 58% | 0.584 | S | S | * | * | 0 | -84 | 0 | -125.1 | 176.6 | -77.1 | 0 | 0 | 112.8 | L3 E4 E5 | M1-L3 VanDerWaalsContact C-N 3.34Å; M1-L3 PolarHBondContact O-N 3.33Å; M1-E4 PolarHBondContact N-OE2 2.69Å; M1-E4 PolarHBondContact O-N 3.28Å; M1-E5 PolarHBondContact O-N 3.33Å | |||
| 2 | R | 59.4 | Low | 61.2 | Low | 204 Ų | 204 | 105.2 Ų | 105.2 | 77% | 0.77 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -65.2 | -30.1 | -174.1 | -150.8 | -178 | -72.2 | 176.8 | -2.2 | 114.9 | M6 | R2-M6 WeakPolarHBondContact O-CG 3.45Å; R2-M6 PolarHBondContact O-N 3.31Å |
| 3 | L | 63.7 | Low | 61.6 | Low | 138 Ų | 138 | 111.2 Ų | 111.2 | 72% | 0.723 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -75.7 | -31 | 172.9 | -63.1 | -164.5 | 0 | 0 | 0 | 113 | M1 M6 A7 | M1-L3 VanDerWaalsContact C-N 3.34Å; M1-L3 PolarHBondContact O-N 3.33Å; L3-M6 HydrophobicContact CD2-CE 3.34Å; L3-A7 PolarHBondContact O-N 3.37Å; L3-A7 VanDerWaalsContact O-N 3.11Å |
| 4 | E | 65.8 | Low | 62.2 | Low | 134 Ų | 134 | 108.2 Ų | 108.2 | 63% | 0.626 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -74.4 | -39.5 | 177.3 | -71.8 | 167 | 129.9 | 0 | 0 | 110.8 | M1 M6 A7 V8 | M1-E4 PolarHBondContact N-OE2 2.69Å; M1-E4 PolarHBondContact O-N 3.28Å; E4-M6 VanDerWaalsContact C-N 3.33Å; E4-M6 PolarHBondContact O-N 3.23Å; E4-A7 PolarHBondContact O-N 2.61Å; E4-A7 VanDerWaalsContact O-N 3.12Å; E4-V8 VanDerWaalsContact O-CG2 3.27Å; E4-V8 WeakPolarHBondContact O-CG2 3.15Å; E4-V8 PolarHBondContact O-N 3.43Å |
| 5 | E | 61.7 | Low | 63.4 | Low | 114 Ų | 114 | 105.3 Ų | 105.3 | 53% | 0.533 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -58.7 | -45.7 | 173.1 | -75.1 | 175.3 | 156.4 | 0 | 0 | 111.1 | M1 A7 V8 D9 | M1-E5 PolarHBondContact O-N 3.33Å; E5-A7 VanDerWaalsContact C-N 3.29Å; E5-A7 PolarHBondContact O-N 2.92Å; E5-V8 PolarHBondContact O-N 3.04Å; E5-D9 PolarHBondContact O-N 3.06Å |
| 6 | M | 56.8 | Low | 64.3 | Low | 114 Ų | 114 | 104.6 Ų | 104.6 | 56% | 0.562 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -64.3 | -31.7 | 175.7 | -69.2 | -170.5 | -55.1 | 0 | 0 | 113.2 | R2 L3 E4 A10 | R2-M6 WeakPolarHBondContact O-CG 3.45Å; R2-M6 PolarHBondContact O-N 3.31Å; L3-M6 HydrophobicContact CD2-CE 3.34Å; E4-M6 VanDerWaalsContact C-N 3.33Å; E4-M6 PolarHBondContact O-N 3.23Å; M6-A10 WeakPolarHBondContact O-CB 3.5Å; M6-A10 PolarHBondContact O-N 3.16Å; M6-A10 VanDerWaalsContact O-N 3.16Å |
| 7 | A | 64 | Low | 65.3 | Low | 60 Ų | 60 | 103.5 Ų | 103.5 | 50% | 0.496 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -73 | -38.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112 | L3 E4 E5 A10 A11 | L3-A7 PolarHBondContact O-N 3.37Å; L3-A7 VanDerWaalsContact O-N 3.11Å; E4-A7 PolarHBondContact O-N 2.61Å; E4-A7 VanDerWaalsContact O-N 3.12Å; E5-A7 VanDerWaalsContact C-N 3.29Å; E5-A7 PolarHBondContact O-N 2.92Å; A7-A10 PolarHBondContact O-N 3.22Å; A7-A11 WeakPolarHBondContact O-CB 3.45Å; A7-A11 PolarHBondContact O-N 2.86Å |
| 8 | V | 66.3 | Low | 66.3 | Low | 99 Ų | 99 | 102.5 Ų | 102.5 | 60% | 0.6 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -66.4 | -41.7 | 176.3 | 172 | 0 | 0 | 0 | 0 | 111 | E4 E5 A10 A11 S12 | E4-V8 VanDerWaalsContact O-CG2 3.27Å; E4-V8 WeakPolarHBondContact O-CG2 3.15Å; E4-V8 PolarHBondContact O-N 3.43Å; E5-V8 PolarHBondContact O-N 3.04Å; V8-A10 VanDerWaalsContact C-N 3.33Å; V8-A10 PolarHBondContact O-N 3.13Å; V8-A11 WeakPolarHBondContact O-CB 3.38Å; V8-A11 PolarHBondContact O-N 2.92Å; V8-S12 PolarHBondContact O-N 3.21Å |
| 9 | D | 56.3 | Low | 66.9 | Low | 104 Ų | 104 | 101.1 Ų | 101.1 | 56% | 0.556 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -64.4 | -39 | 175.9 | -71.9 | -27.7 | 0 | 0 | 0 | 111.5 | E5 S12 F13 | E5-D9 PolarHBondContact O-N 3.06Å; D9-S12 WeakPolarHBondContact O-CB 3.36Å; D9-S12 PolarHBondContact O-N 3.06Å; D9-S12 PolarHBondContact O-OG 3.18Å; D9-F13 WeakPolarHBondContact O-CD2 3.48Å |
| 10 | A | 62.5 | Low | 67.7 | Low | 56 Ų | 56 | 97.5 Ų | 97.5 | 46% | 0.463 | 51% | 0.508 | S | S | . | . | H | α-helix | trans | -64.2 | -41.2 | 173.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | M6 A7 V8 S12 F13 L14 | M6-A10 WeakPolarHBondContact O-CB 3.5Å; M6-A10 PolarHBondContact O-N 3.16Å; M6-A10 VanDerWaalsContact O-N 3.16Å; A7-A10 PolarHBondContact O-N 3.22Å; V8-A10 VanDerWaalsContact C-N 3.33Å; V8-A10 PolarHBondContact O-N 3.13Å; A10-S12 PolarHBondContact O-N 2.87Å; A10-F13 PolarHBondContact O-N 3.47Å; A10-L14 WeakPolarHBondContact O-CD1 3.19Å |
| 11 | A | 61.5 | Low | 68.6 | Low | 29 Ų | 29 | 94.5 Ų | 94.5 | 24% | 0.24 | 50% | 0.501 | C | S | . | . | H | α-helix | trans | -60.9 | -26.6 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.3 | A7 V8 F13 L14 R19 | A7-A11 WeakPolarHBondContact O-CB 3.45Å; A7-A11 PolarHBondContact O-N 2.86Å; V8-A11 WeakPolarHBondContact O-CB 3.38Å; V8-A11 PolarHBondContact O-N 2.92Å; A11-F13 VanDerWaalsContact C-N 3.27Å; A11-F13 PolarHBondContact O-N 2.84Å; A11-L14 PolarHBondContact O-N 2.86Å; A11-R19 WeakPolarHBondContact O-CD 3.27Å; A11-R19 VanDerWaalsContact O-CG 3.31Å; A11-R19 WeakPolarHBondContact O-CG 3.43Å |
| 12 | S | 62.3 | Low | 70 | Confident | 36 Ų | 36 | 90.2 Ų | 90.2 | 25% | 0.252 | 48% | 0.482 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -66.8 | -25.2 | -179.8 | 77.6 | 0 | 0 | 0 | 0 | 114 | V8 D9 A10 | V8-S12 PolarHBondContact O-N 3.21Å; D9-S12 WeakPolarHBondContact O-CB 3.36Å; D9-S12 PolarHBondContact O-N 3.06Å; D9-S12 PolarHBondContact O-OG 3.18Å; A10-S12 PolarHBondContact O-N 2.87Å |
| 13 | F | 66.2 | Low | 71.2 | Confident | 184 Ų | 184 | 83.6 Ų | 83.6 | 81% | 0.807 | 47% | 0.471 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -88.5 | -5.9 | 179.5 | -66.2 | -77.5 | 0 | 0 | 0 | 113.9 | D9 A10 A11 | D9-F13 WeakPolarHBondContact O-CD2 3.48Å; A10-F13 PolarHBondContact O-N 3.47Å; A11-F13 VanDerWaalsContact C-N 3.27Å; A11-F13 PolarHBondContact O-N 2.84Å |
| 14 | L | 70.3 | Confident | 72.2 | Confident | 69 Ų | 69 | 78.5 Ų | 78.5 | 36% | 0.361 | 44% | 0.443 | S | S | . | . | S | Bend | trans | -76.2 | 153.9 | -177.5 | -91.5 | 77.2 | 0 | 0 | 0 | 112 | A10 A11 D18 R19 | A10-L14 WeakPolarHBondContact O-CD1 3.19Å; A11-L14 PolarHBondContact O-N 2.86Å; L14-D18 HydrophobicContact CB-CB 4.01Å; L14-D18 HydrophobicContact CD2-CB 3.56Å; L14-D18 HydrophobicContact CG-CB 4.17Å; L14-R19 HydrophobicContact CB-CG 3.86Å; L14-R19 WeakPolarHBondContact O-CD 3.45Å |
| 15 | S | 80.7 | Confident | 73.4 | Confident | 65 Ų | 65 | 75.4 Ų | 75.4 | 46% | 0.455 | 44% | 0.437 | S | S | . | . | trans | -57.9 | 154.3 | 174 | -162.2 | 0 | 0 | 0 | 0 | 110 | E17 D18 R19 | S15-E17 WeakPolarHBondContact CB-OE2 3.45Å; S15-E17 PolarHBondContact O-N 3.11Å; S15-E17 VanDerWaalsContact O-N 3.13Å; S15-E17 PolarHBondContact OG-OE2 2.94Å; S15-D18 PolarHBondContact O-N 2.94Å; S15-R19 PolarHBondContact O-N 3.25Å | ||
| 16 | V | 77.5 | Confident | 74.7 | Confident | 94 Ų | 94 | 76.8 Ų | 76.8 | 57% | 0.57 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -53.9 | -37.9 | -178.9 | 176.4 | 0 | 0 | 0 | 0 | 111 | I20 | V16-I20 HydrophobicContact CG1-CD1 3.77Å; V16-I20 HydrophobicContact CG1-CG1 4.45Å; V16-I20 WeakPolarHBondContact O-CB 3.49Å; V16-I20 WeakPolarHBondContact O-CD1 3.4Å; V16-I20 WeakPolarHBondContact O-CG1 3.31Å; V16-I20 PolarHBondContact O-N 3.12Å |
| 17 | E | 81 | Confident | 76.3 | Confident | 86 Ų | 86 | 73.5 Ų | 73.5 | 40% | 0.402 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -63.4 | -44.5 | 177.9 | -63.3 | 76.5 | -168 | 0 | 0 | 113 | S15 I20 G21 | S15-E17 WeakPolarHBondContact CB-OE2 3.45Å; S15-E17 PolarHBondContact O-N 3.11Å; S15-E17 VanDerWaalsContact O-N 3.13Å; S15-E17 PolarHBondContact OG-OE2 2.94Å; E17-I20 PolarHBondContact O-N 3.34Å; E17-G21 PolarHBondContact O-N 3.44Å |
| 18 | D | 83.5 | Confident | 77.6 | Confident | 85 Ų | 85 | 71.5 Ų | 71.5 | 46% | 0.455 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -70.8 | -38.4 | -178.3 | -56.5 | -35.7 | 0 | 0 | 0 | 110.6 | L14 S15 I20 G21 D22 | L14-D18 HydrophobicContact CB-CB 4.01Å; L14-D18 HydrophobicContact CD2-CB 3.56Å; L14-D18 HydrophobicContact CG-CB 4.17Å; S15-D18 PolarHBondContact O-N 2.94Å; D18-I20 VanDerWaalsContact C-N 3.34Å; D18-I20 PolarHBondContact O-N 3.25Å; D18-G21 WeakPolarHBondContact O-CA 3.37Å; D18-G21 PolarHBondContact O-N 3.07Å; D18-G21 VanDerWaalsContact O-N 3.12Å; D18-D22 PolarHBondContact O-N 3.05Å |
| 19 | R | 78.1 | Confident | 78.8 | Confident | 76 Ų | 76 | 69 Ų | 69 | 29% | 0.287 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -62.5 | -40.5 | 175 | -68.5 | -179.2 | 60.9 | -161.3 | -4.1 | 112.7 | A11 L14 S15 G21 A23 L109 | A11-R19 WeakPolarHBondContact O-CD 3.27Å; A11-R19 VanDerWaalsContact O-CG 3.31Å; A11-R19 WeakPolarHBondContact O-CG 3.43Å; L14-R19 HydrophobicContact CB-CG 3.86Å; L14-R19 WeakPolarHBondContact O-CD 3.45Å; S15-R19 PolarHBondContact O-N 3.25Å; R19-G21 VanDerWaalsContact C-N 3.33Å; R19-A23 WeakPolarHBondContact O-CB 3.42Å; R19-A23 PolarHBondContact O-N 3.36Å; R19-A23 VanDerWaalsContact O-N 3.14Å; R19-L109 VanDerWaalsContact NH2-CD1 3.34Å |
| 20 | I | 81.6 | Confident | 80.6 | Confident | 28 Ų | 28 | 67.5 Ų | 67.5 | 14% | 0.144 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -65.3 | -42.4 | 173.8 | -69.7 | 168.6 | 0 | 0 | 0 | 109.7 | V16 E17 D18 A23 M24 L83 | V16-I20 HydrophobicContact CG1-CD1 3.77Å; V16-I20 HydrophobicContact CG1-CG1 4.45Å; V16-I20 WeakPolarHBondContact O-CB 3.49Å; V16-I20 WeakPolarHBondContact O-CD1 3.4Å; V16-I20 WeakPolarHBondContact O-CG1 3.31Å; V16-I20 PolarHBondContact O-N 3.12Å; E17-I20 PolarHBondContact O-N 3.34Å; D18-I20 VanDerWaalsContact C-N 3.34Å; D18-I20 PolarHBondContact O-N 3.25Å; I20-A23 PolarHBondContact O-N 3.38Å; I20-M24 HydrophobicContact CG2-CE 3.51Å; I20-M24 HydrophobicContact CG2-CG 4.17Å; I20-M24 HydrophobicContact CG2-SD 3.65Å; I20-M24 WeakPolarHBondContact O-CB 3.2Å; I20-M24 WeakPolarHBondContact O-CG 3.45Å; I20-M24 PolarHBondContact O-N 2.95Å; I20-L83 HydrophobicContact CB-CD1 4.33Å; I20-L83 HydrophobicContact CD1-CB 3.76Å; I20-L83 HydrophobicContact CD1-CD1 4.04Å; I20-L83 HydrophobicContact CG1-CD1 3.91Å; I20-L83 HydrophobicContact CG2-CD1 3.51Å |
| 21 | G | 86.4 | Confident | 82 | Confident | 36 Ų | 36 | 67.4 Ų | 67.4 | 37% | 0.371 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -57.8 | -47.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.8 | E17 D18 R19 M24 S25 | E17-G21 PolarHBondContact O-N 3.44Å; D18-G21 WeakPolarHBondContact O-CA 3.37Å; D18-G21 PolarHBondContact O-N 3.07Å; D18-G21 VanDerWaalsContact O-N 3.12Å; R19-G21 VanDerWaalsContact C-N 3.33Å; G21-M24 PolarHBondContact O-N 3.12Å; G21-S25 WeakPolarHBondContact O-CB 3.46Å; G21-S25 PolarHBondContact O-N 3.44Å |
| 22 | D | 85 | Confident | 83.6 | Confident | 83 Ų | 83 | 68.2 Ų | 68.2 | 44% | 0.444 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -62.9 | -49.1 | 178.3 | -73.3 | -15.1 | 0 | 0 | 0 | 111.4 | D18 M24 S25 E26 | D18-D22 PolarHBondContact O-N 3.05Å; D22-M24 VanDerWaalsContact C-N 3.3Å; D22-M24 PolarHBondContact O-N 2.88Å; D22-S25 PolarHBondContact O-N 2.91Å; D22-S25 PolarHBondContact O-OG 2.93Å; D22-E26 PolarHBondContact O-N 3.27Å |
| 23 | A | 83.1 | Confident | 85.1 | Confident | 65 Ų | 65 | 71.7 Ų | 71.7 | 54% | 0.537 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -61.6 | -38.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | R19 I20 A27 | R19-A23 WeakPolarHBondContact O-CB 3.42Å; R19-A23 PolarHBondContact O-N 3.36Å; R19-A23 VanDerWaalsContact O-N 3.14Å; I20-A23 PolarHBondContact O-N 3.38Å; A23-A27 PolarHBondContact O-N 3.39Å |
| 24 | M | 86.6 | Confident | 86.5 | Confident | 31 Ų | 31 | 66.5 Ų | 66.5 | 15% | 0.153 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -68.7 | -38 | 176 | -80.6 | -175.3 | 178 | 0 | 0 | 112.7 | I20 G21 D22 A27 A28 M76 Q79 A80 L83 | I20-M24 HydrophobicContact CG2-CE 3.51Å; I20-M24 HydrophobicContact CG2-CG 4.17Å; I20-M24 HydrophobicContact CG2-SD 3.65Å; I20-M24 WeakPolarHBondContact O-CB 3.2Å; I20-M24 WeakPolarHBondContact O-CG 3.45Å; I20-M24 PolarHBondContact O-N 2.95Å; G21-M24 PolarHBondContact O-N 3.12Å; D22-M24 VanDerWaalsContact C-N 3.3Å; D22-M24 PolarHBondContact O-N 2.88Å; M24-A27 PolarHBondContact O-N 3.44Å; M24-A28 WeakPolarHBondContact O-CB 3.19Å; M24-A28 PolarHBondContact O-N 3.36Å; M24-M76 HydrophobicContact CB-CE 3.36Å; M24-M76 HydrophobicContact CG-CE 3.52Å; M24-M76 VanDerWaalsContact O-CE 3.3Å; M24-M76 WeakPolarHBondContact O-CE 3.36Å; M24-M76 HydrophobicContact SD-CE 4.12Å; M24-Q79 HydrophobicContact CE-CB 3.92Å; M24-A80 VanDerWaalsContact CE-CA 3.44Å; M24-A80 HydrophobicContact CE-CB 3.67Å; M24-A80 VanDerWaalsContact CE-N 3.27Å; M24-A80 HydrophobicContact SD-CB 3.94Å; M24-L83 HydrophobicContact CE-CD1 3.56Å |
| 25 | S | 90.5 | Very high | 87.7 | Confident | 70 Ų | 70 | 64 Ų | 64 | 49% | 0.49 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -64.6 | -41 | 179.7 | 74.6 | 0 | 0 | 0 | 0 | 111.8 | G21 D22 A28 A29 | G21-S25 WeakPolarHBondContact O-CB 3.46Å; G21-S25 PolarHBondContact O-N 3.44Å; D22-S25 PolarHBondContact O-N 2.91Å; D22-S25 PolarHBondContact O-OG 2.93Å; S25-A28 PolarHBondContact O-N 3.36Å; S25-A29 WeakPolarHBondContact O-CB 3.5Å; S25-A29 PolarHBondContact O-N 3.18Å |
| 26 | E | 88.6 | Confident | 88.3 | Confident | 142 Ų | 142 | 64.9 Ų | 64.9 | 66% | 0.664 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -67.3 | -44.9 | 177.1 | -173.6 | 60.9 | -158.9 | 0 | 0 | 111.3 | D22 A28 A29 S30 | D22-E26 PolarHBondContact O-N 3.27Å; E26-A28 PolarHBondContact O-N 3.14Å; E26-A29 PolarHBondContact O-N 2.72Å; E26-S30 PolarHBondContact O-N 2.73Å |
| 27 | A | 89.4 | Confident | 89.1 | Confident | 45 Ų | 45 | 64 Ų | 64 | 37% | 0.372 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -62.4 | -42.3 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | A23 M24 S30 I31 | A23-A27 PolarHBondContact O-N 3.39Å; M24-A27 PolarHBondContact O-N 3.44Å; A27-S30 PolarHBondContact O-N 3.19Å; A27-I31 WeakPolarHBondContact O-CD1 3.41Å; A27-I31 VanDerWaalsContact O-CG1 3.28Å; A27-I31 WeakPolarHBondContact O-CG1 3.46Å; A27-I31 PolarHBondContact O-N 2.86Å |
| 28 | A | 91.6 | Very high | 89.8 | Confident | 19 Ų | 19 | 63.6 Ų | 63.6 | 16% | 0.157 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -64.8 | -38.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | M24 S25 E26 T32 L72 M76 | M24-A28 WeakPolarHBondContact O-CB 3.19Å; M24-A28 PolarHBondContact O-N 3.36Å; S25-A28 PolarHBondContact O-N 3.36Å; E26-A28 PolarHBondContact O-N 3.14Å; A28-T32 WeakPolarHBondContact O-CB 3.39Å; A28-T32 PolarHBondContact O-N 3.19Å; A28-T32 PolarHBondContact O-OG1 3.09Å; A28-L72 HydrophobicContact CB-CD2 3.87Å; A28-M76 HydrophobicContact CB-CE 4.27Å |
| 29 | A | 92.8 | Very high | 90.3 | Very high | 45 Ų | 45 | 60.8 Ų | 60.8 | 37% | 0.372 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -61.9 | -46.5 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.2 | S25 E26 T32 I33 | S25-A29 WeakPolarHBondContact O-CB 3.5Å; S25-A29 PolarHBondContact O-N 3.18Å; E26-A29 PolarHBondContact O-N 2.72Å; A29-T32 PolarHBondContact O-N 2.79Å; A29-I33 VanDerWaalsContact O-CG1 3.28Å; A29-I33 WeakPolarHBondContact O-CG1 3.39Å; A29-I33 PolarHBondContact O-N 3.02Å |
| 30 | S | 93.5 | Very high | 91 | Very high | 73 Ų | 73 | 63.3 Ų | 63.3 | 51% | 0.51 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -59.1 | -50.5 | 176.5 | -177.9 | 0 | 0 | 0 | 0 | 112.4 | E26 A27 T32 I33 T34 | E26-S30 PolarHBondContact O-N 2.73Å; A27-S30 PolarHBondContact O-N 3.19Å; S30-T32 VanDerWaalsContact C-N 3.31Å; S30-T32 PolarHBondContact O-N 2.92Å; S30-I33 PolarHBondContact O-N 2.66Å; S30-T34 PolarHBondContact O-N 3.32Å; S30-T34 VanDerWaalsContact O-N 3.09Å; S30-T34 PolarHBondContact O-OG1 3.05Å |
| 31 | I | 92.4 | Very high | 91.6 | Very high | 54 Ų | 54 | 65.5 Ų | 65.5 | 28% | 0.277 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -58.3 | -45 | 178.9 | -67.6 | 164.3 | 0 | 0 | 0 | 110.8 | A27 I33 T34 V35 L68 Q71 | A27-I31 WeakPolarHBondContact O-CD1 3.41Å; A27-I31 VanDerWaalsContact O-CG1 3.28Å; A27-I31 WeakPolarHBondContact O-CG1 3.46Å; A27-I31 PolarHBondContact O-N 2.86Å; I31-I33 VanDerWaalsContact C-N 3.35Å; I31-I33 PolarHBondContact O-N 3.33Å; I31-T34 PolarHBondContact O-N 3.43Å; I31-V35 HydrophobicContact CG2-CG2 4.35Å; I31-V35 WeakPolarHBondContact O-CG2 3.46Å; I31-V35 PolarHBondContact O-N 3.1Å; I31-L68 HydrophobicContact CG2-CD1 4.46Å; I31-Q71 VanDerWaalsContact CG2-OE1 3.26Å |
| 32 | T | 94.5 | Very high | 91.8 | Very high | 46 Ų | 46 | 65.9 Ų | 65.9 | 28% | 0.282 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -62.8 | -42.3 | -179.2 | -57.2 | 0 | 0 | 0 | 0 | 111.3 | A28 A29 S30 L36 | A28-T32 WeakPolarHBondContact O-CB 3.39Å; A28-T32 PolarHBondContact O-N 3.19Å; A28-T32 PolarHBondContact O-OG1 3.09Å; A29-T32 PolarHBondContact O-N 2.79Å; S30-T32 VanDerWaalsContact C-N 3.31Å; S30-T32 PolarHBondContact O-N 2.92Å; T32-L36 WeakPolarHBondContact O-CB 3.4Å; T32-L36 PolarHBondContact O-N 2.72Å |
| 33 | I | 94.5 | Very high | 92.1 | Very high | 109 Ų | 109 | 63.6 Ų | 63.6 | 56% | 0.559 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -63.1 | -46.2 | 178.5 | -69.2 | 164.8 | 0 | 0 | 0 | 111.1 | A29 S30 I31 L36 T37 | A29-I33 VanDerWaalsContact O-CG1 3.28Å; A29-I33 WeakPolarHBondContact O-CG1 3.39Å; A29-I33 PolarHBondContact O-N 3.02Å; S30-I33 PolarHBondContact O-N 2.66Å; I31-I33 VanDerWaalsContact C-N 3.35Å; I31-I33 PolarHBondContact O-N 3.33Å; I33-L36 PolarHBondContact O-N 3.21Å; I33-T37 WeakPolarHBondContact O-CB 3.35Å; I33-T37 PolarHBondContact O-N 3.16Å; I33-T37 PolarHBondContact O-OG1 3.12Å |
| 34 | T | 94.2 | Very high | 92.5 | Very high | 76 Ų | 76 | 66 Ų | 66 | 47% | 0.466 | 38% | 0.384 | S | S | . | . | H | α-helix | trans | -60.6 | -52.5 | 178.5 | -59.5 | 0 | 0 | 0 | 0 | 110.9 | S30 I31 L36 T37 D38 | S30-T34 PolarHBondContact O-N 3.32Å; S30-T34 VanDerWaalsContact O-N 3.09Å; S30-T34 PolarHBondContact O-OG1 3.05Å; I31-T34 PolarHBondContact O-N 3.43Å; T34-L36 VanDerWaalsContact C-N 3.33Å; T34-L36 PolarHBondContact O-N 3.4Å; T34-T37 PolarHBondContact O-N 3.38Å; T34-D38 PolarHBondContact O-N 3.38Å |
| 35 | V | 95.2 | Very high | 92.6 | Very high | 15 Ų | 15 | 65.2 Ų | 65.2 | 9% | 0.091 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -65.7 | -38 | -177.8 | 176.7 | 0 | 0 | 0 | 0 | 111.6 | I31 T37 D38 V39 I64 L68 | I31-V35 HydrophobicContact CG2-CG2 4.35Å; I31-V35 WeakPolarHBondContact O-CG2 3.46Å; I31-V35 PolarHBondContact O-N 3.1Å; V35-T37 VanDerWaalsContact C-N 3.33Å; V35-T37 PolarHBondContact O-N 2.93Å; V35-D38 PolarHBondContact O-N 3.14Å; V35-V39 HydrophobicContact CG1-CG2 4.27Å; V35-V39 WeakPolarHBondContact O-CB 3.47Å; V35-V39 VanDerWaalsContact O-CG2 3.27Å; V35-V39 WeakPolarHBondContact O-CG2 3.46Å; V35-V39 PolarHBondContact O-N 3.38Å; V35-I64 HydrophobicContact CG1-CG2 3.55Å; V35-L68 HydrophobicContact CB-CD1 4.16Å; V35-L68 HydrophobicContact CG1-CB 3.93Å; V35-L68 HydrophobicContact CG1-CD1 4.33Å; V35-L68 HydrophobicContact CG1-CD2 4.24Å; V35-L68 HydrophobicContact CG1-CG 4.39Å; V35-L68 HydrophobicContact CG2-CD1 4.39Å |
| 36 | L | 94.2 | Very high | 92.5 | Very high | 84 Ų | 84 | 65.3 Ų | 65.3 | 44% | 0.44 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -62.7 | -42.3 | 176.6 | -175.4 | 63.9 | 0 | 0 | 0 | 111.4 | T32 I33 T34 D38 V39 F40 | T32-L36 WeakPolarHBondContact O-CB 3.4Å; T32-L36 PolarHBondContact O-N 2.72Å; I33-L36 PolarHBondContact O-N 3.21Å; T34-L36 VanDerWaalsContact C-N 3.33Å; T34-L36 PolarHBondContact O-N 3.4Å; L36-D38 VanDerWaalsContact C-N 3.35Å; L36-V39 PolarHBondContact O-N 3.39Å; L36-F40 HydrophobicContact CD1-CD2 3.93Å; L36-F40 HydrophobicContact CD1-CE2 3.4Å; L36-F40 VanDerWaalsContact CD1-CE2 3.4Å; L36-F40 HydrophobicContact CD1-CZ 4.14Å; L36-F40 HydrophobicContact CD2-CE2 4.05Å; L36-F40 HydrophobicContact CG-CD2 3.79Å; L36-F40 HydrophobicContact CG-CE2 3.5Å; L36-F40 VanDerWaalsContact CG-CE2 3.5Å; L36-F40 WeakPolarHBondContact O-CD2 3.37Å; L36-F40 PolarHBondContact O-N 2.84Å |
| 37 | T | 95.3 | Very high | 92.6 | Very high | 77 Ų | 77 | 65.2 Ų | 65.2 | 47% | 0.472 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -64.7 | -39.9 | 176.9 | -55.5 | 0 | 0 | 0 | 0 | 111.4 | I33 T34 V35 F40 S41 | I33-T37 WeakPolarHBondContact O-CB 3.35Å; I33-T37 PolarHBondContact O-N 3.16Å; I33-T37 PolarHBondContact O-OG1 3.12Å; T34-T37 PolarHBondContact O-N 3.38Å; V35-T37 VanDerWaalsContact C-N 3.33Å; V35-T37 PolarHBondContact O-N 2.93Å; T37-F40 PolarHBondContact O-N 3.36Å; T37-S41 WeakPolarHBondContact O-CB 3.16Å; T37-S41 PolarHBondContact O-N 2.69Å; T37-S41 PolarHBondContact O-OG 2.8Å |
| 38 | D | 94.5 | Very high | 92.6 | Very high | 77 Ų | 77 | 65.5 Ų | 65.5 | 41% | 0.412 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -64.6 | -45.5 | 175.7 | -72.1 | -12 | 0 | 0 | 0 | 111.4 | T34 V35 L36 F40 S41 I42 | T34-D38 PolarHBondContact O-N 3.38Å; V35-D38 PolarHBondContact O-N 3.14Å; L36-D38 VanDerWaalsContact C-N 3.35Å; D38-F40 PolarHBondContact O-N 2.81Å; D38-S41 PolarHBondContact O-N 3.4Å; D38-I42 WeakPolarHBondContact O-CB 3.44Å; D38-I42 VanDerWaalsContact O-CG1 3.32Å; D38-I42 WeakPolarHBondContact O-CG1 3.2Å; D38-I42 PolarHBondContact O-N 3.22Å |
| 39 | V | 94.1 | Very high | 92.5 | Very high | 25 Ų | 25 | 72.1 Ų | 72.1 | 15% | 0.152 | 41% | 0.412 | C | S | . | . | H | α-helix | trans | -58.6 | -47.1 | 176.2 | 165.9 | 0 | 0 | 0 | 0 | 110.8 | V35 L36 A43 T61 I64 V65 | V35-V39 HydrophobicContact CG1-CG2 4.27Å; V35-V39 WeakPolarHBondContact O-CB 3.47Å; V35-V39 VanDerWaalsContact O-CG2 3.27Å; V35-V39 WeakPolarHBondContact O-CG2 3.46Å; V35-V39 PolarHBondContact O-N 3.38Å; L36-V39 PolarHBondContact O-N 3.39Å; V39-A43 WeakPolarHBondContact O-CB 3.34Å; V39-A43 PolarHBondContact O-N 2.88Å; V39-T61 HydrophobicContact CG1-CG2 3.92Å; V39-I64 HydrophobicContact CG2-CB 4.32Å; V39-I64 HydrophobicContact CG2-CG2 3.57Å; V39-V65 HydrophobicContact CG1-CG2 4.17Å; V39-V65 HydrophobicContact CG2-CG2 3.75Å |
| 40 | F | 93.1 | Very high | 92.4 | Very high | 130 Ų | 130 | 75.1 Ų | 75.1 | 57% | 0.57 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -64 | -44.7 | 177.1 | -79.8 | -60.2 | 0 | 0 | 0 | 112.1 | L36 T37 D38 I42 A43 L44 | L36-F40 HydrophobicContact CD1-CD2 3.93Å; L36-F40 HydrophobicContact CD1-CE2 3.4Å; L36-F40 VanDerWaalsContact CD1-CE2 3.4Å; L36-F40 HydrophobicContact CD1-CZ 4.14Å; L36-F40 HydrophobicContact CD2-CE2 4.05Å; L36-F40 HydrophobicContact CG-CD2 3.79Å; L36-F40 HydrophobicContact CG-CE2 3.5Å; L36-F40 VanDerWaalsContact CG-CE2 3.5Å; L36-F40 WeakPolarHBondContact O-CD2 3.37Å; L36-F40 PolarHBondContact O-N 2.84Å; T37-F40 PolarHBondContact O-N 3.36Å; D38-F40 PolarHBondContact O-N 2.81Å; F40-I42 VanDerWaalsContact C-N 3.34Å; F40-I42 PolarHBondContact O-N 2.89Å; F40-A43 PolarHBondContact O-N 3.1Å; F40-L44 WeakPolarHBondContact O-CG 3.27Å; F40-L44 PolarHBondContact O-N 2.74Å |
| 41 | S | 93.1 | Very high | 92.2 | Very high | 74 Ų | 74 | 77.2 Ų | 77.2 | 52% | 0.517 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -61.3 | -42.5 | -179.5 | -60.3 | 0 | 0 | 0 | 0 | 111.9 | T37 D38 | T37-S41 WeakPolarHBondContact O-CB 3.16Å; T37-S41 PolarHBondContact O-N 2.69Å; T37-S41 PolarHBondContact O-OG 2.8Å; D38-S41 PolarHBondContact O-N 3.4Å |
| 42 | I | 92.3 | Very high | 92.1 | Very high | 44 Ų | 44 | 78.2 Ų | 78.2 | 23% | 0.226 | 44% | 0.441 | C | S | . | . | H | α-helix | trans | -75.2 | -37.9 | 178.4 | -65.1 | 169.5 | 0 | 0 | 0 | 111.1 | D38 F40 L44 G45 C57 T60 T61 I64 | D38-I42 WeakPolarHBondContact O-CB 3.44Å; D38-I42 VanDerWaalsContact O-CG1 3.32Å; D38-I42 WeakPolarHBondContact O-CG1 3.2Å; D38-I42 PolarHBondContact O-N 3.22Å; F40-I42 VanDerWaalsContact C-N 3.34Å; F40-I42 PolarHBondContact O-N 2.89Å; I42-L44 VanDerWaalsContact C-N 3.3Å; I42-L44 PolarHBondContact O-N 2.97Å; I42-G45 WeakPolarHBondContact O-CA 3.47Å; I42-G45 PolarHBondContact O-N 3.43Å; I42-C57 HydrophobicContact CG2-CB 4.1Å; I42-C57 WeakPolarHBondContact CG2-O 3.15Å; I42-C57 WeakPolarHBondContact O-CB 3.39Å; I42-T60 VanDerWaalsContact CG2-OG1 3.25Å; I42-T60 WeakPolarHBondContact CG2-OG1 3.2Å; I42-T61 VanDerWaalsContact CG2-OG1 3.28Å; I42-T61 WeakPolarHBondContact CG2-OG1 3.41Å; I42-I64 HydrophobicContact CD1-CD1 3.4Å; I42-I64 VanDerWaalsContact CD1-CD1 3.4Å |
| 43 | A | 90.2 | Very high | 91.8 | Very high | 34 Ų | 34 | 78.1 Ų | 78.1 | 28% | 0.281 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -63.2 | -35.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | V39 F40 G45 I46 | V39-A43 WeakPolarHBondContact O-CB 3.34Å; V39-A43 PolarHBondContact O-N 2.88Å; F40-A43 PolarHBondContact O-N 3.1Å; A43-G45 PolarHBondContact O-N 3.17Å; A43-I46 HydrophobicContact CB-CD1 4.49Å; A43-I46 VanDerWaalsContact O-CB 3.26Å; A43-I46 WeakPolarHBondContact O-CB 3.36Å; A43-I46 VanDerWaalsContact O-CG1 3.3Å; A43-I46 WeakPolarHBondContact O-CG1 3.44Å; A43-I46 PolarHBondContact O-N 3.49Å |
| 44 | L | 91.7 | Very high | 91.6 | Very high | 116 Ų | 116 | 76.7 Ų | 76.7 | 61% | 0.607 | 43% | 0.432 | S | S | * | . | H | α-helix | trans | -61 | -26.4 | 172 | -72.1 | 175.8 | 0 | 0 | 0 | 112.5 | F40 I42 I46 L47 | F40-L44 WeakPolarHBondContact O-CG 3.27Å; F40-L44 PolarHBondContact O-N 2.74Å; I42-L44 VanDerWaalsContact C-N 3.3Å; I42-L44 PolarHBondContact O-N 2.97Å; L44-I46 PolarHBondContact O-N 3.46Å; L44-L47 HydrophobicContact CD2-CD1 4.26Å; L44-L47 PolarHBondContact O-N 3.02Å |
| 45 | G | 88.2 | Confident | 91.4 | Very high | 15 Ų | 15 | 78.5 Ų | 78.5 | 16% | 0.155 | 44% | 0.437 | C | S | . | . | G | 310 helix | trans | -63 | -22.5 | 173.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | I42 A43 L47 T48 V53 | I42-G45 WeakPolarHBondContact O-CA 3.47Å; I42-G45 PolarHBondContact O-N 3.43Å; A43-G45 PolarHBondContact O-N 3.17Å; G45-L47 PolarHBondContact O-N 2.89Å; G45-T48 WeakPolarHBondContact O-CB 3.3Å; G45-T48 WeakPolarHBondContact O-CG2 3.33Å; G45-T48 PolarHBondContact O-N 3.47Å; G45-T48 PolarHBondContact O-OG1 2.85Å; G45-V53 WeakPolarHBondContact O-CG1 3.3Å |
| 46 | I | 88.5 | Confident | 91.3 | Very high | 71 Ų | 71 | 83.8 Ų | 83.8 | 36% | 0.364 | 46% | 0.459 | S | S | . | . | G | 310 helix | trans | -66.2 | -25.8 | 177.7 | -55.9 | 172.2 | 0 | 0 | 0 | 111.4 | A43 L44 T48 C57 P58 | A43-I46 HydrophobicContact CB-CD1 4.49Å; A43-I46 VanDerWaalsContact O-CB 3.26Å; A43-I46 WeakPolarHBondContact O-CB 3.36Å; A43-I46 VanDerWaalsContact O-CG1 3.3Å; A43-I46 WeakPolarHBondContact O-CG1 3.44Å; A43-I46 PolarHBondContact O-N 3.49Å; L44-I46 PolarHBondContact O-N 3.46Å; I46-T48 PolarHBondContact O-N 3.21Å; I46-C57 HydrophobicContact CG1-CB 3.71Å; I46-P58 HydrophobicContact CD1-CG 4.02Å; I46-P58 HydrophobicContact CG1-CG 4.01Å |
| 47 | L | 90.3 | Very high | 91.2 | Very high | 140 Ų | 140 | 80.2 Ų | 80.2 | 73% | 0.733 | 44% | 0.441 | S | S | * | . | G | 310 helix | trans | -74.8 | -9.7 | 178.7 | -61.5 | 176.5 | 0 | 0 | 0 | 113.5 | L44 G45 | L44-L47 HydrophobicContact CD2-CD1 4.26Å; L44-L47 PolarHBondContact O-N 3.02Å; G45-L47 PolarHBondContact O-N 2.89Å |
| 48 | T | 90.7 | Very high | 91 | Very high | 51 Ų | 51 | 79.3 Ų | 79.3 | 31% | 0.313 | 44% | 0.437 | S | S | . | . | S | Bend | trans | -71.8 | 143.9 | 179.5 | 64.8 | 0 | 0 | 0 | 0 | 111.1 | G45 I46 I50 V53 Q54 | G45-T48 WeakPolarHBondContact O-CB 3.3Å; G45-T48 WeakPolarHBondContact O-CG2 3.33Å; G45-T48 PolarHBondContact O-N 3.47Å; G45-T48 PolarHBondContact O-OG1 2.85Å; I46-T48 PolarHBondContact O-N 3.21Å; T48-I50 PolarHBondContact O-N 2.99Å; T48-V53 HydrophobicContact CG2-CG1 4.45Å; T48-V53 WeakPolarHBondContact OG1-CB 3.15Å; T48-V53 WeakPolarHBondContact OG1-CG1 3.35Å; T48-Q54 VanDerWaalsContact O-CG 3.24Å; T48-Q54 WeakPolarHBondContact O-CG 3.19Å; T48-Q54 PolarHBondContact O-NE2 3.02Å |
| 49 | N | 88.9 | Confident | 90.9 | Very high | 159 Ų | 159 | 82.6 Ų | 82.6 | 85% | 0.85 | 45% | 0.449 | S | S | * | . | S | Bend | trans | -78.3 | 3.2 | 179.7 | -70.3 | -47 | 0 | 0 | 0 | 113.9 | ||
| 50 | I | 90.8 | Very high | 90.9 | Very high | 107 Ų | 107 | 82.8 Ų | 82.8 | 55% | 0.549 | 45% | 0.45 | S | S | . | . | trans | -89 | 114.3 | -176.6 | -57.8 | 173.1 | 0 | 0 | 0 | 108.8 | T48 A52 V53 Q54 | T48-I50 PolarHBondContact O-N 2.99Å; I50-A52 HydrophobicContact CG2-CB 4.2Å; I50-A52 PolarHBondContact O-N 3.05Å; I50-A52 VanDerWaalsContact O-N 3.13Å; I50-V53 HydrophobicContact CB-CB 4.37Å; I50-V53 HydrophobicContact CB-CG2 4.04Å; I50-V53 HydrophobicContact CG2-CG2 4.07Å; I50-V53 PolarHBondContact O-N 3.37Å; I50-Q54 PolarHBondContact O-N 2.92Å; I50-Q54 VanDerWaalsContact O-N 3.07Å | ||
| 51 | L | 88.7 | Confident | 90.8 | Very high | 118 Ų | 118 | 77.5 Ų | 77.5 | 62% | 0.618 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -52.4 | -39.2 | -177.4 | -178.7 | 63.7 | 0 | 0 | 0 | 113.2 | V53 Q54 I55 | L51-V53 VanDerWaalsContact C-N 3.31Å; L51-V53 PolarHBondContact O-N 3.17Å; L51-Q54 PolarHBondContact O-N 3.03Å; L51-I55 HydrophobicContact CD1-CD1 4.15Å; L51-I55 HydrophobicContact CD1-CG1 4.36Å; L51-I55 HydrophobicContact CG-CD1 4.16Å; L51-I55 WeakPolarHBondContact O-CG1 3.5Å; L51-I55 PolarHBondContact O-N 2.86Å |
| 52 | A | 90.1 | Very high | 90.8 | Very high | 74 Ų | 74 | 76.8 Ų | 76.8 | 61% | 0.612 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -60.3 | -40.3 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | I50 F56 | I50-A52 HydrophobicContact CG2-CB 4.2Å; I50-A52 PolarHBondContact O-N 3.05Å; I50-A52 VanDerWaalsContact O-N 3.13Å; A52-F56 WeakPolarHBondContact O-CB 3.21Å; A52-F56 PolarHBondContact O-N 3.31Å |
| 53 | V | 90.2 | Very high | 90.9 | Very high | 45 Ų | 45 | 77.7 Ų | 77.7 | 27% | 0.273 | 44% | 0.436 | S | S | . | . | H | α-helix | trans | -74.8 | -38.6 | 179.9 | -177.6 | 0 | 0 | 0 | 0 | 110.6 | G45 T48 I50 L51 I55 F56 C57 | G45-V53 WeakPolarHBondContact O-CG1 3.3Å; T48-V53 HydrophobicContact CG2-CG1 4.45Å; T48-V53 WeakPolarHBondContact OG1-CB 3.15Å; T48-V53 WeakPolarHBondContact OG1-CG1 3.35Å; I50-V53 HydrophobicContact CB-CB 4.37Å; I50-V53 HydrophobicContact CB-CG2 4.04Å; I50-V53 HydrophobicContact CG2-CG2 4.07Å; I50-V53 PolarHBondContact O-N 3.37Å; L51-V53 VanDerWaalsContact C-N 3.31Å; L51-V53 PolarHBondContact O-N 3.17Å; V53-I55 VanDerWaalsContact C-N 3.27Å; V53-I55 PolarHBondContact O-N 2.67Å; V53-F56 PolarHBondContact O-N 3.06Å; V53-C57 VanDerWaalsContact CG1-SG 3.56Å; V53-C57 WeakPolarHBondContact O-CB 3.25Å; V53-C57 PolarHBondContact O-N 3.14Å |
| 54 | Q | 89.2 | Confident | 91.1 | Very high | 78 Ų | 78 | 77.9 Ų | 77.9 | 36% | 0.364 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -62.1 | -30.5 | 177.5 | -69.5 | -177.2 | -2.6 | 0 | 0 | 113.7 | T48 I50 L51 P58 | T48-Q54 VanDerWaalsContact O-CG 3.24Å; T48-Q54 WeakPolarHBondContact O-CG 3.19Å; T48-Q54 PolarHBondContact O-NE2 3.02Å; I50-Q54 PolarHBondContact O-N 2.92Å; I50-Q54 VanDerWaalsContact O-N 3.07Å; L51-Q54 PolarHBondContact O-N 3.03Å; Q54-P58 WeakPolarHBondContact O-CD 3.35Å; Q54-P58 WeakPolarHBondContact O-CG 3.37Å |
| 55 | I | 91.1 | Very high | 91.2 | Very high | 114 Ų | 114 | 74.8 Ų | 74.8 | 59% | 0.585 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -82 | -39.1 | 175.9 | -60.5 | 172.2 | 0 | 0 | 0 | 110.7 | L51 V53 | L51-I55 HydrophobicContact CD1-CD1 4.15Å; L51-I55 HydrophobicContact CD1-CG1 4.36Å; L51-I55 HydrophobicContact CG-CD1 4.16Å; L51-I55 WeakPolarHBondContact O-CG1 3.5Å; L51-I55 PolarHBondContact O-N 2.86Å; V53-I55 VanDerWaalsContact C-N 3.27Å; V53-I55 PolarHBondContact O-N 2.67Å |
| 56 | F | 92.6 | Very high | 91.4 | Very high | 127 Ų | 127 | 77.3 Ų | 77.3 | 56% | 0.557 | 43% | 0.43 | S | S | * | . | H | α-helix | trans | -69.6 | -50.2 | -176.4 | 173.8 | -104.9 | 0 | 0 | 0 | 113 | A52 V53 H59 T60 | A52-F56 WeakPolarHBondContact O-CB 3.21Å; A52-F56 PolarHBondContact O-N 3.31Å; V53-F56 PolarHBondContact O-N 3.06Å; F56-H59 PolarHBondContact O-N 2.97Å; F56-H59 VanDerWaalsContact O-N 3.11Å; F56-T60 HydrophobicContact CD1-CG2 4.43Å; F56-T60 HydrophobicContact CD2-CG2 3.88Å; F56-T60 HydrophobicContact CE1-CG2 3.99Å; F56-T60 HydrophobicContact CE2-CG2 3.37Å; F56-T60 HydrophobicContact CG-CG2 4.39Å; F56-T60 HydrophobicContact CZ-CG2 3.45Å; F56-T60 VanDerWaalsContact CZ-CG2 3.45Å; F56-T60 PolarHBondContact O-N 2.82Å; F56-T60 PolarHBondContact O-OG1 3.45Å |
| 57 | C | 92.5 | Very high | 91.6 | Very high | 9 Ų | 9 | 76.9 Ų | 76.9 | 6% | 0.061 | 43% | 0.431 | C | S | . | . | H | α-helix | trans | -59.9 | -44.3 | -172.9 | -74.3 | 0 | 0 | 0 | 0 | 113.9 | I42 I46 V53 H59 T60 T61 | I42-C57 HydrophobicContact CG2-CB 4.1Å; I42-C57 WeakPolarHBondContact CG2-O 3.15Å; I42-C57 WeakPolarHBondContact O-CB 3.39Å; I46-C57 HydrophobicContact CG1-CB 3.71Å; V53-C57 VanDerWaalsContact CG1-SG 3.56Å; V53-C57 WeakPolarHBondContact O-CB 3.25Å; V53-C57 PolarHBondContact O-N 3.14Å; C57-H59 VanDerWaalsContact C-N 3.34Å; C57-H59 PolarHBondContact O-N 3.33Å; C57-T60 PolarHBondContact O-N 3.24Å; C57-T60 PolarHBondContact O-OG1 3.14Å; C57-T60 VanDerWaalsContact O-OG1 3.07Å; C57-T61 WeakPolarHBondContact O-CB 3.39Å; C57-T61 PolarHBondContact O-N 3.29Å; C57-T61 PolarHBondContact O-OG1 3.04Å |
| 58 | P | 90.3 | Very high | 91.7 | Very high | 58 Ų | 58 | 71.6 Ų | 71.6 | 38% | 0.377 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -64.4 | -38.4 | 174.1 | -22.7 | 34.8 | 0 | 0 | 0 | 112.7 | I46 Q54 T60 T61 A62 | I46-P58 HydrophobicContact CD1-CG 4.02Å; I46-P58 HydrophobicContact CG1-CG 4.01Å; Q54-P58 WeakPolarHBondContact O-CD 3.35Å; Q54-P58 WeakPolarHBondContact O-CG 3.37Å; P58-T60 VanDerWaalsContact C-N 3.32Å; P58-T60 PolarHBondContact O-N 3.01Å; P58-T61 PolarHBondContact O-N 3.29Å; P58-A62 PolarHBondContact O-N 3.36Å |
| 59 | H | 92.6 | Very high | 91.8 | Very high | 146 Ų | 146 | 75.5 Ų | 75.5 | 68% | 0.676 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -70 | -26.7 | -179.4 | -169.7 | -77 | 0 | 0 | 0 | 112.8 | F56 C57 P63 | F56-H59 PolarHBondContact O-N 2.97Å; F56-H59 VanDerWaalsContact O-N 3.11Å; C57-H59 VanDerWaalsContact C-N 3.34Å; C57-H59 PolarHBondContact O-N 3.33Å; H59-P63 WeakPolarHBondContact O-CD 3.05Å; H59-P63 WeakPolarHBondContact O-CG 3.49Å |
| 60 | T | 93.4 | Very high | 92.1 | Very high | 28 Ų | 28 | 74.6 Ų | 74.6 | 17% | 0.172 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -86.9 | -32.1 | 172.8 | 51.8 | 0 | 0 | 0 | 0 | 112.9 | I42 F56 C57 P58 P63 I64 | I42-T60 VanDerWaalsContact CG2-OG1 3.25Å; I42-T60 WeakPolarHBondContact CG2-OG1 3.2Å; F56-T60 HydrophobicContact CD1-CG2 4.43Å; F56-T60 HydrophobicContact CD2-CG2 3.88Å; F56-T60 HydrophobicContact CE1-CG2 3.99Å; F56-T60 HydrophobicContact CE2-CG2 3.37Å; F56-T60 HydrophobicContact CG-CG2 4.39Å; F56-T60 HydrophobicContact CZ-CG2 3.45Å; F56-T60 VanDerWaalsContact CZ-CG2 3.45Å; F56-T60 PolarHBondContact O-N 2.82Å; F56-T60 PolarHBondContact O-OG1 3.45Å; C57-T60 PolarHBondContact O-N 3.24Å; C57-T60 PolarHBondContact O-OG1 3.14Å; C57-T60 VanDerWaalsContact O-OG1 3.07Å; P58-T60 VanDerWaalsContact C-N 3.32Å; P58-T60 PolarHBondContact O-N 3.01Å; T60-P63 VanDerWaalsContact O-CD 3.28Å; T60-P63 WeakPolarHBondContact O-CD 3.28Å; T60-P63 VanDerWaalsContact O-CG 3.29Å; T60-P63 WeakPolarHBondContact O-CG 3.28Å; T60-I64 VanDerWaalsContact O-CD1 3.26Å; T60-I64 WeakPolarHBondContact O-CD1 3.46Å; T60-I64 WeakPolarHBondContact O-CG1 3.33Å; T60-I64 PolarHBondContact O-N 3.03Å |
| 61 | T | 92.5 | Very high | 92.1 | Very high | 20 Ų | 20 | 73 Ų | 73 | 12% | 0.123 | 39% | 0.392 | C | S | . | . | H | α-helix | trans | -65.9 | -43.4 | 178.6 | -55.8 | 0 | 0 | 0 | 0 | 112.2 | V39 I42 C57 P58 I64 V65 | V39-T61 HydrophobicContact CG1-CG2 3.92Å; I42-T61 VanDerWaalsContact CG2-OG1 3.28Å; I42-T61 WeakPolarHBondContact CG2-OG1 3.41Å; C57-T61 WeakPolarHBondContact O-CB 3.39Å; C57-T61 PolarHBondContact O-N 3.29Å; C57-T61 PolarHBondContact O-OG1 3.04Å; P58-T61 PolarHBondContact O-N 3.29Å; T61-I64 PolarHBondContact O-N 3.45Å; T61-V65 HydrophobicContact CG2-CG2 4.33Å; T61-V65 WeakPolarHBondContact O-CG2 3.44Å; T61-V65 PolarHBondContact O-N 3.37Å |
| 62 | A | 92.4 | Very high | 92.2 | Very high | 58 Ų | 58 | 70.5 Ų | 70.5 | 48% | 0.479 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -58 | -49.3 | -179.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | P58 V65 T66 | P58-A62 PolarHBondContact O-N 3.36Å; A62-V65 PolarHBondContact O-N 3.36Å; A62-T66 WeakPolarHBondContact O-CB 3.19Å; A62-T66 PolarHBondContact O-N 3.36Å; A62-T66 PolarHBondContact O-OG1 3.08Å |
| 63 | P | 94 | Very high | 92.3 | Very high | 63 Ų | 63 | 70.9 Ų | 70.9 | 41% | 0.409 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -66.8 | -34.8 | 176.6 | 23.4 | -31.9 | 0 | 0 | 0 | 112.3 | H59 T60 T66 T67 | H59-P63 WeakPolarHBondContact O-CD 3.05Å; H59-P63 WeakPolarHBondContact O-CG 3.49Å; T60-P63 VanDerWaalsContact O-CD 3.28Å; T60-P63 WeakPolarHBondContact O-CD 3.28Å; T60-P63 VanDerWaalsContact O-CG 3.29Å; T60-P63 WeakPolarHBondContact O-CG 3.28Å; P63-T66 CarbonylContact O-C 3.45Å; P63-T66 WeakPolarHBondContact O-CB 3.42Å; P63-T66 PolarHBondContact O-N 3.28Å; P63-T67 WeakPolarHBondContact O-CG2 3.35Å; P63-T67 PolarHBondContact O-N 3.01Å; P63-T67 PolarHBondContact O-OG1 2.74Å |
| 64 | I | 94.5 | Very high | 92.4 | Very high | 39 Ų | 39 | 73.2 Ų | 73.2 | 20% | 0.2 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -63.8 | -43 | 177.2 | -67.1 | 168.5 | 0 | 0 | 0 | 111.4 | V35 V39 I42 T60 T61 T66 T67 L68 | V35-I64 HydrophobicContact CG1-CG2 3.55Å; V39-I64 HydrophobicContact CG2-CB 4.32Å; V39-I64 HydrophobicContact CG2-CG2 3.57Å; I42-I64 HydrophobicContact CD1-CD1 3.4Å; I42-I64 VanDerWaalsContact CD1-CD1 3.4Å; T60-I64 VanDerWaalsContact O-CD1 3.26Å; T60-I64 WeakPolarHBondContact O-CD1 3.46Å; T60-I64 WeakPolarHBondContact O-CG1 3.33Å; T60-I64 PolarHBondContact O-N 3.03Å; T61-I64 PolarHBondContact O-N 3.45Å; I64-T66 VanDerWaalsContact C-N 3.31Å; I64-T66 PolarHBondContact O-N 3.09Å; I64-T67 WeakPolarHBondContact CA-OG1 3.42Å; I64-T67 PolarHBondContact O-N 3.23Å; I64-T67 PolarHBondContact O-OG1 3.04Å; I64-L68 PolarHBondContact O-N 2.86Å; I64-L68 VanDerWaalsContact O-N 3.13Å |
| 65 | V | 93.1 | Very high | 92.4 | Very high | 51 Ų | 51 | 74.3 Ų | 74.3 | 31% | 0.309 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -64.2 | -41.2 | 174.5 | 173.1 | 0 | 0 | 0 | 0 | 110.5 | V39 T61 A62 L68 F69 | V39-V65 HydrophobicContact CG1-CG2 4.17Å; V39-V65 HydrophobicContact CG2-CG2 3.75Å; T61-V65 HydrophobicContact CG2-CG2 4.33Å; T61-V65 WeakPolarHBondContact O-CG2 3.44Å; T61-V65 PolarHBondContact O-N 3.37Å; A62-V65 PolarHBondContact O-N 3.36Å; V65-L68 WeakPolarHBondContact O-CB 3.27Å; V65-L68 PolarHBondContact O-N 2.98Å; V65-F69 HydrophobicContact CG1-CD2 4.08Å; V65-F69 HydrophobicContact CG1-CE2 3.71Å; V65-F69 WeakPolarHBondContact O-CD2 3.36Å; V65-F69 PolarHBondContact O-N 2.82Å |
| 66 | T | 92.2 | Very high | 92.3 | Very high | 68 Ų | 68 | 70 Ų | 70 | 42% | 0.417 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -63.4 | -42.5 | 178.1 | -58.7 | 0 | 0 | 0 | 0 | 111.5 | A62 P63 I64 L68 F69 Y70 | A62-T66 WeakPolarHBondContact O-CB 3.19Å; A62-T66 PolarHBondContact O-N 3.36Å; A62-T66 PolarHBondContact O-OG1 3.08Å; P63-T66 CarbonylContact O-C 3.45Å; P63-T66 WeakPolarHBondContact O-CB 3.42Å; P63-T66 PolarHBondContact O-N 3.28Å; I64-T66 VanDerWaalsContact C-N 3.31Å; I64-T66 PolarHBondContact O-N 3.09Å; T66-L68 VanDerWaalsContact C-N 3.32Å; T66-L68 PolarHBondContact O-N 2.91Å; T66-F69 PolarHBondContact O-N 3.48Å; T66-Y70 HydrophobicContact CG2-CD2 3.63Å; T66-Y70 HydrophobicContact CG2-CE2 3.41Å; T66-Y70 VanDerWaalsContact CG2-CE2 3.41Å; T66-Y70 WeakPolarHBondContact O-CD2 3.48Å; T66-Y70 PolarHBondContact O-N 3.22Å |
| 67 | T | 92.6 | Very high | 92.1 | Very high | 61 Ų | 61 | 67 Ų | 67 | 37% | 0.374 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -66 | -33 | 177.5 | 53.1 | 0 | 0 | 0 | 0 | 112.3 | P63 I64 Y70 Q71 | P63-T67 WeakPolarHBondContact O-CG2 3.35Å; P63-T67 PolarHBondContact O-N 3.01Å; P63-T67 PolarHBondContact O-OG1 2.74Å; I64-T67 WeakPolarHBondContact CA-OG1 3.42Å; I64-T67 PolarHBondContact O-N 3.23Å; I64-T67 PolarHBondContact O-OG1 3.04Å; T67-Y70 PolarHBondContact O-N 3.04Å; T67-Q71 WeakPolarHBondContact O-CB 3.46Å; T67-Q71 VanDerWaalsContact O-CG 3.25Å; T67-Q71 WeakPolarHBondContact O-CG 3.25Å; T67-Q71 PolarHBondContact O-N 3.47Å |
| 68 | L | 94.2 | Very high | 92 | Very high | 29 Ų | 29 | 70 Ų | 70 | 15% | 0.152 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -58.4 | -48.6 | 171.8 | -178.5 | 61.5 | 0 | 0 | 0 | 111.4 | I31 V35 I64 V65 T66 Y70 Q71 L72 | I31-L68 HydrophobicContact CG2-CD1 4.46Å; V35-L68 HydrophobicContact CB-CD1 4.16Å; V35-L68 HydrophobicContact CG1-CB 3.93Å; V35-L68 HydrophobicContact CG1-CD1 4.33Å; V35-L68 HydrophobicContact CG1-CD2 4.24Å; V35-L68 HydrophobicContact CG1-CG 4.39Å; V35-L68 HydrophobicContact CG2-CD1 4.39Å; I64-L68 PolarHBondContact O-N 2.86Å; I64-L68 VanDerWaalsContact O-N 3.13Å; V65-L68 WeakPolarHBondContact O-CB 3.27Å; V65-L68 PolarHBondContact O-N 2.98Å; T66-L68 VanDerWaalsContact C-N 3.32Å; T66-L68 PolarHBondContact O-N 2.91Å; L68-Y70 PolarHBondContact O-N 3.3Å; L68-Q71 PolarHBondContact O-N 3.02Å; L68-L72 HydrophobicContact CD1-CD1 3.87Å; L68-L72 HydrophobicContact CD1-CG 4.08Å; L68-L72 HydrophobicContact CG-CD1 4.03Å; L68-L72 WeakPolarHBondContact O-CG 3.13Å; L68-L72 PolarHBondContact O-N 3.13Å |
| 69 | F | 93 | Very high | 91.9 | Very high | 133 Ų | 133 | 71.5 Ų | 71.5 | 58% | 0.583 | 39% | 0.386 | S | S | * | . | H | α-helix | trans | -60.9 | -43.3 | 177.1 | -76.4 | -70.8 | 0 | 0 | 0 | 112 | V65 T66 T73 | V65-F69 HydrophobicContact CG1-CD2 4.08Å; V65-F69 HydrophobicContact CG1-CE2 3.71Å; V65-F69 WeakPolarHBondContact O-CD2 3.36Å; V65-F69 PolarHBondContact O-N 2.82Å; T66-F69 PolarHBondContact O-N 3.48Å; F69-T73 WeakPolarHBondContact O-CB 3.44Å; F69-T73 WeakPolarHBondContact O-CG2 3.41Å; F69-T73 PolarHBondContact O-N 2.84Å; F69-T73 VanDerWaalsContact O-N 3.14Å; F69-T73 PolarHBondContact O-OG1 3.44Å |
| 70 | Y | 93.4 | Very high | 91.5 | Very high | 140 Ų | 140 | 65.9 Ų | 65.9 | 55% | 0.549 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -66.1 | -38.6 | 177.3 | -82.1 | -70.2 | 0 | 0 | 0 | 113.2 | T66 T67 L68 I74 M75 | T66-Y70 HydrophobicContact CG2-CD2 3.63Å; T66-Y70 HydrophobicContact CG2-CE2 3.41Å; T66-Y70 VanDerWaalsContact CG2-CE2 3.41Å; T66-Y70 WeakPolarHBondContact O-CD2 3.48Å; T66-Y70 PolarHBondContact O-N 3.22Å; T67-Y70 PolarHBondContact O-N 3.04Å; L68-Y70 PolarHBondContact O-N 3.3Å; Y70-I74 HydrophobicContact CD1-CD1 3.57Å; Y70-I74 HydrophobicContact CE1-CD1 3.73Å; Y70-I74 PolarHBondContact O-N 3.22Å; Y70-I74 VanDerWaalsContact O-N 3.14Å; Y70-M75 PolarHBondContact O-N 2.8Å; Y70-M75 VanDerWaalsContact O-N 3.14Å |
| 71 | Q | 91.8 | Very high | 91.2 | Very high | 75 Ų | 75 | 69.6 Ų | 69.6 | 35% | 0.35 | 38% | 0.383 | S | S | . | . | I | π-helix | trans | -66.5 | -49.4 | 177.4 | -74.4 | 176.4 | 23 | 0 | 0 | 110.6 | I31 T67 L68 T73 M75 M76 | I31-Q71 VanDerWaalsContact CG2-OE1 3.26Å; T67-Q71 WeakPolarHBondContact O-CB 3.46Å; T67-Q71 VanDerWaalsContact O-CG 3.25Å; T67-Q71 WeakPolarHBondContact O-CG 3.25Å; T67-Q71 PolarHBondContact O-N 3.47Å; L68-Q71 PolarHBondContact O-N 3.02Å; Q71-T73 PolarHBondContact O-N 3.41Å; Q71-M75 WeakPolarHBondContact O-CB 3.26Å; Q71-M76 WeakPolarHBondContact O-CG 3.17Å; Q71-M76 PolarHBondContact O-N 3.41Å; Q71-M76 VanDerWaalsContact O-N 3.16Å |
| 72 | L | 91.4 | Very high | 90.7 | Very high | 64 Ų | 64 | 71.2 Ų | 71.2 | 34% | 0.335 | 39% | 0.393 | S | S | . | . | I | π-helix | trans | -67.3 | -30.8 | -177.5 | -68.6 | 177.8 | 0 | 0 | 0 | 114.1 | A28 L68 | A28-L72 HydrophobicContact CB-CD2 3.87Å; L68-L72 HydrophobicContact CD1-CD1 3.87Å; L68-L72 HydrophobicContact CD1-CG 4.08Å; L68-L72 HydrophobicContact CG-CD1 4.03Å; L68-L72 WeakPolarHBondContact O-CG 3.13Å; L68-L72 PolarHBondContact O-N 3.13Å |
| 73 | T | 91.1 | Very high | 90.1 | Very high | 82 Ų | 82 | 71.5 Ų | 71.5 | 50% | 0.503 | 39% | 0.386 | S | S | . | . | I | π-helix | trans | -96.3 | -68.8 | -175.7 | 56.7 | 0 | 0 | 0 | 0 | 112.2 | F69 Q71 A77 | F69-T73 WeakPolarHBondContact O-CB 3.44Å; F69-T73 WeakPolarHBondContact O-CG2 3.41Å; F69-T73 PolarHBondContact O-N 2.84Å; F69-T73 VanDerWaalsContact O-N 3.14Å; F69-T73 PolarHBondContact O-OG1 3.44Å; Q71-T73 PolarHBondContact O-N 3.41Å; T73-A77 WeakPolarHBondContact O-CB 3.27Å; T73-A77 PolarHBondContact O-N 2.93Å |
| 74 | I | 92.2 | Very high | 89.4 | Confident | 95 Ų | 95 | 76.3 Ų | 76.3 | 49% | 0.487 | 40% | 0.396 | S | S | . | . | I | π-helix | trans | -76.9 | -46.9 | -170.2 | -70.3 | 162.9 | 0 | 0 | 0 | 110.6 | Y70 A77 V78 | Y70-I74 HydrophobicContact CD1-CD1 3.57Å; Y70-I74 HydrophobicContact CE1-CD1 3.73Å; Y70-I74 PolarHBondContact O-N 3.22Å; Y70-I74 VanDerWaalsContact O-N 3.14Å; I74-A77 PolarHBondContact O-N 2.97Å; I74-V78 HydrophobicContact CG2-CG2 4.29Å; I74-V78 WeakPolarHBondContact O-CB 3.25Å; I74-V78 WeakPolarHBondContact O-CG2 3.4Å; I74-V78 PolarHBondContact O-N 2.96Å |
| 75 | M | 90.4 | Very high | 88.6 | Confident | 101 Ų | 101 | 76.9 Ų | 76.9 | 50% | 0.498 | 40% | 0.401 | S | S | . | . | I | π-helix | trans | -66.4 | -47.6 | -176.8 | -170.9 | 66.4 | 72.6 | 0 | 0 | 111.5 | Y70 Q71 A77 V78 Q79 | Y70-M75 PolarHBondContact O-N 2.8Å; Y70-M75 VanDerWaalsContact O-N 3.14Å; Q71-M75 WeakPolarHBondContact O-CB 3.26Å; M75-A77 VanDerWaalsContact C-N 3.32Å; M75-A77 PolarHBondContact O-N 2.8Å; M75-V78 PolarHBondContact O-N 3.46Å; M75-Q79 HydrophobicContact CG-CG 4.45Å; M75-Q79 WeakPolarHBondContact O-CB 3.17Å; M75-Q79 WeakPolarHBondContact O-CG 3.28Å; M75-Q79 PolarHBondContact O-N 3.21Å |
| 76 | M | 88.1 | Confident | 87.5 | Confident | 24 Ų | 24 | 77.9 Ų | 77.9 | 12% | 0.118 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -60.4 | -40.7 | 176.7 | -63 | -58.9 | -75.4 | 0 | 0 | 111.9 | M24 A28 Q71 Q79 A80 | M24-M76 HydrophobicContact CB-CE 3.36Å; M24-M76 HydrophobicContact CG-CE 3.52Å; M24-M76 VanDerWaalsContact O-CE 3.3Å; M24-M76 WeakPolarHBondContact O-CE 3.36Å; M24-M76 HydrophobicContact SD-CE 4.12Å; A28-M76 HydrophobicContact CB-CE 4.27Å; Q71-M76 WeakPolarHBondContact O-CG 3.17Å; Q71-M76 PolarHBondContact O-N 3.41Å; Q71-M76 VanDerWaalsContact O-N 3.16Å; M76-Q79 PolarHBondContact O-N 2.99Å; M76-A80 WeakPolarHBondContact O-CB 3.21Å; M76-A80 PolarHBondContact O-N 3.39Å |
| 77 | A | 89.2 | Confident | 85.9 | Confident | 62 Ų | 62 | 84.9 Ų | 84.9 | 51% | 0.512 | 42% | 0.421 | S | S | . | . | H | α-helix | trans | -64.9 | -41.8 | 176 | 0 | 0 | 0 | 0 | 0 | 112.5 | T73 I74 M75 A80 L81 | T73-A77 WeakPolarHBondContact O-CB 3.27Å; T73-A77 PolarHBondContact O-N 2.93Å; I74-A77 PolarHBondContact O-N 2.97Å; M75-A77 VanDerWaalsContact C-N 3.32Å; M75-A77 PolarHBondContact O-N 2.8Å; A77-A80 PolarHBondContact O-N 2.88Å; A77-L81 WeakPolarHBondContact O-CB 3.29Å; A77-L81 PolarHBondContact O-N 3.3Å |
| 78 | V | 90.1 | Very high | 84.4 | Confident | 73 Ų | 73 | 86.5 Ų | 86.5 | 44% | 0.442 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -65.6 | -40.4 | 175.5 | 170.1 | 0 | 0 | 0 | 0 | 110.8 | I74 M75 L81 T82 | I74-V78 HydrophobicContact CG2-CG2 4.29Å; I74-V78 WeakPolarHBondContact O-CB 3.25Å; I74-V78 WeakPolarHBondContact O-CG2 3.4Å; I74-V78 PolarHBondContact O-N 2.96Å; M75-V78 PolarHBondContact O-N 3.46Å; V78-L81 PolarHBondContact O-N 3Å; V78-T82 WeakPolarHBondContact O-CB 3.19Å; V78-T82 PolarHBondContact O-N 3.46Å; V78-T82 PolarHBondContact O-OG1 3.48Å |
| 79 | Q | 87.3 | Confident | 82.6 | Confident | 89 Ų | 89 | 89.5 Ų | 89.5 | 42% | 0.416 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -64.4 | -44.3 | 174.5 | -74.3 | 177.4 | -29.4 | 0 | 0 | 111.2 | M24 M75 M76 L81 T82 L83 | M24-Q79 HydrophobicContact CE-CB 3.92Å; M75-Q79 HydrophobicContact CG-CG 4.45Å; M75-Q79 WeakPolarHBondContact O-CB 3.17Å; M75-Q79 WeakPolarHBondContact O-CG 3.28Å; M75-Q79 PolarHBondContact O-N 3.21Å; M76-Q79 PolarHBondContact O-N 2.99Å; Q79-L81 VanDerWaalsContact C-N 3.31Å; Q79-L81 PolarHBondContact O-N 3.4Å; Q79-T82 WeakPolarHBondContact O-CB 3.35Å; Q79-T82 PolarHBondContact O-N 3.49Å; Q79-T82 VanDerWaalsContact O-N 3.1Å; Q79-L83 VanDerWaalsContact O-CG 3.27Å; Q79-L83 WeakPolarHBondContact O-CG 2.91Å; Q79-L83 PolarHBondContact O-N 2.87Å |
| 80 | A | 85.7 | Confident | 81 | Confident | 28 Ų | 28 | 85.2 Ų | 85.2 | 23% | 0.231 | 43% | 0.428 | C | S | . | . | H | α-helix | trans | -60.7 | -39.6 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | M24 M76 A77 R84 | M24-A80 VanDerWaalsContact CE-CA 3.44Å; M24-A80 HydrophobicContact CE-CB 3.67Å; M24-A80 VanDerWaalsContact CE-N 3.27Å; M24-A80 HydrophobicContact SD-CB 3.94Å; M76-A80 WeakPolarHBondContact O-CB 3.21Å; M76-A80 PolarHBondContact O-N 3.39Å; A77-A80 PolarHBondContact O-N 2.88Å; A80-R84 WeakPolarHBondContact O-CG 3.26Å; A80-R84 PolarHBondContact O-N 3.22Å |
| 81 | L | 85.6 | Confident | 79.2 | Confident | 107 Ų | 107 | 88.8 Ų | 88.8 | 56% | 0.56 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -66.3 | -44.4 | 172.4 | -177.4 | 61.8 | 0 | 0 | 0 | 111.3 | A77 V78 Q79 L83 R84 V85 | A77-L81 WeakPolarHBondContact O-CB 3.29Å; A77-L81 PolarHBondContact O-N 3.3Å; V78-L81 PolarHBondContact O-N 3Å; Q79-L81 VanDerWaalsContact C-N 3.31Å; Q79-L81 PolarHBondContact O-N 3.4Å; L81-L83 VanDerWaalsContact C-N 3.33Å; L81-L83 PolarHBondContact O-N 3.49Å; L81-R84 WeakPolarHBondContact O-CB 3.36Å; L81-R84 PolarHBondContact O-N 2.81Å; L81-R84 VanDerWaalsContact O-N 3.1Å; L81-V85 HydrophobicContact CD1-CG1 4.24Å; L81-V85 WeakPolarHBondContact O-CG2 3.19Å; L81-V85 PolarHBondContact O-N 2.85Å |
| 82 | T | 83.5 | Confident | 77.6 | Confident | 53 Ų | 53 | 92 Ų | 92 | 33% | 0.325 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -57.2 | -47.6 | 179.6 | -58.3 | 0 | 0 | 0 | 0 | 110.5 | V78 Q79 R84 V85 E86 | V78-T82 WeakPolarHBondContact O-CB 3.19Å; V78-T82 PolarHBondContact O-N 3.46Å; V78-T82 PolarHBondContact O-OG1 3.48Å; Q79-T82 WeakPolarHBondContact O-CB 3.35Å; Q79-T82 PolarHBondContact O-N 3.49Å; Q79-T82 VanDerWaalsContact O-N 3.1Å; T82-R84 VanDerWaalsContact C-N 3.31Å; T82-R84 PolarHBondContact O-N 3.42Å; T82-V85 CarbonylContact O-C 3.54Å; T82-V85 WeakPolarHBondContact O-CG2 3.3Å; T82-V85 PolarHBondContact O-N 3.41Å; T82-E86 WeakPolarHBondContact O-CG 3.28Å; T82-E86 PolarHBondContact O-N 2.84Å |
| 83 | L | 79.7 | Confident | 76.1 | Confident | 64 Ų | 64 | 96.2 Ų | 96.2 | 34% | 0.335 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -58.3 | -39.7 | 176.1 | -66.6 | 172.7 | 0 | 0 | 0 | 112.3 | I20 M24 Q79 L81 E86 | I20-L83 HydrophobicContact CB-CD1 4.33Å; I20-L83 HydrophobicContact CD1-CB 3.76Å; I20-L83 HydrophobicContact CD1-CD1 4.04Å; I20-L83 HydrophobicContact CG1-CD1 3.91Å; I20-L83 HydrophobicContact CG2-CD1 3.51Å; M24-L83 HydrophobicContact CE-CD1 3.56Å; Q79-L83 VanDerWaalsContact O-CG 3.27Å; Q79-L83 WeakPolarHBondContact O-CG 2.91Å; Q79-L83 PolarHBondContact O-N 2.87Å; L81-L83 VanDerWaalsContact C-N 3.33Å; L81-L83 PolarHBondContact O-N 3.49Å; L83-E86 VanDerWaalsContact CD2-OE1 3.3Å; L83-E86 WeakPolarHBondContact CD2-OE1 3.26Å |
| 84 | R | 78.3 | Confident | 74.2 | Confident | 165 Ų | 165 | 95.1 Ų | 95.1 | 62% | 0.623 | 47% | 0.466 | S | S | * | . | H | α-helix | trans | -67.8 | -36.7 | 175.1 | -71.1 | 178.9 | -179.2 | -149.7 | -0.2 | 112.6 | A80 L81 T82 | A80-R84 WeakPolarHBondContact O-CG 3.26Å; A80-R84 PolarHBondContact O-N 3.22Å; L81-R84 WeakPolarHBondContact O-CB 3.36Å; L81-R84 PolarHBondContact O-N 2.81Å; L81-R84 VanDerWaalsContact O-N 3.1Å; T82-R84 VanDerWaalsContact C-N 3.31Å; T82-R84 PolarHBondContact O-N 3.42Å |
| 85 | V | 78.2 | Confident | 72 | Confident | 50 Ų | 50 | 99.7 Ų | 99.7 | 30% | 0.303 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -92.4 | 5.2 | -178.5 | -56.8 | 0 | 0 | 0 | 0 | 113.8 | L81 T82 R87 T88 F89 | L81-V85 HydrophobicContact CD1-CG1 4.24Å; L81-V85 WeakPolarHBondContact O-CG2 3.19Å; L81-V85 PolarHBondContact O-N 2.85Å; T82-V85 CarbonylContact O-C 3.54Å; T82-V85 WeakPolarHBondContact O-CG2 3.3Å; T82-V85 PolarHBondContact O-N 3.41Å; V85-R87 PolarHBondContact O-N 2.89Å; V85-T88 CarbonylContact O-C 3.6Å; V85-T88 WeakPolarHBondContact O-CA 3.44Å; V85-T88 WeakPolarHBondContact O-CB 3.32Å; V85-T88 PolarHBondContact O-N 3.24Å; V85-F89 HydrophobicContact CG2-CB 4.1Å; V85-F89 PolarHBondContact O-N 3.28Å |
| 86 | E | 70.1 | Confident | 69.9 | Low | 72 Ų | 72 | 98.4 Ų | 98.4 | 34% | 0.336 | 50% | 0.501 | S | S | . | . | H | α-helix | trans | -51.5 | -35.9 | -175 | -84.8 | -177.4 | 165.7 | 0 | 0 | 113.3 | T82 L83 T88 T90 I101 | T82-E86 WeakPolarHBondContact O-CG 3.28Å; T82-E86 PolarHBondContact O-N 2.84Å; L83-E86 VanDerWaalsContact CD2-OE1 3.3Å; L83-E86 WeakPolarHBondContact CD2-OE1 3.26Å; E86-T88 VanDerWaalsContact C-N 3.26Å; E86-T88 PolarHBondContact O-N 2.99Å; E86-T90 WeakPolarHBondContact O-CB 3.26Å; E86-T90 PolarHBondContact O-N 2.86Å; E86-T90 VanDerWaalsContact O-N 3.12Å; E86-T90 PolarHBondContact O-OG1 3.18Å; E86-I101 HydrophobicContact CB-CD1 4.29Å; E86-I101 WeakPolarHBondContact OE2-CD1 3.06Å |
| 87 | R | 57.5 | Low | 68 | Low | 216 Ų | 216 | 101.3 Ų | 101.3 | 82% | 0.815 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -66.1 | -25.9 | 174.9 | -81.3 | -174.3 | -100.4 | 168.2 | -6.3 | 114.1 | V85 | V85-R87 PolarHBondContact O-N 2.89Å |
| 88 | T | 61.6 | Low | 66 | Low | 95 Ų | 95 | 100.3 Ų | 100.3 | 58% | 0.583 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -96.7 | -40.6 | -179.9 | -52.3 | 0 | 0 | 0 | 0 | 111.7 | V85 E86 R91 L92 | V85-T88 CarbonylContact O-C 3.6Å; V85-T88 WeakPolarHBondContact O-CA 3.44Å; V85-T88 WeakPolarHBondContact O-CB 3.32Å; V85-T88 PolarHBondContact O-N 3.24Å; E86-T88 VanDerWaalsContact C-N 3.26Å; E86-T88 PolarHBondContact O-N 2.99Å; T88-R91 WeakPolarHBondContact O-CB 3.33Å; T88-R91 PolarHBondContact O-N 3.43Å; T88-L92 PolarHBondContact O-N 2.95Å |
| 89 | F | 56.7 | Low | 64.2 | Low | 92 Ų | 92 | 99.8 Ų | 99.8 | 40% | 0.404 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -69.3 | -37.3 | -179.3 | -168.7 | -96.8 | 0 | 0 | 0 | 112 | V85 R91 L92 F93 | V85-F89 HydrophobicContact CG2-CB 4.1Å; V85-F89 PolarHBondContact O-N 3.28Å; F89-R91 PolarHBondContact O-N 3.45Å; F89-L92 PolarHBondContact O-N 3.4Å; F89-F93 HydrophobicContact CD1-CB 4.49Å; F89-F93 HydrophobicContact CD2-CD2 4.26Å; F89-F93 HydrophobicContact CE1-CB 3.97Å; F89-F93 AromaticContact CE1-CD2 3.96Å; F89-F93 HydrophobicContact CE1-CD2 3.96Å; F89-F93 HydrophobicContact CE1-CG 4.12Å; F89-F93 AromaticContact CE2-CD2 3.43Å; F89-F93 HydrophobicContact CE2-CD2 3.43Å; F89-F93 VanDerWaalsContact CE2-CD2 3.43Å; F89-F93 AromaticContact CE2-CE2 3.8Å; F89-F93 HydrophobicContact CE2-CE2 3.8Å; F89-F93 HydrophobicContact CE2-CG 4.38Å; F89-F93 HydrophobicContact CZ-CB 4.14Å; F89-F93 AromaticContact CZ-CD2 3.24Å; F89-F93 HydrophobicContact CZ-CD2 3.24Å; F89-F93 AromaticContact CZ-CE2 3.76Å; F89-F93 HydrophobicContact CZ-CE2 3.76Å; F89-F93 AromaticContact CZ-CG 3.79Å; F89-F93 HydrophobicContact CZ-CG 3.79Å; F89-F93 PolarHBondContact O-N 3.28Å |
| 90 | T | 59.3 | Low | 62.2 | Low | 42 Ų | 42 | 101.2 Ų | 101.2 | 26% | 0.258 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -63 | -9.1 | 170.9 | -51.7 | 0 | 0 | 0 | 0 | 112.6 | E86 N94 V99 | E86-T90 WeakPolarHBondContact O-CB 3.26Å; E86-T90 PolarHBondContact O-N 2.86Å; E86-T90 VanDerWaalsContact O-N 3.12Å; E86-T90 PolarHBondContact O-OG1 3.18Å; T90-N94 VanDerWaalsContact CG2-ND2 3.25Å; T90-N94 WeakPolarHBondContact CG2-ND2 3.34Å; T90-N94 WeakPolarHBondContact O-CB 3.17Å; T90-N94 PolarHBondContact O-ND2 3.35Å; T90-V99 HydrophobicContact CG2-CB 4.21Å |
| 91 | R | 55.8 | Low | 60.6 | Low | 216 Ų | 216 | 103.6 Ų | 103.6 | 82% | 0.815 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -97.4 | -24.4 | 169.3 | -64.2 | -175.6 | -179.2 | 163.6 | 0.5 | 113.1 | T88 F89 | T88-R91 WeakPolarHBondContact O-CB 3.33Å; T88-R91 PolarHBondContact O-N 3.43Å; F89-R91 PolarHBondContact O-N 3.45Å |
| 92 | L | 58.2 | Low | 58.6 | Low | 142 Ų | 142 | 106.1 Ų | 106.1 | 74% | 0.743 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -85.7 | -36.3 | -176.4 | -142 | 80.9 | 0 | 0 | 0 | 112.4 | T88 F89 | T88-L92 PolarHBondContact O-N 2.95Å; F89-L92 PolarHBondContact O-N 3.4Å |
| 93 | F | 59.9 | Low | 56.7 | Low | 152 Ų | 152 | 108.3 Ų | 108.3 | 67% | 0.667 | 56% | 0.563 | S | S | * | * | S | Bend | trans | -107.1 | 4.3 | -176.7 | -95.8 | -86.5 | 0 | 0 | 0 | 114.6 | F89 M95 | F89-F93 HydrophobicContact CD1-CB 4.49Å; F89-F93 HydrophobicContact CD2-CD2 4.26Å; F89-F93 HydrophobicContact CE1-CB 3.97Å; F89-F93 AromaticContact CE1-CD2 3.96Å; F89-F93 HydrophobicContact CE1-CD2 3.96Å; F89-F93 HydrophobicContact CE1-CG 4.12Å; F89-F93 AromaticContact CE2-CD2 3.43Å; F89-F93 HydrophobicContact CE2-CD2 3.43Å; F89-F93 VanDerWaalsContact CE2-CD2 3.43Å; F89-F93 AromaticContact CE2-CE2 3.8Å; F89-F93 HydrophobicContact CE2-CE2 3.8Å; F89-F93 HydrophobicContact CE2-CG 4.38Å; F89-F93 HydrophobicContact CZ-CB 4.14Å; F89-F93 AromaticContact CZ-CD2 3.24Å; F89-F93 HydrophobicContact CZ-CD2 3.24Å; F89-F93 AromaticContact CZ-CE2 3.76Å; F89-F93 HydrophobicContact CZ-CE2 3.76Å; F89-F93 AromaticContact CZ-CG 3.79Å; F89-F93 HydrophobicContact CZ-CG 3.79Å; F89-F93 PolarHBondContact O-N 3.28Å; F93-M95 PolarHBondContact O-N 3.04Å |
| 94 | N | 50.3 | Low | 54.9 | Low | 60 Ų | 60 | 108.4 Ų | 108.4 | 32% | 0.321 | 57% | 0.573 | S | S | . | * | trans | -80.2 | 89.9 | -179.7 | -124.1 | -36.6 | 0 | 0 | 0 | 113.3 | T90 G96 T97 | T90-N94 VanDerWaalsContact CG2-ND2 3.25Å; T90-N94 WeakPolarHBondContact CG2-ND2 3.34Å; T90-N94 WeakPolarHBondContact O-CB 3.17Å; T90-N94 PolarHBondContact O-ND2 3.35Å; N94-G96 PolarHBondContact O-N 3.41Å; N94-G96 VanDerWaalsContact O-N 3.08Å; N94-T97 VanDerWaalsContact CG-O 3.29Å; N94-T97 PolarHBondContact ND2-O 2.69Å; N94-T97 WeakPolarHBondContact OD1-CA 3.35Å; N94-T97 PolarHBondContact OD1-N 3.24Å; N94-T97 PolarHBondContact OD1-O 2.97Å | ||
| 95 | M | 46.8 | Very low | 52.6 | Low | 190 Ų | 190 | 111.1 Ų | 111.1 | 94% | 0.936 | 59% | 0.589 | S | S | * | * | S | Bend | trans | -72.3 | 72 | 145.6 | -87.9 | 177.9 | 159.8 | 0 | 0 | 109.7 | F93 | F93-M95 PolarHBondContact O-N 3.04Š|
| 96 | G | 46.9 | Very low | 50.5 | Low | 75 Ų | 75 | 111.9 Ų | 111.9 | 77% | 0.773 | 61% | 0.608 | S | S | * | * | S | Bend | trans | 87.1 | 10.4 | 153.7 | 0 | 0 | 0 | 0 | 0 | 119.5 | N94 | N94-G96 PolarHBondContact O-N 3.41Å; N94-G96 VanDerWaalsContact O-N 3.08Å |
| 97 | T | 47.1 | Very low | 49.1 | Very low | 85 Ų | 85 | 110.3 Ų | 110.3 | 52% | 0.521 | 61% | 0.611 | S | S | . | * | trans | -120.2 | 84.4 | 175.3 | -42.8 | 0 | 0 | 0 | 0 | 110.9 | N94 V99 | N94-T97 VanDerWaalsContact CG-O 3.29Å; N94-T97 PolarHBondContact ND2-O 2.69Å; N94-T97 WeakPolarHBondContact OD1-CA 3.35Å; N94-T97 PolarHBondContact OD1-N 3.24Å; N94-T97 PolarHBondContact OD1-O 2.97Å; T97-V99 PolarHBondContact O-N 2.98Å | ||
| 98 | G | 48.3 | Very low | 47.9 | Very low | 40 Ų | 40 | 103.3 Ų | 103.3 | 41% | 0.412 | 60% | 0.595 | S | S | . | * | trans | -56.6 | 109.7 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.1 | D100 R113 | G98-D100 PolarHBondContact O-N 2.84Å; G98-R113 PolarHBondContact O-NH2 3.41Å | ||
| 99 | V | 52.3 | Low | 47.3 | Very low | 63 Ų | 63 | 104.1 Ų | 104.1 | 38% | 0.382 | 60% | 0.595 | S | S | . | * | trans | -91.3 | 92.3 | 167.4 | -178.3 | 0 | 0 | 0 | 0 | 106.2 | T90 T97 I101 I112 | T90-V99 HydrophobicContact CG2-CB 4.21Å; T97-V99 PolarHBondContact O-N 2.98Å; V99-I101 HydrophobicContact CG1-CG1 4.13Å; V99-I101 PolarHBondContact O-N 3.32Å; V99-I112 HydrophobicContact CG1-CG2 3.66Å | ||
| 100 | D | 44.7 | Very low | 46.6 | Very low | 118 Ų | 118 | 106.8 Ų | 106.8 | 63% | 0.631 | 61% | 0.609 | S | S | * | * | trans | -77.7 | 95.8 | 172.4 | -79.6 | -35.2 | 0 | 0 | 0 | 109.1 | G98 Q102 I112 | G98-D100 PolarHBondContact O-N 2.84Å; D100-Q102 PolarHBondContact O-N 3.42Å; D100-I112 WeakPolarHBondContact O-CG2 3.4Å | ||
| 101 | I | 52.3 | Low | 46.1 | Very low | 78 Ų | 78 | 108.8 Ų | 108.8 | 40% | 0.4 | 62% | 0.623 | S | S | . | * | trans | -70.4 | 83.3 | 167.2 | -55.7 | -175.6 | 0 | 0 | 0 | 107.5 | E86 V99 A103 I112 | E86-I101 HydrophobicContact CB-CD1 4.29Å; E86-I101 WeakPolarHBondContact OE2-CD1 3.06Å; V99-I101 HydrophobicContact CG1-CG1 4.13Å; V99-I101 PolarHBondContact O-N 3.32Å; I101-A103 PolarHBondContact O-N 2.91Å; I101-I112 HydrophobicContact CB-CD1 3.75Å; I101-I112 HydrophobicContact CB-CG1 4.44Å; I101-I112 HydrophobicContact CG1-CD1 3.91Å; I101-I112 HydrophobicContact CG1-CG2 4.41Å; I101-I112 HydrophobicContact CG2-CD1 3.37Å; I101-I112 HydrophobicContact CG2-CG1 4.47Å | ||
| 102 | Q | 42.4 | Very low | 45.8 | Very low | 160 Ų | 160 | 100.9 Ų | 100.9 | 75% | 0.748 | 60% | 0.596 | S | S | * | * | trans | -77.4 | 115 | 169 | -75.9 | -169.1 | 15 | 0 | 0 | 108.9 | D100 A104 | D100-Q102 PolarHBondContact O-N 3.42Å; Q102-A104 VanDerWaalsContact C-N 3.34Å; Q102-A104 PolarHBondContact O-N 3.28Å | ||
| 103 | A | 44.8 | Very low | 45.5 | Very low | 99 Ų | 99 | 101.5 Ų | 101.5 | 82% | 0.818 | 59% | 0.588 | S | S | * | * | trans | -61.8 | 96 | 166.8 | 0 | 0 | 0 | 0 | 0 | 108.7 | I101 K105 | I101-A103 PolarHBondContact O-N 2.91Å; A103-K105 PolarHBondContact O-N 2.77Å | ||
| 104 | A | 40.6 | Very low | 45.4 | Very low | 66 Ų | 66 | 97.3 Ų | 97.3 | 55% | 0.545 | 58% | 0.576 | S | S | . | * | trans | -59.9 | 122.7 | 172.5 | 0 | 0 | 0 | 0 | 0 | 108.7 | Q102 G106 | Q102-A104 VanDerWaalsContact C-N 3.34Å; Q102-A104 PolarHBondContact O-N 3.28Å; A104-G106 VanDerWaalsContact C-N 3.31Å; A104-G106 PolarHBondContact O-N 2.92Å | ||
| 105 | K | 31.1 | Very low | 46.3 | Very low | 222 Ų | 222 | 100 Ų | 100 | 97% | 0.965 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -59.5 | 92.9 | 166.7 | -91.8 | 179.4 | 167 | 179.3 | 0 | 108.2 | A103 | A103-K105 PolarHBondContact O-N 2.77Š|
| 106 | G | 34 | Very low | 47.7 | Very low | 67 Ų | 67 | 98.9 Ų | 98.9 | 69% | 0.691 | 58% | 0.581 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 157.5 | 16 | 176 | 0 | 0 | 0 | 0 | 0 | 117.6 | A104 S108 | A104-G106 VanDerWaalsContact C-N 3.31Å; A104-G106 PolarHBondContact O-N 2.92Å; G106-S108 PolarHBondContact O-N 3.12Å |
| 107 | G | 40.5 | Very low | 49.2 | Very low | 39 Ų | 39 | 98.5 Ų | 98.5 | 40% | 0.402 | 57% | 0.571 | S | S | . | * | S | Bend | trans | 71.8 | -19.5 | 174.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | L109 | G107-L109 PolarHBondContact O-N 3.06Š|
| 108 | S | 32.8 | Very low | 50.7 | Low | 68 Ų | 68 | 99.2 Ų | 99.2 | 48% | 0.476 | 57% | 0.568 | S | S | . | * | trans | -77.1 | 101.5 | 171.7 | -164.5 | 0 | 0 | 0 | 0 | 109.9 | G106 E110 | G106-S108 PolarHBondContact O-N 3.12Å; S108-E110 PolarHBondContact O-N 3.38Å; S108-E110 VanDerWaalsContact O-N 3.09Å; S108-E110 WeakPolarHBondContact OG-CG 3.37Å | ||
| 109 | L | 48.4 | Very low | 52.2 | Low | 112 Ų | 112 | 103 Ų | 103 | 59% | 0.586 | 57% | 0.573 | S | S | * | * | trans | -81.2 | 74.5 | 166.1 | -156.7 | 147.7 | 0 | 0 | 0 | 106.3 | R19 G107 | R19-L109 VanDerWaalsContact NH2-CD1 3.34Å; G107-L109 PolarHBondContact O-N 3.06Å | ||
| 110 | E | 41.6 | Very low | 53.7 | Low | 149 Ų | 149 | 103.6 Ų | 103.6 | 70% | 0.696 | 57% | 0.573 | S | S | * | * | trans | -64.2 | 135.7 | 168.5 | -66.6 | -157.8 | 124.4 | 0 | 0 | 108.1 | S108 I112 | S108-E110 PolarHBondContact O-N 3.38Å; S108-E110 VanDerWaalsContact O-N 3.09Å; S108-E110 WeakPolarHBondContact OG-CG 3.37Å; E110-I112 PolarHBondContact O-N 2.94Å | ||
| 111 | P | 49.8 | Very low | 55.7 | Low | 84 Ų | 84 | 102.7 Ų | 102.7 | 55% | 0.545 | 57% | 0.567 | S | S | . | * | trans | -55.3 | 119.4 | 178.5 | 21.8 | -31.3 | 0 | 0 | 0 | 109.3 | R113 | P111-R113 PolarHBondContact O-N 3.42Š| ||
| 112 | I | 49.8 | Very low | 57.3 | Low | 50 Ų | 50 | 105.1 Ų | 105.1 | 26% | 0.256 | 58% | 0.577 | S | S | . | * | S | Bend | trans | -60.7 | 100.5 | 174.2 | -71.8 | 122.7 | 0 | 0 | 0 | 107.5 | V99 D100 I101 E110 | V99-I112 HydrophobicContact CG1-CG2 3.66Å; D100-I112 WeakPolarHBondContact O-CG2 3.4Å; I101-I112 HydrophobicContact CB-CD1 3.75Å; I101-I112 HydrophobicContact CB-CG1 4.44Å; I101-I112 HydrophobicContact CG1-CD1 3.91Å; I101-I112 HydrophobicContact CG1-CG2 4.41Å; I101-I112 HydrophobicContact CG2-CD1 3.37Å; I101-I112 HydrophobicContact CG2-CG1 4.47Å; E110-I112 PolarHBondContact O-N 2.94Å |
| 113 | R | 51.9 | Low | 59.4 | Low | 155 Ų | 155 | 102.3 Ų | 102.3 | 59% | 0.585 | 57% | 0.567 | S | S | * | * | S | Bend | trans | 65 | 111.7 | -171 | -56.3 | -177 | -176.2 | -169.2 | 4 | 111.8 | G98 P111 D115 | G98-R113 PolarHBondContact O-NH2 3.41Å; P111-R113 PolarHBondContact O-N 3.42Å; R113-D115 PolarHBondContact O-N 3.49Å |
| 114 | P | 56.2 | Low | 61.3 | Low | 63 Ų | 63 | 105.6 Ų | 105.6 | 41% | 0.409 | 56% | 0.558 | S | S | . | * | trans | -57.6 | 122.5 | 165.4 | 26.4 | -32.4 | 0 | 0 | 0 | 106.3 | F116 Q118 K119 | P114-F116 PolarHBondContact O-N 3.01Å; P114-Q118 HydrophobicContact CB-CB 4.2Å; P114-K119 HydrophobicContact CB-CB 4.19Å; P114-K119 HydrophobicContact CG-CB 4.25Å; P114-K119 HydrophobicContact CG-CD 4.43Å | ||
| 115 | D | 69.7 | Low | 63.5 | Low | 118 Ų | 118 | 108.5 Ų | 108.5 | 63% | 0.631 | 56% | 0.556 | S | S | * | * | trans | -48.7 | 143.8 | 169.4 | -88.5 | -35 | 0 | 0 | 0 | 107.7 | R113 A117 Q118 K119 | R113-D115 PolarHBondContact O-N 3.49Å; D115-A117 CarbonylContact O-C 3.51Å; D115-A117 PolarHBondContact O-N 3.45Å; D115-Q118 HydrophobicContact CB-CG 4.48Å; D115-Q118 WeakPolarHBondContact O-CA 3.13Å; D115-Q118 PolarHBondContact O-N 3.33Å; D115-K119 PolarHBondContact O-N 3.18Å | ||
| 116 | F | 77.1 | Confident | 66.3 | Low | 165 Ų | 165 | 101 Ų | 101 | 72% | 0.724 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -47.4 | -35.9 | 179 | 172.5 | -99.9 | 0 | 0 | 0 | 111.3 | P114 K119 M120 | P114-F116 PolarHBondContact O-N 3.01Å; F116-K119 PolarHBondContact O-N 2.97Å; F116-M120 HydrophobicContact CD1-CG 4.14Å; F116-M120 HydrophobicContact CD2-CG 4.2Å; F116-M120 HydrophobicContact CE1-CG 3.73Å; F116-M120 HydrophobicContact CE2-CG 3.8Å; F116-M120 HydrophobicContact CE2-SD 4.12Å; F116-M120 HydrophobicContact CG-CG 4.36Å; F116-M120 HydrophobicContact CZ-CG 3.54Å; F116-M120 HydrophobicContact CZ-SD 3.9Å; F116-M120 VanDerWaalsContact O-CB 3.26Å; F116-M120 WeakPolarHBondContact O-CB 3.14Å; F116-M120 WeakPolarHBondContact O-CG 3.31Å; F116-M120 PolarHBondContact O-N 3.49Å |
| 117 | A | 77.1 | Confident | 68.9 | Low | 68 Ų | 68 | 101 Ų | 101 | 56% | 0.562 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -61.6 | -48 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | D115 M120 L121 | D115-A117 CarbonylContact O-C 3.51Å; D115-A117 PolarHBondContact O-N 3.45Å; A117-M120 PolarHBondContact O-N 3.22Å; A117-L121 VanDerWaalsContact O-CB 3.26Å; A117-L121 WeakPolarHBondContact O-CB 3.11Å; A117-L121 PolarHBondContact O-N 3.48Å |
| 118 | Q | 78.7 | Confident | 71.3 | Confident | 99 Ų | 99 | 102.5 Ų | 102.5 | 46% | 0.463 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -63.3 | -44.2 | 176.5 | -71.7 | -175 | -33.8 | 0 | 0 | 111 | P114 D115 M120 L121 E122 | P114-Q118 HydrophobicContact CB-CB 4.2Å; D115-Q118 HydrophobicContact CB-CG 4.48Å; D115-Q118 WeakPolarHBondContact O-CA 3.13Å; D115-Q118 PolarHBondContact O-N 3.33Å; Q118-M120 VanDerWaalsContact C-N 3.34Å; Q118-M120 PolarHBondContact O-N 3.1Å; Q118-L121 PolarHBondContact O-N 2.92Å; Q118-E122 WeakPolarHBondContact O-CB 3.31Å; Q118-E122 PolarHBondContact O-N 3.43Å |
| 119 | K | 79.8 | Confident | 73.9 | Confident | 121 Ų | 121 | 102.6 Ų | 102.6 | 53% | 0.526 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -63.6 | -39.8 | 178.6 | -165.4 | 173.5 | -178.8 | 172.8 | 0 | 112.1 | P114 D115 F116 N123 | P114-K119 HydrophobicContact CB-CB 4.19Å; P114-K119 HydrophobicContact CG-CB 4.25Å; P114-K119 HydrophobicContact CG-CD 4.43Å; D115-K119 PolarHBondContact O-N 3.18Å; F116-K119 PolarHBondContact O-N 2.97Å; K119-N123 WeakPolarHBondContact CG-ND2 2.91Å; K119-N123 VanDerWaalsContact O-CB 3.25Å; K119-N123 WeakPolarHBondContact O-CB 3.25Å; K119-N123 PolarHBondContact O-N 3.2Å; K119-N123 PolarHBondContact O-ND2 3.31Å |
| 120 | M | 84.9 | Confident | 75.7 | Confident | 75 Ų | 75 | 104.7 Ų | 104.7 | 37% | 0.369 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -68 | -40.3 | 174.7 | -77.8 | -67 | -62.3 | 0 | 0 | 111.9 | F116 A117 Q118 W124 Y125 | F116-M120 HydrophobicContact CD1-CG 4.14Å; F116-M120 HydrophobicContact CD2-CG 4.2Å; F116-M120 HydrophobicContact CE1-CG 3.73Å; F116-M120 HydrophobicContact CE2-CG 3.8Å; F116-M120 HydrophobicContact CE2-SD 4.12Å; F116-M120 HydrophobicContact CG-CG 4.36Å; F116-M120 HydrophobicContact CZ-CG 3.54Å; F116-M120 HydrophobicContact CZ-SD 3.9Å; F116-M120 VanDerWaalsContact O-CB 3.26Å; F116-M120 WeakPolarHBondContact O-CB 3.14Å; F116-M120 WeakPolarHBondContact O-CG 3.31Å; F116-M120 PolarHBondContact O-N 3.49Å; A117-M120 PolarHBondContact O-N 3.22Å; Q118-M120 VanDerWaalsContact C-N 3.34Å; Q118-M120 PolarHBondContact O-N 3.1Å; M120-W124 HydrophobicContact CE-CB 4.48Å; M120-W124 HydrophobicContact CE-CD2 4.44Å; M120-W124 HydrophobicContact CE-CE3 4.2Å; M120-W124 WeakPolarHBondContact O-CB 3.48Å; M120-W124 PolarHBondContact O-N 3.11Å; M120-Y125 PolarHBondContact O-N 3.22Å; M120-Y125 VanDerWaalsContact O-N 3.12Å |
| 121 | L | 86.9 | Confident | 78.1 | Confident | 98 Ų | 98 | 103 Ų | 103 | 51% | 0.513 | 51% | 0.513 | S | S | . | . | I | π-helix | trans | -63.6 | -50.6 | 178 | -172.6 | 147.9 | 0 | 0 | 0 | 110.3 | A117 Q118 Y125 V126 | A117-L121 VanDerWaalsContact O-CB 3.26Å; A117-L121 WeakPolarHBondContact O-CB 3.11Å; A117-L121 PolarHBondContact O-N 3.48Å; Q118-L121 PolarHBondContact O-N 2.92Å; L121-Y125 HydrophobicContact CG-CD1 4.35Å; L121-Y125 WeakPolarHBondContact O-CB 3.44Å; L121-Y125 PolarHBondContact O-N 3.07Å; L121-V126 HydrophobicContact CD2-CG2 3.72Å; L121-V126 VanDerWaalsContact O-CG2 3.27Å; L121-V126 WeakPolarHBondContact O-CG2 3.47Å; L121-V126 PolarHBondContact O-N 2.93Å |
| 122 | E | 85.3 | Confident | 80 | Confident | 130 Ų | 130 | 109.6 Ų | 109.6 | 61% | 0.607 | 53% | 0.527 | S | S | * | . | I | π-helix | trans | -69.3 | -47.4 | -177.6 | -170.8 | -177.9 | 175.2 | 0 | 0 | 112.7 | Q118 P127 | Q118-E122 WeakPolarHBondContact O-CB 3.31Å; Q118-E122 PolarHBondContact O-N 3.43Å; E122-P127 WeakPolarHBondContact O-CD 3.42Å |
| 123 | N | 86.8 | Confident | 82 | Confident | 100 Ų | 100 | 111.6 Ų | 111.6 | 54% | 0.535 | 54% | 0.542 | S | S | . | . | I | π-helix | trans | -84.1 | -26 | -172 | -67.3 | -66.4 | 0 | 0 | 0 | 114.3 | K119 P127 | K119-N123 WeakPolarHBondContact CG-ND2 2.91Å; K119-N123 VanDerWaalsContact O-CB 3.25Å; K119-N123 WeakPolarHBondContact O-CB 3.25Å; K119-N123 PolarHBondContact O-N 3.2Å; K119-N123 PolarHBondContact O-ND2 3.31Å; N123-P127 WeakPolarHBondContact O-CG 3.4Å |
| 124 | W | 83.6 | Confident | 83.8 | Confident | 169 Ų | 169 | 108 Ų | 108 | 64% | 0.64 | 53% | 0.532 | S | S | * | . | I | π-helix | trans | -117.5 | -50.8 | -174.1 | -172.8 | 73.6 | 0 | 0 | 0 | 112 | M120 V128 | M120-W124 HydrophobicContact CE-CB 4.48Å; M120-W124 HydrophobicContact CE-CD2 4.44Å; M120-W124 HydrophobicContact CE-CE3 4.2Å; M120-W124 WeakPolarHBondContact O-CB 3.48Å; M120-W124 PolarHBondContact O-N 3.11Å; W124-V128 WeakPolarHBondContact O-CB 3.49Å; W124-V128 WeakPolarHBondContact O-CG2 3.4Å; W124-V128 PolarHBondContact O-N 2.96Å |
| 125 | Y | 87.9 | Confident | 85.4 | Confident | 126 Ų | 126 | 113.6 Ų | 113.6 | 49% | 0.494 | 55% | 0.545 | S | S | . | . | I | π-helix | trans | -71.9 | -49.8 | -174.6 | -174.4 | -99.9 | 0 | 0 | 0 | 113.1 | M120 L121 V128 L129 | M120-Y125 PolarHBondContact O-N 3.22Å; M120-Y125 VanDerWaalsContact O-N 3.12Å; L121-Y125 HydrophobicContact CG-CD1 4.35Å; L121-Y125 WeakPolarHBondContact O-CB 3.44Å; L121-Y125 PolarHBondContact O-N 3.07Å; Y125-V128 PolarHBondContact O-N 2.89Å; Y125-L129 HydrophobicContact CE1-CD2 3.87Å; Y125-L129 WeakPolarHBondContact O-CB 3.28Å; Y125-L129 PolarHBondContact O-N 3.34Å |
| 126 | V | 88.7 | Confident | 86.6 | Confident | 64 Ų | 64 | 114.6 Ų | 114.6 | 39% | 0.388 | 54% | 0.544 | S | S | . | . | H | α-helix | trans | -58.4 | -50.3 | -179.5 | 171.3 | 0 | 0 | 0 | 0 | 112.8 | L121 V128 L129 M130 | L121-V126 HydrophobicContact CD2-CG2 3.72Å; L121-V126 VanDerWaalsContact O-CG2 3.27Å; L121-V126 WeakPolarHBondContact O-CG2 3.47Å; L121-V126 PolarHBondContact O-N 2.93Å; V126-V128 VanDerWaalsContact C-N 3.34Å; V126-V128 PolarHBondContact O-N 3.26Å; V126-L129 PolarHBondContact O-N 2.75Å; V126-M130 WeakPolarHBondContact O-CB 3.46Å; V126-M130 PolarHBondContact O-N 3.21Å |
| 127 | P | 89.6 | Confident | 87.3 | Confident | 69 Ų | 69 | 112.2 Ų | 112.2 | 45% | 0.448 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -67.7 | -33.4 | -179.2 | 22.6 | -32.2 | 0 | 0 | 0 | 112.9 | E122 N123 H131 | E122-P127 WeakPolarHBondContact O-CD 3.42Å; N123-P127 WeakPolarHBondContact O-CG 3.4Å; P127-H131 PolarHBondContact O-N 3.41Å |
| 128 | V | 89.9 | Confident | 88.1 | Confident | 69 Ų | 69 | 112.1 Ų | 112.1 | 42% | 0.418 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -65.8 | -43.7 | 174.5 | 170 | 0 | 0 | 0 | 0 | 110.5 | W124 Y125 V126 H131 M134 | W124-V128 WeakPolarHBondContact O-CB 3.49Å; W124-V128 WeakPolarHBondContact O-CG2 3.4Å; W124-V128 PolarHBondContact O-N 2.96Å; Y125-V128 PolarHBondContact O-N 2.89Å; V126-V128 VanDerWaalsContact C-N 3.34Å; V126-V128 PolarHBondContact O-N 3.26Å; V128-H131 PolarHBondContact O-N 2.99Å; V128-M134 HydrophobicContact CG1-CG 4.26Å; V128-M134 WeakPolarHBondContact O-CB 3.34Å; V128-M134 VanDerWaalsContact O-CG 3.31Å; V128-M134 WeakPolarHBondContact O-CG 3.32Å |
| 129 | L | 87.9 | Confident | 88.8 | Confident | 70 Ų | 70 | 111 Ų | 111 | 37% | 0.366 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -68.8 | -34.5 | 179.9 | -170.7 | 62.6 | 0 | 0 | 0 | 112.8 | Y125 V126 H131 I138 | Y125-L129 HydrophobicContact CE1-CD2 3.87Å; Y125-L129 WeakPolarHBondContact O-CB 3.28Å; Y125-L129 PolarHBondContact O-N 3.34Å; V126-L129 PolarHBondContact O-N 2.75Å; L129-H131 VanDerWaalsContact C-N 3.32Å; L129-H131 PolarHBondContact O-N 3.25Å; L129-I138 HydrophobicContact CD1-CD1 3.15Å |
| 130 | M | 87.2 | Confident | 89.6 | Confident | 156 Ų | 156 | 108.4 Ų | 108.4 | 77% | 0.768 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -74.4 | -17.8 | 179.4 | -92.2 | -78.2 | 159.5 | 0 | 0 | 114.2 | V126 R132 | V126-M130 WeakPolarHBondContact O-CB 3.46Å; V126-M130 PolarHBondContact O-N 3.21Å; M130-R132 PolarHBondContact O-N 3.47Å |
| 131 | H | 90.4 | Very high | 90 | Very high | 114 Ų | 114 | 108.5 Ų | 108.5 | 53% | 0.528 | 53% | 0.528 | S | S | . | . | S | Bend | trans | -63.6 | 130.6 | 179.9 | -163.1 | -89.7 | 0 | 0 | 0 | 111 | P127 V128 L129 V133 M134 R135 | P127-H131 PolarHBondContact O-N 3.41Å; V128-H131 PolarHBondContact O-N 2.99Å; L129-H131 VanDerWaalsContact C-N 3.32Å; L129-H131 PolarHBondContact O-N 3.25Å; H131-V133 PolarHBondContact ND1-N 3.42Å; H131-V133 PolarHBondContact O-N 3.28Å; H131-V133 VanDerWaalsContact O-N 3.1Å; H131-M134 HydrophobicContact CB-CB 4.33Å; H131-M134 PolarHBondContact O-N 3.49Å; H131-R135 PolarHBondContact O-N 2.9Å |
| 132 | R | 90.3 | Very high | 90.5 | Very high | 223 Ų | 223 | 110 Ų | 110 | 84% | 0.842 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -53.3 | -39.2 | -173.8 | -172.7 | -179.6 | -66.9 | -172.9 | 0.5 | 113 | M130 F136 | M130-R132 PolarHBondContact O-N 3.47Å; R132-F136 PolarHBondContact O-N 3.05Å |
| 133 | V | 91.7 | Very high | 91 | Very high | 92 Ų | 92 | 109 Ų | 109 | 56% | 0.558 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -66.9 | -44 | 177.5 | -178.7 | 0 | 0 | 0 | 0 | 111.2 | H131 F136 M137 | H131-V133 PolarHBondContact ND1-N 3.42Å; H131-V133 PolarHBondContact O-N 3.28Å; H131-V133 VanDerWaalsContact O-N 3.1Å; V133-F136 PolarHBondContact O-N 2.94Å; V133-M137 HydrophobicContact CG1-CG 4.36Å; V133-M137 VanDerWaalsContact O-CG 3.28Å; V133-M137 WeakPolarHBondContact O-CG 3.4Å; V133-M137 PolarHBondContact O-N 3.23Å |
| 134 | M | 90.5 | Very high | 91.5 | Very high | 78 Ų | 78 | 109.5 Ų | 109.5 | 38% | 0.384 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -67.2 | -41.1 | -178.5 | -171.7 | 56.9 | -176.2 | 0 | 0 | 111.3 | V128 H131 F136 M137 I138 | V128-M134 HydrophobicContact CG1-CG 4.26Å; V128-M134 WeakPolarHBondContact O-CB 3.34Å; V128-M134 VanDerWaalsContact O-CG 3.31Å; V128-M134 WeakPolarHBondContact O-CG 3.32Å; H131-M134 HydrophobicContact CB-CB 4.33Å; H131-M134 PolarHBondContact O-N 3.49Å; M134-F136 VanDerWaalsContact C-N 3.3Å; M134-F136 PolarHBondContact O-N 3.37Å; M134-M137 PolarHBondContact O-N 3.18Å; M134-M137 HydrophobicContact SD-CB 4.47Å; M134-I138 HydrophobicContact CE-CD1 3.89Å; M134-I138 HydrophobicContact CE-CG1 3.83Å; M134-I138 HydrophobicContact CG-CD1 3.96Å; M134-I138 HydrophobicContact CG-CG1 4.43Å; M134-I138 WeakPolarHBondContact O-CG1 3.38Å; M134-I138 PolarHBondContact O-N 3.3Å; M134-I138 HydrophobicContact SD-CG1 4.43Å |
| 135 | R | 90.3 | Very high | 92.1 | Very high | 181 Ų | 181 | 108.4 Ų | 108.4 | 68% | 0.683 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -56.7 | -44 | 173 | -174.4 | 176.7 | 177.3 | 175.3 | 0.2 | 111.9 | H131 V139 | H131-R135 PolarHBondContact O-N 2.9Å; R135-V139 VanDerWaalsContact O-CG2 3.31Å; R135-V139 WeakPolarHBondContact O-CG2 3.24Å; R135-V139 PolarHBondContact O-N 3.17Å |
| 136 | F | 94.1 | Very high | 92.5 | Very high | 140 Ų | 140 | 106.3 Ų | 106.3 | 61% | 0.614 | 52% | 0.524 | S | S | * | . | H | α-helix | trans | -63.8 | -45.2 | 175.9 | -176.7 | -99.1 | 0 | 0 | 0 | 111.8 | R132 V133 M134 I138 V139 V140 | R132-F136 PolarHBondContact O-N 3.05Å; V133-F136 PolarHBondContact O-N 2.94Å; M134-F136 VanDerWaalsContact C-N 3.3Å; M134-F136 PolarHBondContact O-N 3.37Å; F136-I138 PolarHBondContact O-N 3.34Å; F136-V139 PolarHBondContact O-N 3.24Å; F136-V140 HydrophobicContact CD1-CG2 4.1Å; F136-V140 HydrophobicContact CE1-CG2 3.69Å; F136-V140 HydrophobicContact CE2-CG2 4.32Å; F136-V140 HydrophobicContact CZ-CG2 3.82Å; F136-V140 WeakPolarHBondContact O-CG2 3.37Å; F136-V140 PolarHBondContact O-N 3.26Å |
| 137 | M | 92.7 | Very high | 92.8 | Very high | 114 Ų | 114 | 106 Ų | 106 | 56% | 0.562 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -60.2 | -41.9 | 178.6 | -69.6 | -68.1 | -75.7 | 0 | 0 | 112.6 | V133 M134 V140 S141 | V133-M137 HydrophobicContact CG1-CG 4.36Å; V133-M137 VanDerWaalsContact O-CG 3.28Å; V133-M137 WeakPolarHBondContact O-CG 3.4Å; V133-M137 PolarHBondContact O-N 3.23Å; M134-M137 PolarHBondContact O-N 3.18Å; M134-M137 HydrophobicContact SD-CB 4.47Å; M137-V140 PolarHBondContact O-N 2.96Å; M137-S141 WeakPolarHBondContact O-CB 3.34Å; M137-S141 PolarHBondContact O-N 3.49Å |
| 138 | I | 93.7 | Very high | 93.1 | Very high | 66 Ų | 66 | 106.4 Ų | 106.4 | 34% | 0.338 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -64.5 | -44.5 | 177.7 | -68.2 | 165.8 | 0 | 0 | 0 | 110.9 | L129 M134 F136 V140 S141 F142 | L129-I138 HydrophobicContact CD1-CD1 3.15Å; M134-I138 HydrophobicContact CE-CD1 3.89Å; M134-I138 HydrophobicContact CE-CG1 3.83Å; M134-I138 HydrophobicContact CG-CD1 3.96Å; M134-I138 HydrophobicContact CG-CG1 4.43Å; M134-I138 WeakPolarHBondContact O-CG1 3.38Å; M134-I138 PolarHBondContact O-N 3.3Å; M134-I138 HydrophobicContact SD-CG1 4.43Å; F136-I138 PolarHBondContact O-N 3.34Å; I138-V140 VanDerWaalsContact C-N 3.34Å; I138-V140 PolarHBondContact O-N 3.07Å; I138-S141 PolarHBondContact O-N 3.39Å; I138-F142 WeakPolarHBondContact O-CB 3.35Å; I138-F142 PolarHBondContact O-N 3.23Å |
| 139 | V | 93.3 | Very high | 93.4 | Very high | 77 Ų | 77 | 104.9 Ų | 104.9 | 47% | 0.467 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -60.8 | -45.5 | 177.7 | 171.9 | 0 | 0 | 0 | 0 | 110.7 | R135 F136 S141 F142 I143 | R135-V139 VanDerWaalsContact O-CG2 3.31Å; R135-V139 WeakPolarHBondContact O-CG2 3.24Å; R135-V139 PolarHBondContact O-N 3.17Å; F136-V139 PolarHBondContact O-N 3.24Å; V139-S141 PolarHBondContact O-N 2.77Å; V139-F142 PolarHBondContact O-N 3.4Å; V139-I143 HydrophobicContact CG1-CD1 3.96Å; V139-I143 VanDerWaalsContact O-CG1 3.32Å; V139-I143 WeakPolarHBondContact O-CG1 3.35Å; V139-I143 PolarHBondContact O-N 2.95Å |
| 140 | V | 95.8 | Very high | 93.8 | Very high | 66 Ų | 66 | 107 Ų | 107 | 40% | 0.4 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -61.6 | -43.8 | 176.3 | 172.5 | 0 | 0 | 0 | 0 | 111.3 | F136 M137 I138 F142 I143 L144 | F136-V140 HydrophobicContact CD1-CG2 4.1Å; F136-V140 HydrophobicContact CE1-CG2 3.69Å; F136-V140 HydrophobicContact CE2-CG2 4.32Å; F136-V140 HydrophobicContact CZ-CG2 3.82Å; F136-V140 WeakPolarHBondContact O-CG2 3.37Å; F136-V140 PolarHBondContact O-N 3.26Å; M137-V140 PolarHBondContact O-N 2.96Å; I138-V140 VanDerWaalsContact C-N 3.34Å; I138-V140 PolarHBondContact O-N 3.07Å; V140-F142 PolarHBondContact O-N 2.89Å; V140-I143 PolarHBondContact O-N 3.47Å; V140-L144 WeakPolarHBondContact O-CB 3.2Å; V140-L144 PolarHBondContact O-N 3.41Å |
| 141 | S | 94.3 | Very high | 94.2 | Very high | 77 Ų | 77 | 107.3 Ų | 107.3 | 54% | 0.538 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -62.9 | -40 | 177.9 | 179.8 | 0 | 0 | 0 | 0 | 112.3 | M137 I138 V139 L144 Y145 | M137-S141 WeakPolarHBondContact O-CB 3.34Å; M137-S141 PolarHBondContact O-N 3.49Å; I138-S141 PolarHBondContact O-N 3.39Å; V139-S141 PolarHBondContact O-N 2.77Å; S141-L144 PolarHBondContact O-N 3.33Å; S141-Y145 WeakPolarHBondContact O-CB 3.38Å; S141-Y145 PolarHBondContact O-N 2.96Å |
| 142 | F | 95.7 | Very high | 94.3 | Very high | 130 Ų | 130 | 108.1 Ų | 108.1 | 57% | 0.57 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -67 | -40.1 | 177.6 | -152.6 | -97.6 | 0 | 0 | 0 | 111.7 | I138 V139 V140 Y145 L146 | I138-F142 WeakPolarHBondContact O-CB 3.35Å; I138-F142 PolarHBondContact O-N 3.23Å; V139-F142 PolarHBondContact O-N 3.4Å; V140-F142 PolarHBondContact O-N 2.89Å; F142-Y145 PolarHBondContact O-N 2.95Å; F142-L146 HydrophobicContact CD1-CD1 3.95Å; F142-L146 HydrophobicContact CD1-CG 4.3Å; F142-L146 HydrophobicContact CE1-CD1 4.06Å; F142-L146 HydrophobicContact CE1-CG 4.36Å; F142-L146 WeakPolarHBondContact O-CG 3.5Å; F142-L146 PolarHBondContact O-N 2.89Å |
| 143 | I | 96.8 | Very high | 94.4 | Very high | 107 Ų | 107 | 101.8 Ų | 101.8 | 55% | 0.549 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.4 | -44.9 | 174.8 | -67.4 | 166.8 | 0 | 0 | 0 | 110.9 | V139 V140 L146 A147 | V139-I143 HydrophobicContact CG1-CD1 3.96Å; V139-I143 VanDerWaalsContact O-CG1 3.32Å; V139-I143 WeakPolarHBondContact O-CG1 3.35Å; V139-I143 PolarHBondContact O-N 2.95Å; V140-I143 PolarHBondContact O-N 3.47Å; I143-L146 PolarHBondContact O-N 3.13Å; I143-A147 PolarHBondContact O-N 3.33Å |
| 144 | L | 97 | Very high | 94.4 | Very high | 112 Ų | 112 | 102.3 Ų | 102.3 | 59% | 0.586 | 52% | 0.52 | S | S | * | . | H | α-helix | trans | -64.1 | -41.7 | 177.5 | -175.5 | 144 | 0 | 0 | 0 | 111.5 | V140 S141 L146 A147 V148 | V140-L144 WeakPolarHBondContact O-CB 3.2Å; V140-L144 PolarHBondContact O-N 3.41Å; S141-L144 PolarHBondContact O-N 3.33Å; L144-L146 PolarHBondContact O-N 3.25Å; L144-A147 PolarHBondContact O-N 3.04Å; L144-V148 HydrophobicContact CD2-CG2 4.15Å; L144-V148 WeakPolarHBondContact O-CG2 3.34Å; L144-V148 PolarHBondContact O-N 3.28Å |
| 145 | Y | 96.3 | Very high | 94.4 | Very high | 146 Ų | 146 | 103.3 Ų | 103.3 | 57% | 0.573 | 53% | 0.527 | S | S | * | . | H | α-helix | trans | -60.2 | -43.6 | 174.9 | 174.7 | -98.5 | 0 | 0 | 0 | 112.1 | S141 F142 V148 S149 | S141-Y145 WeakPolarHBondContact O-CB 3.38Å; S141-Y145 PolarHBondContact O-N 2.96Å; F142-Y145 PolarHBondContact O-N 2.95Å; Y145-V148 PolarHBondContact O-N 3.34Å; Y145-S149 WeakPolarHBondContact O-CB 3.31Å; Y145-S149 PolarHBondContact O-N 2.87Å; Y145-S149 PolarHBondContact O-OG 2.78Å |
| 146 | L | 96.1 | Very high | 94.2 | Very high | 82 Ų | 82 | 99.9 Ų | 99.9 | 43% | 0.429 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63.5 | -43.3 | 175.3 | -73 | 175.1 | 0 | 0 | 0 | 111.8 | F142 I143 L144 S149 I150 | F142-L146 HydrophobicContact CD1-CD1 3.95Å; F142-L146 HydrophobicContact CD1-CG 4.3Å; F142-L146 HydrophobicContact CE1-CD1 4.06Å; F142-L146 HydrophobicContact CE1-CG 4.36Å; F142-L146 WeakPolarHBondContact O-CG 3.5Å; F142-L146 PolarHBondContact O-N 2.89Å; I143-L146 PolarHBondContact O-N 3.13Å; L144-L146 PolarHBondContact O-N 3.25Å; L146-S149 PolarHBondContact O-N 3.27Å; L146-I150 VanDerWaalsContact O-CG1 3.27Å; L146-I150 WeakPolarHBondContact O-CG1 3.27Å; L146-I150 PolarHBondContact O-N 3.28Å |
| 147 | A | 96.1 | Very high | 93.6 | Very high | 57 Ų | 57 | 102.2 Ų | 102.2 | 47% | 0.471 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -62.3 | -44.3 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | I143 L144 I150 W151 | I143-A147 PolarHBondContact O-N 3.33Å; L144-A147 PolarHBondContact O-N 3.04Å; A147-I150 PolarHBondContact O-N 2.89Å; A147-W151 WeakPolarHBondContact O-CB 3.48Å; A147-W151 PolarHBondContact O-N 2.94Å |
| 148 | V | 95.7 | Very high | 92.9 | Very high | 78 Ų | 78 | 105.8 Ų | 105.8 | 47% | 0.473 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -64.7 | -40.7 | 175.6 | 173.3 | 0 | 0 | 0 | 0 | 110.9 | L144 Y145 W151 F152 | L144-V148 HydrophobicContact CD2-CG2 4.15Å; L144-V148 WeakPolarHBondContact O-CG2 3.34Å; L144-V148 PolarHBondContact O-N 3.28Å; Y145-V148 PolarHBondContact O-N 3.34Å; V148-W151 PolarHBondContact O-N 3.49Å; V148-F152 VanDerWaalsContact O-CB 3.31Å; V148-F152 WeakPolarHBondContact O-CB 3.45Å; V148-F152 PolarHBondContact O-N 3.38Å |
| 149 | S | 95.5 | Very high | 91.7 | Very high | 37 Ų | 37 | 105.7 Ų | 105.7 | 26% | 0.259 | 56% | 0.557 | S | S | . | * | H | α-helix | trans | -64.1 | -43.6 | 178.4 | -60.2 | 0 | 0 | 0 | 0 | 111.7 | Y145 L146 F152 C153 | Y145-S149 WeakPolarHBondContact O-CB 3.31Å; Y145-S149 PolarHBondContact O-N 2.87Å; Y145-S149 PolarHBondContact O-OG 2.78Å; L146-S149 PolarHBondContact O-N 3.27Å; S149-F152 PolarHBondContact O-N 3.47Å; S149-C153 WeakPolarHBondContact O-CB 3.39Å; S149-C153 PolarHBondContact O-N 2.92Å; S149-C153 PolarHBondContact O-SG 3.2Å |
| 150 | I | 95.8 | Very high | 90.5 | Very high | 114 Ų | 114 | 110.3 Ų | 110.3 | 59% | 0.585 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -61.5 | -47.4 | 174.7 | -67.1 | 163.6 | 0 | 0 | 0 | 110.1 | L146 A147 F152 C153 T154 | L146-I150 VanDerWaalsContact O-CG1 3.27Å; L146-I150 WeakPolarHBondContact O-CG1 3.27Å; L146-I150 PolarHBondContact O-N 3.28Å; A147-I150 PolarHBondContact O-N 2.89Å; I150-F152 VanDerWaalsContact C-N 3.29Å; I150-F152 PolarHBondContact O-N 2.8Å; I150-C153 PolarHBondContact O-N 3.32Å; I150-T154 WeakPolarHBondContact O-CG2 3.33Å; I150-T154 PolarHBondContact O-N 3.47Å; I150-T154 PolarHBondContact O-OG1 2.97Å |
| 151 | W | 95.9 | Very high | 89 | Confident | 163 Ų | 163 | 113.2 Ų | 113.2 | 62% | 0.617 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -59.7 | -40.1 | 176.9 | -178.9 | 81.2 | 0 | 0 | 0 | 112.1 | A147 V148 T154 N155 | A147-W151 WeakPolarHBondContact O-CB 3.48Å; A147-W151 PolarHBondContact O-N 2.94Å; V148-W151 PolarHBondContact O-N 3.49Å; W151-T154 PolarHBondContact O-N 3.12Å; W151-T154 PolarHBondContact O-OG1 3.29Å; W151-N155 VanDerWaalsContact CE2-ND2 3.32Å; W151-N155 PolarHBondContact O-N 3.33Å; W151-N155 PolarHBondContact O-ND2 3.21Å |
| 152 | F | 92.8 | Very high | 87.5 | Confident | 130 Ų | 130 | 113.5 Ų | 113.5 | 57% | 0.57 | 59% | 0.587 | S | S | * | * | H | α-helix | trans | -67.1 | -44.1 | 177.2 | -169.6 | -99.1 | 0 | 0 | 0 | 111.9 | V148 S149 I150 T154 N155 L156 | V148-F152 VanDerWaalsContact O-CB 3.31Å; V148-F152 WeakPolarHBondContact O-CB 3.45Å; V148-F152 PolarHBondContact O-N 3.38Å; S149-F152 PolarHBondContact O-N 3.47Å; I150-F152 VanDerWaalsContact C-N 3.29Å; I150-F152 PolarHBondContact O-N 2.8Å; F152-T154 VanDerWaalsContact C-N 3.27Å; F152-T154 PolarHBondContact O-N 3.35Å; F152-N155 PolarHBondContact O-N 3.37Å; F152-N155 VanDerWaalsContact O-N 3.12Å; F152-L156 HydrophobicContact CE1-CD1 4.34Å; F152-L156 PolarHBondContact O-N 2.87Å |
| 153 | C | 93.1 | Very high | 86 | Confident | 90 Ų | 90 | 112.8 Ų | 112.8 | 61% | 0.608 | 60% | 0.598 | S | S | * | * | H | α-helix | trans | -59.4 | -36.2 | 175 | -70.5 | 0 | 0 | 0 | 0 | 112.3 | S149 I150 N155 L156 | S149-C153 WeakPolarHBondContact O-CB 3.39Å; S149-C153 PolarHBondContact O-N 2.92Å; S149-C153 PolarHBondContact O-SG 3.2Å; I150-C153 PolarHBondContact O-N 3.32Å; C153-N155 VanDerWaalsContact C-N 3.31Å; C153-N155 PolarHBondContact O-N 3.39Å; C153-L156 WeakPolarHBondContact O-CB 3.48Å; C153-L156 PolarHBondContact O-N 3.44Å |
| 154 | T | 91.6 | Very high | 84.2 | Confident | 104 Ų | 104 | 113.7 Ų | 113.7 | 64% | 0.638 | 61% | 0.609 | S | S | * | * | H | α-helix | trans | -71.4 | -22.2 | 177.4 | 57 | 0 | 0 | 0 | 0 | 114.5 | I150 W151 F152 | I150-T154 WeakPolarHBondContact O-CG2 3.33Å; I150-T154 PolarHBondContact O-N 3.47Å; I150-T154 PolarHBondContact O-OG1 2.97Å; W151-T154 PolarHBondContact O-N 3.12Å; W151-T154 PolarHBondContact O-OG1 3.29Å; F152-T154 VanDerWaalsContact C-N 3.27Å; F152-T154 PolarHBondContact O-N 3.35Å |
| 155 | N | 89.3 | Confident | 82.3 | Confident | 99 Ų | 99 | 108.7 Ų | 108.7 | 53% | 0.529 | 58% | 0.584 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -98.6 | 2.4 | 178.2 | -70.3 | -66 | 0 | 0 | 0 | 112.7 | W151 F152 C153 R157 | W151-N155 VanDerWaalsContact CE2-ND2 3.32Å; W151-N155 PolarHBondContact O-N 3.33Å; W151-N155 PolarHBondContact O-ND2 3.21Å; F152-N155 PolarHBondContact O-N 3.37Å; F152-N155 VanDerWaalsContact O-N 3.12Å; C153-N155 VanDerWaalsContact C-N 3.31Å; C153-N155 PolarHBondContact O-N 3.39Å; N155-R157 PolarHBondContact O-N 3.45Å; N155-R157 VanDerWaalsContact O-N 3.13Å |
| 156 | L | 87.5 | Confident | 80.5 | Confident | 108 Ų | 108 | 110.3 Ų | 110.3 | 57% | 0.565 | 59% | 0.594 | S | S | * | * | trans | -71.3 | 110.9 | -179.2 | -166.6 | 69.5 | 0 | 0 | 0 | 109 | F152 C153 E158 | F152-L156 HydrophobicContact CE1-CD1 4.34Å; F152-L156 PolarHBondContact O-N 2.87Å; C153-L156 WeakPolarHBondContact O-CB 3.48Å; C153-L156 PolarHBondContact O-N 3.44Å; L156-E158 PolarHBondContact O-N 2.73Å | ||
| 157 | R | 79.5 | Confident | 78.5 | Confident | 189 Ų | 189 | 115 Ų | 115 | 71% | 0.713 | 61% | 0.611 | S | S | * | * | trans | -74.1 | 110.1 | 177.4 | -162.4 | 166.1 | 176.7 | -122 | -11 | 108.7 | N155 G159 E161 | N155-R157 PolarHBondContact O-N 3.45Å; N155-R157 VanDerWaalsContact O-N 3.13Å; R157-G159 PolarHBondContact O-N 3.46Å; R157-E161 IonicContact CZ-OE1 3.15Å; R157-E161 IonicContact NH1-OE1 2.69Å; R157-E161 PolarHBondContact NH1-OE1 3.13Å; R157-E161 IonicContact NH1-OE2 3.39Å; R157-E161 PolarHBondContact NH1-OE2 3Å; R157-E161 IonicContact NH2-OE1 2.84Å; R157-E161 PolarHBondContact NH2-OE1 3.1Å | ||
| 158 | E | 78.5 | Confident | 76.6 | Confident | 189 Ų | 189 | 117.9 Ų | 117.9 | 88% | 0.883 | 62% | 0.617 | S | S | * | * | trans | -72.4 | 122.7 | 178.5 | -63.7 | 171 | -177.8 | 0 | 0 | 109.7 | L156 | L156-E158 PolarHBondContact O-N 2.73Š| ||
| 159 | G | 68.2 | Low | 74.6 | Confident | 65 Ų | 65 | 124.1 Ų | 124.1 | 67% | 0.67 | 63% | 0.633 | S | S | * | * | S | Bend | trans | 134.6 | 126.6 | 173.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | R157 E161 | R157-G159 PolarHBondContact O-N 3.46Å; G159-E161 PolarHBondContact O-N 3.45Å; G159-E161 VanDerWaalsContact O-N 3.16Å |
| 160 | L | 69.3 | Low | 73.1 | Confident | 173 Ų | 173 | 127.7 Ų | 127.7 | 91% | 0.906 | 65% | 0.649 | S | S | * | * | trans | -74.7 | 99.5 | 166.1 | -176.5 | 67.8 | 0 | 0 | 0 | 107.3 | P162 | L160-P162 WeakPolarHBondContact O-CD 3.11Å; L160-P162 VanDerWaalsContact O-N 3.16Å | ||
| 161 | E | 64.5 | Low | 71.2 | Confident | 128 Ų | 128 | 131.7 Ų | 131.7 | 60% | 0.598 | 66% | 0.658 | S | S | * | * | trans | -65.5 | 112.4 | 175.1 | -69.9 | -170.8 | 139.5 | 0 | 0 | 109.3 | R157 G159 S163 | R157-E161 IonicContact CZ-OE1 3.15Å; R157-E161 IonicContact NH1-OE1 2.69Å; R157-E161 PolarHBondContact NH1-OE1 3.13Å; R157-E161 IonicContact NH1-OE2 3.39Å; R157-E161 PolarHBondContact NH1-OE2 3Å; R157-E161 IonicContact NH2-OE1 2.84Å; R157-E161 PolarHBondContact NH2-OE1 3.1Å; G159-E161 PolarHBondContact O-N 3.45Å; G159-E161 VanDerWaalsContact O-N 3.16Å; E161-S163 PolarHBondContact O-N 3.16Å; E161-S163 VanDerWaalsContact O-N 3.1Å | ||
| 162 | P | 62.1 | Low | 69.7 | Low | 82 Ų | 82 | 125.5 Ų | 125.5 | 53% | 0.532 | 65% | 0.645 | S | S | . | * | trans | -69.2 | 115.5 | 172.5 | 29.9 | -31.8 | 0 | 0 | 0 | 107 | L160 V164 G165 | L160-P162 WeakPolarHBondContact O-CD 3.11Å; L160-P162 VanDerWaalsContact O-N 3.16Å; P162-V164 HydrophobicContact CB-CG2 3.96Å; P162-V164 PolarHBondContact O-N 3.4Å; P162-G165 PolarHBondContact O-N 2.87Å | ||
| 163 | S | 63.8 | Low | 68.5 | Low | 116 Ų | 116 | 124.5 Ų | 124.5 | 81% | 0.811 | 65% | 0.65 | S | S | * | * | G | 310 helix | trans | -56.4 | -21.3 | 179 | 49.8 | 0 | 0 | 0 | 0 | 113.2 | E161 G165 | E161-S163 PolarHBondContact O-N 3.16Å; E161-S163 VanDerWaalsContact O-N 3.1Å; S163-G165 VanDerWaalsContact C-N 3.33Å |
| 164 | V | 60.5 | Low | 67.1 | Low | 126 Ų | 126 | 126.9 Ų | 126.9 | 76% | 0.764 | 65% | 0.652 | S | S | * | * | G | 310 helix | trans | -75.6 | -13.4 | 173.7 | -76.5 | 0 | 0 | 0 | 0 | 114.6 | P162 K166 | P162-V164 HydrophobicContact CB-CG2 3.96Å; P162-V164 PolarHBondContact O-N 3.4Å; V164-K166 PolarHBondContact O-N 3.39Å |
| 165 | G | 55.4 | Low | 65.9 | Low | 6 Ų | 6 | 126.2 Ų | 126.2 | 6% | 0.062 | 65% | 0.648 | C | S | . | * | G | 310 helix | trans | -73.7 | -23.2 | -171.8 | 0 | 0 | 0 | 0 | 0 | 115.5 | P162 S163 K167 L168 W169 | P162-G165 PolarHBondContact O-N 2.87Å; S163-G165 VanDerWaalsContact C-N 3.33Å; G165-K167 PolarHBondContact O-N 2.84Å; G165-L168 WeakPolarHBondContact O-CA 3.35Å; G165-L168 WeakPolarHBondContact O-CB 3.38Å; G165-L168 PolarHBondContact O-N 2.69Å; G165-W169 VanDerWaalsContact C-CD1 3.48Å; G165-W169 PolarHBondContact O-N 3.26Å |
| 166 | K | 59.1 | Low | 65.2 | Low | 181 Ų | 181 | 129 Ų | 129 | 79% | 0.787 | 66% | 0.657 | S | S | * | * | G | 310 helix | trans | -57.6 | -26.3 | -172.1 | -74.9 | -173.8 | 179.3 | -179.8 | 0 | 114.7 | V164 | V164-K166 PolarHBondContact O-N 3.39Š|
| 167 | K | 54.6 | Low | 64.4 | Low | 180 Ų | 180 | 128.8 Ų | 128.8 | 78% | 0.783 | 66% | 0.66 | S | S | * | * | G | 310 helix | trans | -89.4 | -24.3 | 172.5 | -74 | -173.8 | 178 | -176.8 | 0 | 113.7 | G165 | G165-K167 PolarHBondContact O-N 2.84Š|
| 168 | L | 55.4 | Low | 64.2 | Low | 117 Ų | 117 | 125.7 Ų | 125.7 | 61% | 0.613 | 66% | 0.662 | S | S | * | * | G | 310 helix | trans | -75.3 | -30.3 | 178.6 | -159.8 | 73 | 0 | 0 | 0 | 111.6 | G165 N170 Y171 G172 | G165-L168 WeakPolarHBondContact O-CA 3.35Å; G165-L168 WeakPolarHBondContact O-CB 3.38Å; G165-L168 PolarHBondContact O-N 2.69Å; L168-N170 PolarHBondContact O-N 2.85Å; L168-Y171 PolarHBondContact O-N 3.45Å; L168-G172 PolarHBondContact O-N 3.25Å |
| 169 | W | 55.2 | Low | 63.9 | Low | 210 Ų | 210 | 121.1 Ų | 121.1 | 80% | 0.795 | 65% | 0.647 | S | S | * | * | G | 310 helix | trans | -62.5 | -22.3 | 175.9 | -74.9 | 105.5 | 0 | 0 | 0 | 114.4 | G165 Y171 | G165-W169 VanDerWaalsContact C-CD1 3.48Å; G165-W169 PolarHBondContact O-N 3.26Å; W169-Y171 VanDerWaalsContact C-N 3.3Å; W169-Y171 PolarHBondContact O-N 3Å |
| 170 | N | 62.8 | Low | 64 | Low | 111 Ų | 111 | 125.6 Ų | 125.6 | 59% | 0.594 | 66% | 0.655 | S | S | * | * | G | 310 helix | trans | -77.7 | -11.9 | 179.5 | -76 | -1.3 | 0 | 0 | 0 | 114.1 | L168 | L168-N170 PolarHBondContact O-N 2.85Š|
| 171 | Y | 56.7 | Low | 64.1 | Low | 198 Ų | 198 | 124.3 Ų | 124.3 | 78% | 0.776 | 65% | 0.649 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -121.9 | -2.5 | -179.5 | -70.7 | -80 | 0 | 0 | 0 | 112.5 | L168 W169 | L168-Y171 PolarHBondContact O-N 3.45Å; W169-Y171 VanDerWaalsContact C-N 3.3Å; W169-Y171 PolarHBondContact O-N 3Å |
| 172 | G | 63.4 | Low | 64.2 | Low | 33 Ų | 33 | 122.6 Ų | 122.6 | 34% | 0.34 | 65% | 0.649 | S | S | . | * | trans | 61.7 | 174.6 | -173.2 | 0 | 0 | 0 | 0 | 0 | 113.4 | L168 | L168-G172 PolarHBondContact O-N 3.25Š| ||
| 173 | T | 67.2 | Low | 64.3 | Low | 110 Ų | 110 | 120.8 Ų | 120.8 | 68% | 0.675 | 64% | 0.637 | S | S | * | * | trans | -91 | 136.1 | 162.7 | -95.4 | 0 | 0 | 0 | 0 | 107.9 | V175 | T173-V175 PolarHBondContact O-N 2.63Å; T173-V175 VanDerWaalsContact O-N 3.16Å | ||
| 174 | E | 65.8 | Low | 64.3 | Low | 139 Ų | 139 | 119.1 Ų | 119.1 | 65% | 0.65 | 62% | 0.619 | S | S | * | * | trans | -62.5 | 115.2 | 171.7 | -67 | -178.4 | -178.2 | 0 | 0 | 109.7 | ||||
| 175 | V | 65.6 | Low | 64.6 | Low | 91 Ų | 91 | 115.2 Ų | 115.2 | 55% | 0.552 | 60% | 0.596 | S | S | * | * | trans | -93.4 | 113.7 | 174.3 | -179 | 0 | 0 | 0 | 0 | 108.5 | T173 V177 | T173-V175 PolarHBondContact O-N 2.63Å; T173-V175 VanDerWaalsContact O-N 3.16Å; V175-V177 HydrophobicContact CG1-CG2 4.45Å | ||
| 176 | Q | 74.5 | Confident | 64.9 | Low | 158 Ų | 158 | 115.8 Ų | 115.8 | 74% | 0.738 | 60% | 0.599 | S | S | * | * | trans | -88.4 | 111.3 | 173.8 | -65.8 | -174.5 | 0.7 | 0 | 0 | 109.9 | V178 | Q176-V178 PolarHBondContact O-N 2.95Š| ||
| 177 | V | 71.1 | Confident | 65.1 | Low | 103 Ų | 103 | 113.1 Ų | 113.1 | 62% | 0.624 | 59% | 0.589 | S | S | * | * | trans | -86.6 | 104.3 | 172.7 | -177.8 | 0 | 0 | 0 | 0 | 108.4 | V175 | V175-V177 HydrophobicContact CG1-CG2 4.45Š| ||
| 178 | V | 75.4 | Confident | 65.6 | Low | 124 Ų | 124 | 110.6 Ų | 110.6 | 75% | 0.752 | 58% | 0.58 | S | S | * | * | trans | -92.9 | 113 | 176.2 | -176.9 | 0 | 0 | 0 | 0 | 108.8 | Q176 N180 | Q176-V178 PolarHBondContact O-N 2.95Å; V178-N180 PolarHBondContact O-N 3.16Å | ||
| 179 | V | 71.9 | Confident | 66.1 | Low | 92 Ų | 92 | 107.7 Ų | 107.7 | 56% | 0.558 | 57% | 0.573 | S | S | * | * | trans | -83.4 | 112.4 | 173.6 | -178.9 | 0 | 0 | 0 | 0 | 108.6 | N181 | V179-N181 PolarHBondContact O-N 3.05Š| ||
| 180 | N | 69.2 | Low | 66.6 | Low | 160 Ų | 160 | 98 Ų | 98 | 86% | 0.856 | 54% | 0.538 | S | S | * | . | S | Bend | trans | -74.4 | 123.1 | 172.6 | -166.4 | 12.8 | 0 | 0 | 0 | 109.3 | V178 | V178-N180 PolarHBondContact O-N 3.16Š|
| 181 | N | 71.4 | Confident | 66.8 | Low | 146 Ų | 146 | 93.7 Ų | 93.7 | 78% | 0.781 | 51% | 0.513 | S | S | * | . | S | Bend | trans | 69.1 | 71.9 | -172.9 | -149.1 | 23.5 | 0 | 0 | 0 | 114.3 | V179 | V179-N181 PolarHBondContact O-N 3.05Š|
| 182 | P | 67.2 | Low | 67.3 | Low | 91 Ų | 91 | 89.4 Ų | 89.4 | 59% | 0.591 | 50% | 0.503 | S | S | * | . | trans | -66.5 | 139.4 | -177.1 | 28.3 | -34.3 | 0 | 0 | 0 | 111.2 | ||||
| 183 | P | 64.3 | Low | 67.5 | Low | 44 Ų | 44 | 93.5 Ų | 93.5 | 29% | 0.286 | 51% | 0.512 | S | S | . | . | trans | -62 | 144.7 | 168.7 | 27.9 | -32.9 | 0 | 0 | 0 | 109.4 | V185 | P183-V185 WeakPolarHBondContact O-CG2 3.44Å; P183-V185 PolarHBondContact O-N 3.13Å | ||
| 184 | D | 64.8 | Low | 67.5 | Low | 81 Ų | 81 | 89.4 Ų | 89.4 | 43% | 0.433 | 49% | 0.489 | S | S | . | . | trans | -62.5 | 103.4 | 177 | -169.4 | -10.3 | 0 | 0 | 0 | 109 | S186 E187 K237 | D184-S186 PolarHBondContact O-N 3.14Å; D184-S186 VanDerWaalsContact O-N 3.14Å; D184-S186 WeakPolarHBondContact OD1-CB 3.46Å; D184-S186 PolarHBondContact OD1-N 2.95Å; D184-S186 PolarHBondContact OD1-OG 3.04Å; D184-S186 PolarHBondContact OD2-OG 3.26Å; D184-E187 PolarHBondContact O-N 3.24Å; D184-K237 IonicContact OD2-NZ 3.95Å | ||
| 185 | V | 66 | Low | 67.5 | Low | 44 Ų | 44 | 85.8 Ų | 85.8 | 27% | 0.267 | 48% | 0.477 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.3 | -7.6 | -179 | -163.2 | 0 | 0 | 0 | 0 | 110.8 | P183 E187 R191 W224 F240 | P183-V185 WeakPolarHBondContact O-CG2 3.44Å; P183-V185 PolarHBondContact O-N 3.13Å; V185-E187 VanDerWaalsContact C-N 3.31Å; V185-R191 HydrophobicContact CG1-CG 4.05Å; V185-R191 VanDerWaalsContact O-CG 3.3Å; V185-R191 WeakPolarHBondContact O-CG 3.47Å; V185-R191 PolarHBondContact O-NE 3.25Å; V185-W224 HydrophobicContact CG1-CH2 4.15Å; V185-F240 HydrophobicContact CB-CZ 4.21Å; V185-F240 HydrophobicContact CG1-CE2 4.45Å; V185-F240 HydrophobicContact CG1-CZ 4.01Å |
| 186 | S | 60.9 | Low | 67.7 | Low | 19 Ų | 19 | 86.6 Ų | 86.6 | 13% | 0.133 | 48% | 0.476 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -75.4 | -19.8 | 170.4 | 76.8 | 0 | 0 | 0 | 0 | 113.2 | D184 K237 | D184-S186 PolarHBondContact O-N 3.14Å; D184-S186 VanDerWaalsContact O-N 3.14Å; D184-S186 WeakPolarHBondContact OD1-CB 3.46Å; D184-S186 PolarHBondContact OD1-N 2.95Å; D184-S186 PolarHBondContact OD1-OG 3.04Å; D184-S186 PolarHBondContact OD2-OG 3.26Å; S186-K237 WeakPolarHBondContact OG-CE 3.48Å; S186-K237 PolarHBondContact OG-NZ 3Å |
| 187 | E | 65 | Low | 67.3 | Low | 125 Ų | 125 | 86.3 Ų | 86.3 | 58% | 0.584 | 47% | 0.468 | S | S | * | . | S | Bend | trans | -98.3 | 141.6 | 180 | -164 | 170.6 | -162.8 | 0 | 0 | 111.4 | D184 V185 A189 G190 R191 | D184-E187 PolarHBondContact O-N 3.24Å; V185-E187 VanDerWaalsContact C-N 3.31Å; E187-A189 VanDerWaalsContact C-N 3.26Å; E187-A189 PolarHBondContact O-N 3.37Å; E187-G190 WeakPolarHBondContact O-CA 3.2Å; E187-G190 PolarHBondContact O-N 3.23Å; E187-R191 PolarHBondContact O-N 3.49Å; E187-R191 VanDerWaalsContact O-N 3.13Å |
| 188 | E | 63.6 | Low | 67 | Low | 127 Ų | 127 | 84 Ų | 84 | 59% | 0.593 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -56.7 | -40.1 | -177.9 | -173.5 | -179.3 | 175.5 | 0 | 0 | 112.2 | G190 R191 L192 | E188-G190 VanDerWaalsContact C-N 3.28Å; E188-G190 PolarHBondContact O-N 2.95Å; E188-R191 PolarHBondContact O-N 3.17Å; E188-L192 HydrophobicContact CG-CD1 4.44Å; E188-L192 PolarHBondContact O-N 2.81Å |
| 189 | A | 66 | Low | 66.6 | Low | 56 Ų | 56 | 80.5 Ų | 80.5 | 46% | 0.463 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -63.9 | -31.9 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | E187 K193 | E187-A189 VanDerWaalsContact C-N 3.26Å; E187-A189 PolarHBondContact O-N 3.37Å; A189-K193 WeakPolarHBondContact O-CG 3.48Å; A189-K193 PolarHBondContact O-N 2.9Å |
| 190 | G | 66.7 | Low | 66.4 | Low | 5 Ų | 5 | 80.7 Ų | 80.7 | 5% | 0.052 | 44% | 0.438 | C | S | . | . | H | α-helix | trans | -72.8 | -37 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | E187 E188 K193 A194 | E187-G190 WeakPolarHBondContact O-CA 3.2Å; E187-G190 PolarHBondContact O-N 3.23Å; E188-G190 VanDerWaalsContact C-N 3.28Å; E188-G190 PolarHBondContact O-N 2.95Å; G190-K193 PolarHBondContact O-N 3.45Å; G190-A194 WeakPolarHBondContact O-CB 3.39Å; G190-A194 PolarHBondContact O-N 3.29Å |
| 191 | R | 65.5 | Low | 66.2 | Low | 21 Ų | 21 | 76.4 Ų | 76.4 | 8% | 0.079 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -69.5 | -43.4 | 176.9 | -65.2 | -179.3 | -173.7 | 166.4 | 5.1 | 112.5 | V185 E187 E188 K193 A194 T195 | V185-R191 HydrophobicContact CG1-CG 4.05Å; V185-R191 VanDerWaalsContact O-CG 3.3Å; V185-R191 WeakPolarHBondContact O-CG 3.47Å; V185-R191 PolarHBondContact O-NE 3.25Å; E187-R191 PolarHBondContact O-N 3.49Å; E187-R191 VanDerWaalsContact O-N 3.13Å; E188-R191 PolarHBondContact O-N 3.17Å; R191-K193 VanDerWaalsContact C-N 3.3Å; R191-K193 PolarHBondContact O-N 2.97Å; R191-A194 PolarHBondContact O-N 3.33Å; R191-T195 WeakPolarHBondContact O-CG2 3.36Å; R191-T195 PolarHBondContact O-N 2.89Å; R191-T195 PolarHBondContact O-OG1 3.46Å |
| 192 | L | 67.5 | Low | 65.6 | Low | 108 Ų | 108 | 73.6 Ų | 73.6 | 57% | 0.565 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -63.2 | -37.3 | 175 | -75.3 | 170.2 | 0 | 0 | 0 | 112 | E188 T195 M196 | E188-L192 HydrophobicContact CG-CD1 4.44Å; E188-L192 PolarHBondContact O-N 2.81Å; L192-T195 WeakPolarHBondContact CA-OG1 3.47Å; L192-T195 PolarHBondContact O-OG1 3Å; L192-M196 VanDerWaalsContact O-CB 3.27Å; L192-M196 WeakPolarHBondContact O-CB 3.24Å; L192-M196 PolarHBondContact O-N 3.47Å |
| 193 | K | 68 | Low | 65.5 | Low | 119 Ų | 119 | 76.1 Ų | 76.1 | 52% | 0.517 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -64.5 | -45.8 | 171.6 | -78.7 | 179.4 | -178.6 | 177.8 | 0 | 111.2 | A189 G190 R191 T195 M196 W197 | A189-K193 WeakPolarHBondContact O-CG 3.48Å; A189-K193 PolarHBondContact O-N 2.9Å; G190-K193 PolarHBondContact O-N 3.45Å; R191-K193 VanDerWaalsContact C-N 3.3Å; R191-K193 PolarHBondContact O-N 2.97Å; K193-T195 PolarHBondContact O-N 3.34Å; K193-M196 WeakPolarHBondContact O-CB 3.48Å; K193-M196 PolarHBondContact O-N 3.36Å; K193-W197 PolarHBondContact O-N 3.46Å |
| 194 | A | 66.6 | Low | 65.4 | Low | 25 Ų | 25 | 77.7 Ų | 77.7 | 21% | 0.207 | 41% | 0.413 | C | S | . | . | H | α-helix | trans | -61 | -43.7 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | G190 R191 M196 W197 C198 | G190-A194 WeakPolarHBondContact O-CB 3.39Å; G190-A194 PolarHBondContact O-N 3.29Å; R191-A194 PolarHBondContact O-N 3.33Å; A194-M196 VanDerWaalsContact C-N 3.35Å; A194-W197 PolarHBondContact O-N 3.44Å; A194-C198 PolarHBondContact O-N 3.18Å; A194-C198 PolarHBondContact O-SG 3.15Å; A194-C198 VanDerWaalsContact O-SG 3.33Å |
| 195 | T | 66 | Low | 65.1 | Low | 62 Ų | 62 | 75.7 Ų | 75.7 | 38% | 0.38 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -66.5 | -36.6 | 175.7 | 55.7 | 0 | 0 | 0 | 0 | 112 | R191 L192 K193 C198 A199 | R191-T195 WeakPolarHBondContact O-CG2 3.36Å; R191-T195 PolarHBondContact O-N 2.89Å; R191-T195 PolarHBondContact O-OG1 3.46Å; L192-T195 WeakPolarHBondContact CA-OG1 3.47Å; L192-T195 PolarHBondContact O-OG1 3Å; K193-T195 PolarHBondContact O-N 3.34Å; T195-C198 PolarHBondContact O-N 2.97Å; T195-A199 PolarHBondContact O-N 3.38Å |
| 196 | M | 70.4 | Confident | 64.4 | Low | 109 Ų | 109 | 78 Ų | 78 | 54% | 0.537 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -64.7 | -42.7 | 172.3 | -171.9 | -176.6 | 78.2 | 0 | 0 | 111.9 | L192 K193 A194 C198 A199 L200 | L192-M196 VanDerWaalsContact O-CB 3.27Å; L192-M196 WeakPolarHBondContact O-CB 3.24Å; L192-M196 PolarHBondContact O-N 3.47Å; K193-M196 WeakPolarHBondContact O-CB 3.48Å; K193-M196 PolarHBondContact O-N 3.36Å; A194-M196 VanDerWaalsContact C-N 3.35Å; M196-C198 VanDerWaalsContact C-N 3.33Å; M196-C198 PolarHBondContact O-N 3.21Å; M196-A199 PolarHBondContact O-N 2.85Å; M196-L200 WeakPolarHBondContact O-CB 3.27Å; M196-L200 PolarHBondContact O-N 3.18Å |
| 197 | W | 66.8 | Low | 63.8 | Low | 151 Ų | 151 | 83.8 Ų | 83.8 | 57% | 0.572 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -59.3 | -44 | 173.8 | -76.5 | 114.8 | 0 | 0 | 0 | 111.2 | K193 A194 A199 L200 L201 | K193-W197 PolarHBondContact O-N 3.46Å; A194-W197 PolarHBondContact O-N 3.44Å; W197-A199 VanDerWaalsContact C-N 3.33Å; W197-A199 PolarHBondContact O-N 3.23Å; W197-L200 PolarHBondContact O-N 3Å; W197-L201 WeakPolarHBondContact O-CB 3.32Å; W197-L201 PolarHBondContact O-N 3.25Å |
| 198 | C | 63.8 | Low | 62.9 | Low | 54 Ų | 54 | 89.5 Ų | 89.5 | 37% | 0.365 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -62.6 | -37.5 | 174.9 | -68.5 | 0 | 0 | 0 | 0 | 112.8 | A194 T195 M196 R202 | A194-C198 PolarHBondContact O-N 3.18Å; A194-C198 PolarHBondContact O-SG 3.15Å; A194-C198 VanDerWaalsContact O-SG 3.33Å; T195-C198 PolarHBondContact O-N 2.97Å; M196-C198 VanDerWaalsContact C-N 3.33Å; M196-C198 PolarHBondContact O-N 3.21Å; C198-R202 PolarHBondContact O-N 3.31Å; C198-R202 VanDerWaalsContact O-N 3.15Å |
| 199 | A | 66.6 | Low | 62.1 | Low | 51 Ų | 51 | 88.9 Ų | 88.9 | 42% | 0.421 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -69.1 | -41.5 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | T195 M196 W197 R202 E203 | T195-A199 PolarHBondContact O-N 3.38Å; M196-A199 PolarHBondContact O-N 2.85Å; W197-A199 VanDerWaalsContact C-N 3.33Å; W197-A199 PolarHBondContact O-N 3.23Å; A199-R202 VanDerWaalsContact O-CB 3.32Å; A199-R202 WeakPolarHBondContact O-CB 3.38Å; A199-R202 PolarHBondContact O-N 2.75Å; A199-E203 PolarHBondContact O-N 3.45Å |
| 200 | L | 68 | Low | 61.1 | Low | 97 Ų | 97 | 91.9 Ų | 91.9 | 51% | 0.508 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -69.5 | -37.9 | 179.4 | -157.3 | 147.5 | 0 | 0 | 0 | 111.4 | M196 W197 R202 E203 A204 | M196-L200 WeakPolarHBondContact O-CB 3.27Å; M196-L200 PolarHBondContact O-N 3.18Å; W197-L200 PolarHBondContact O-N 3Å; L200-R202 VanDerWaalsContact C-N 3.29Å; L200-R202 PolarHBondContact O-N 2.7Å; L200-E203 PolarHBondContact O-N 3.43Å; L200-A204 PolarHBondContact O-N 3.49Å |
| 201 | L | 64.7 | Low | 60.1 | Low | 70 Ų | 70 | 99.7 Ų | 99.7 | 37% | 0.366 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -61.9 | -38.7 | 172.3 | -139.4 | 98.9 | 0 | 0 | 0 | 111.4 | W197 E203 A204 L205 | W197-L201 WeakPolarHBondContact O-CB 3.32Å; W197-L201 PolarHBondContact O-N 3.25Å; L201-E203 VanDerWaalsContact C-N 3.32Å; L201-E203 PolarHBondContact O-N 2.93Å; L201-A204 PolarHBondContact O-N 3.47Å; L201-L205 HydrophobicContact CD2-CD1 4.24Å; L201-L205 WeakPolarHBondContact O-CD1 3.44Å; L201-L205 VanDerWaalsContact O-CG 3.24Å; L201-L205 WeakPolarHBondContact O-CG 3.32Å; L201-L205 PolarHBondContact O-N 3.45Å |
| 202 | R | 60.1 | Low | 59.1 | Low | 86 Ų | 86 | 104.1 Ų | 104.1 | 33% | 0.325 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -61.6 | -38.8 | 176.3 | -178.3 | -172.4 | -62.5 | -144.2 | 0.4 | 112.1 | C198 A199 L200 C217 S221 | C198-R202 PolarHBondContact O-N 3.31Å; C198-R202 VanDerWaalsContact O-N 3.15Å; A199-R202 VanDerWaalsContact O-CB 3.32Å; A199-R202 WeakPolarHBondContact O-CB 3.38Å; A199-R202 PolarHBondContact O-N 2.75Å; L200-R202 VanDerWaalsContact C-N 3.29Å; L200-R202 PolarHBondContact O-N 2.7Å; R202-C217 PolarHBondContact NH2-O 3.02Å; R202-S221 PolarHBondContact NH2-OG 3.37Å |
| 203 | E | 64.9 | Low | 58.2 | Low | 145 Ų | 145 | 101.7 Ų | 101.7 | 68% | 0.678 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -75 | -36.6 | 178.1 | -72.8 | -176.1 | 175 | 0 | 0 | 112.5 | A199 L200 L201 L205 T206 | A199-E203 PolarHBondContact O-N 3.45Å; L200-E203 PolarHBondContact O-N 3.43Å; L201-E203 VanDerWaalsContact C-N 3.32Å; L201-E203 PolarHBondContact O-N 2.93Å; E203-L205 PolarHBondContact O-N 2.83Å; E203-T206 WeakPolarHBondContact O-CB 3.32Å; E203-T206 VanDerWaalsContact O-CG2 3.32Å; E203-T206 WeakPolarHBondContact O-CG2 3.48Å; E203-T206 PolarHBondContact O-N 3.01Å; E203-T206 PolarHBondContact O-OG1 2.94Å |
| 204 | A | 61.1 | Low | 57.2 | Low | 77 Ų | 77 | 101.9 Ų | 101.9 | 64% | 0.636 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -66.3 | -23.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | L200 L201 T206 | L200-A204 PolarHBondContact O-N 3.49Å; L201-A204 PolarHBondContact O-N 3.47Å; A204-T206 PolarHBondContact O-N 3.14Å |
| 205 | L | 58.5 | Low | 56.2 | Low | 38 Ų | 38 | 104.6 Ų | 104.6 | 20% | 0.199 | 52% | 0.522 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -87.9 | 32.1 | 179.5 | -69.2 | 165.9 | 0 | 0 | 0 | 113.1 | L201 E203 E207 W210 L213 | L201-L205 HydrophobicContact CD2-CD1 4.24Å; L201-L205 WeakPolarHBondContact O-CD1 3.44Å; L201-L205 VanDerWaalsContact O-CG 3.24Å; L201-L205 WeakPolarHBondContact O-CG 3.32Å; L201-L205 PolarHBondContact O-N 3.45Å; E203-L205 PolarHBondContact O-N 2.83Å; L205-E207 VanDerWaalsContact C-N 3.31Å; L205-E207 PolarHBondContact O-N 3.05Å; L205-W210 HydrophobicContact CD2-CB 4.4Å; L205-W210 HydrophobicContact CD2-CG 4.34Å; L205-L213 HydrophobicContact CD1-CB 4.42Å; L205-L213 HydrophobicContact CD1-CD2 4.29Å |
| 206 | T | 51.8 | Low | 55.4 | Low | 92 Ų | 92 | 103.1 Ų | 103.1 | 56% | 0.564 | 52% | 0.52 | S | S | * | . | trans | -79.6 | -3.3 | -175.8 | 27.9 | 0 | 0 | 0 | 0 | 115.2 | E203 A204 | E203-T206 WeakPolarHBondContact O-CB 3.32Å; E203-T206 VanDerWaalsContact O-CG2 3.32Å; E203-T206 WeakPolarHBondContact O-CG2 3.48Å; E203-T206 PolarHBondContact O-N 3.01Å; E203-T206 PolarHBondContact O-OG1 2.94Å; A204-T206 PolarHBondContact O-N 3.14Å | ||
| 207 | E | 47.7 | Very low | 54.3 | Low | 141 Ų | 141 | 99.1 Ų | 99.1 | 66% | 0.659 | 50% | 0.502 | S | S | * | . | S | Bend | trans | -85.6 | 141.4 | 174.6 | -77.3 | -65.5 | 159 | 0 | 0 | 112.5 | L205 V209 | L205-E207 VanDerWaalsContact C-N 3.31Å; L205-E207 PolarHBondContact O-N 3.05Å; E207-V209 PolarHBondContact O-N 3.35Å |
| 208 | W | 46.2 | Very low | 53.3 | Low | 246 Ų | 246 | 94.5 Ų | 94.5 | 93% | 0.932 | 49% | 0.493 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.6 | 5.3 | -166.9 | -68.9 | 81.2 | 0 | 0 | 0 | 117 | ||
| 209 | V | 46.8 | Very low | 52.7 | Low | 114 Ų | 114 | 93.8 Ų | 93.8 | 69% | 0.691 | 49% | 0.485 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -96.2 | -9.8 | -172 | 179.6 | 0 | 0 | 0 | 0 | 112.9 | E207 | E207-V209 PolarHBondContact O-N 3.35Š|
| 210 | W | 46.1 | Very low | 51.7 | Low | 119 Ų | 119 | 93.3 Ų | 93.3 | 45% | 0.451 | 48% | 0.479 | S | S | . | . | trans | -128.5 | 46 | -168.5 | -65 | 107.6 | 0 | 0 | 0 | 115.3 | L205 E212 L213 R214 | L205-W210 HydrophobicContact CD2-CB 4.4Å; L205-W210 HydrophobicContact CD2-CG 4.34Å; W210-E212 VanDerWaalsContact C-N 3.25Å; W210-E212 PolarHBondContact O-N 3.47Å; W210-L213 HydrophobicContact CB-CB 4.19Å; W210-L213 HydrophobicContact CD2-CD1 3.85Å; W210-L213 HydrophobicContact CE3-CD1 3.11Å; W210-L213 HydrophobicContact CE3-CG 4.38Å; W210-L213 HydrophobicContact CH2-CD1 4.31Å; W210-L213 HydrophobicContact CZ3-CD1 3.38Å; W210-L213 PolarHBondContact O-N 2.8Å; W210-R214 PolarHBondContact O-N 3.26Å | ||
| 211 | M | 45.2 | Very low | 50.7 | Low | 169 Ų | 169 | 91 Ų | 91 | 83% | 0.833 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -60.9 | -31.4 | 179.7 | -144.9 | 167.7 | 108.6 | 0 | 0 | 113.1 | C215 | M211-C215 PolarHBondContact O-N 3.19Å |
| 212 | E | 45.2 | Very low | 49.9 | Very low | 114 Ų | 114 | 89.1 Ų | 89.1 | 53% | 0.533 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -72.6 | -38.1 | 177 | -67.8 | -171.1 | 161.1 | 0 | 0 | 113.3 | W210 R214 C215 G216 | W210-E212 VanDerWaalsContact C-N 3.25Å; W210-E212 PolarHBondContact O-N 3.47Å; E212-R214 VanDerWaalsContact C-N 3.29Å; E212-R214 PolarHBondContact O-N 3.26Å; E212-C215 WeakPolarHBondContact O-CB 3.05Å; E212-C215 PolarHBondContact O-N 3.24Å; E212-G216 PolarHBondContact O-N 3.03Å |
| 213 | L | 47.2 | Very low | 49.3 | Very low | 56 Ų | 56 | 86.7 Ų | 86.7 | 29% | 0.293 | 46% | 0.457 | S | S | . | . | H | α-helix | trans | -69.9 | -27.5 | 176.6 | -104.2 | 136.4 | 0 | 0 | 0 | 112.2 | L205 W210 G216 C217 | L205-L213 HydrophobicContact CD1-CB 4.42Å; L205-L213 HydrophobicContact CD1-CD2 4.29Å; W210-L213 HydrophobicContact CB-CB 4.19Å; W210-L213 HydrophobicContact CD2-CD1 3.85Å; W210-L213 HydrophobicContact CE3-CD1 3.11Å; W210-L213 HydrophobicContact CE3-CG 4.38Å; W210-L213 HydrophobicContact CH2-CD1 4.31Å; W210-L213 HydrophobicContact CZ3-CD1 3.38Å; W210-L213 PolarHBondContact O-N 2.8Å; L213-G216 PolarHBondContact O-N 3.43Å; L213-C217 WeakPolarHBondContact O-CB 3.29Å; L213-C217 PolarHBondContact O-N 2.95Å; L213-C217 PolarHBondContact O-SG 2.95Å; L213-C217 VanDerWaalsContact O-SG 3.35Å |
| 214 | R | 47.1 | Very low | 48.4 | Very low | 123 Ų | 123 | 84 Ų | 84 | 46% | 0.464 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -68.3 | -38.2 | 171.2 | -172 | 174 | -87 | -135.3 | -3.9 | 111.6 | W210 E212 S218 | W210-R214 PolarHBondContact O-N 3.26Å; E212-R214 VanDerWaalsContact C-N 3.29Å; E212-R214 PolarHBondContact O-N 3.26Å; R214-S218 VanDerWaalsContact O-CB 3.29Å; R214-S218 WeakPolarHBondContact O-CB 3.46Å; R214-S218 PolarHBondContact O-N 3.35Å |
| 215 | C | 46.3 | Very low | 47.7 | Very low | 82 Ų | 82 | 85.8 Ų | 85.8 | 55% | 0.554 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -65.4 | -45.1 | 171.8 | -117.8 | 0 | 0 | 0 | 0 | 111.2 | M211 E212 C217 S218 N219 | M211-C215 PolarHBondContact O-N 3.19Å; E212-C215 WeakPolarHBondContact O-CB 3.05Å; E212-C215 PolarHBondContact O-N 3.24Å; C215-C217 PolarHBondContact O-N 3.24Å; C215-S218 PolarHBondContact O-N 2.9Å; C215-N219 PolarHBondContact O-N 3.44Å |
| 216 | G | 48.5 | Very low | 47 | Very low | 32 Ų | 32 | 90.4 Ų | 90.4 | 33% | 0.33 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -62.5 | -38.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | E212 L213 S220 | E212-G216 PolarHBondContact O-N 3.03Å; L213-G216 PolarHBondContact O-N 3.43Å; G216-S220 WeakPolarHBondContact O-CB 3.16Å; G216-S220 PolarHBondContact O-N 3.28Å |
| 217 | C | 48.1 | Very low | 46.7 | Very low | 25 Ų | 25 | 89.4 Ų | 89.4 | 17% | 0.169 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -76.3 | -29.7 | 175.3 | -70.8 | 0 | 0 | 0 | 0 | 113.1 | R202 L213 C215 S221 | R202-C217 PolarHBondContact NH2-O 3.02Å; L213-C217 WeakPolarHBondContact O-CB 3.29Å; L213-C217 PolarHBondContact O-N 2.95Å; L213-C217 PolarHBondContact O-SG 2.95Å; L213-C217 VanDerWaalsContact O-SG 3.35Å; C215-C217 PolarHBondContact O-N 3.24Å; C217-S221 PolarHBondContact O-N 3.37Å; C217-S221 VanDerWaalsContact O-N 3.12Å; C217-S221 PolarHBondContact O-OG 3.12Å |
| 218 | S | 46.1 | Very low | 46.3 | Very low | 54 Ų | 54 | 91.6 Ų | 91.6 | 38% | 0.378 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -67.6 | -46.2 | 172.1 | -167.6 | 0 | 0 | 0 | 0 | 110.7 | R214 C215 S221 A222 | R214-S218 VanDerWaalsContact O-CB 3.29Å; R214-S218 WeakPolarHBondContact O-CB 3.46Å; R214-S218 PolarHBondContact O-N 3.35Å; C215-S218 PolarHBondContact O-N 2.9Å; S218-S221 PolarHBondContact O-N 3.47Å; S218-S221 PolarHBondContact O-OG 3.21Å; S218-A222 PolarHBondContact O-N 3.23Å |
| 219 | N | 49.9 | Very low | 46.2 | Very low | 38 Ų | 38 | 82 Ų | 82 | 20% | 0.203 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -75.7 | -25.2 | 176.4 | -78.6 | 12.8 | 0 | 0 | 0 | 113 | C215 S221 A222 F223 T259 S261 | C215-N219 PolarHBondContact O-N 3.44Å; N219-S221 VanDerWaalsContact C-N 3.35Å; N219-A222 CarbonylContact O-C 3.41Å; N219-A222 WeakPolarHBondContact O-CB 3.3Å; N219-A222 PolarHBondContact O-N 3.21Å; N219-F223 VanDerWaalsContact O-CB 3.24Å; N219-F223 WeakPolarHBondContact O-CB 3.39Å; N219-F223 PolarHBondContact O-N 3.39Å; N219-T259 WeakPolarHBondContact CB-O 3.32Å; N219-T259 PolarHBondContact ND2-O 3.27Å; N219-S261 PolarHBondContact ND2-OXT 3.26Å |
| 220 | S | 46.7 | Very low | 45.8 | Very low | 42 Ų | 42 | 81.8 Ų | 81.8 | 29% | 0.294 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -68.2 | -36.2 | 170.3 | -174.5 | 0 | 0 | 0 | 0 | 111.4 | G216 A222 F223 W224 | G216-S220 WeakPolarHBondContact O-CB 3.16Å; G216-S220 PolarHBondContact O-N 3.28Å; S220-A222 VanDerWaalsContact C-N 3.32Å; S220-F223 WeakPolarHBondContact O-CB 3.42Å; S220-F223 PolarHBondContact O-N 3.1Å; S220-W224 PolarHBondContact O-N 3.48Å |
| 221 | S | 45.9 | Very low | 45.9 | Very low | 49 Ų | 49 | 81.7 Ų | 81.7 | 34% | 0.343 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -68.2 | -32.4 | 169.9 | 61.3 | 0 | 0 | 0 | 0 | 112.7 | R202 C217 S218 N219 V225 | R202-S221 PolarHBondContact NH2-OG 3.37Å; C217-S221 PolarHBondContact O-N 3.37Å; C217-S221 VanDerWaalsContact O-N 3.12Å; C217-S221 PolarHBondContact O-OG 3.12Å; S218-S221 PolarHBondContact O-N 3.47Å; S218-S221 PolarHBondContact O-OG 3.21Å; N219-S221 VanDerWaalsContact C-N 3.35Å; S221-V225 WeakPolarHBondContact O-CG2 3.44Å |
| 222 | A | 48.1 | Very low | 46.1 | Very low | 29 Ų | 29 | 77.1 Ų | 77.1 | 24% | 0.24 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -70.9 | -33 | 171 | 0 | 0 | 0 | 0 | 0 | 111.7 | S218 N219 S220 W224 V225 E226 | S218-A222 PolarHBondContact O-N 3.23Å; N219-A222 CarbonylContact O-C 3.41Å; N219-A222 WeakPolarHBondContact O-CB 3.3Å; N219-A222 PolarHBondContact O-N 3.21Å; S220-A222 VanDerWaalsContact C-N 3.32Å; A222-W224 VanDerWaalsContact C-N 3.32Å; A222-W224 PolarHBondContact O-N 3.08Å; A222-V225 CarbonylContact O-C 3.38Å; A222-V225 VanDerWaalsContact O-CA 3.32Å; A222-V225 WeakPolarHBondContact O-CA 3.48Å; A222-V225 WeakPolarHBondContact O-CB 3.41Å; A222-V225 PolarHBondContact O-N 3.02Å; A222-E226 WeakPolarHBondContact O-CB 3.48Å; A222-E226 PolarHBondContact O-N 3.14Å |
| 223 | F | 47.4 | Very low | 46.5 | Very low | 36 Ų | 36 | 75.4 Ų | 75.4 | 16% | 0.158 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -63.1 | -36.3 | 179.2 | 175.2 | -95.6 | 0 | 0 | 0 | 112 | N219 S220 V225 L227 F247 T259 | N219-F223 VanDerWaalsContact O-CB 3.24Å; N219-F223 WeakPolarHBondContact O-CB 3.39Å; N219-F223 PolarHBondContact O-N 3.39Å; S220-F223 WeakPolarHBondContact O-CB 3.42Å; S220-F223 PolarHBondContact O-N 3.1Å; F223-V225 VanDerWaalsContact C-N 3.28Å; F223-V225 PolarHBondContact O-N 2.89Å; F223-L227 HydrophobicContact CE1-CD1 4.37Å; F223-L227 HydrophobicContact CE2-CD1 4.2Å; F223-L227 HydrophobicContact CZ-CD1 3.92Å; F223-L227 PolarHBondContact O-N 3.3Å; F223-F247 HydrophobicContact CE1-CE2 4.3Å; F223-F247 HydrophobicContact CE1-CZ 4.31Å; F223-F247 HydrophobicContact CE2-CD2 4.34Å; F223-F247 AromaticContact CE2-CE2 3.67Å; F223-F247 HydrophobicContact CE2-CE2 3.67Å; F223-F247 HydrophobicContact CE2-CZ 4.3Å; F223-F247 AromaticContact CZ-CD2 3.77Å; F223-F247 HydrophobicContact CZ-CD2 3.77Å; F223-F247 HydrophobicContact CZ-CE1 4.46Å; F223-F247 AromaticContact CZ-CE2 3.21Å; F223-F247 HydrophobicContact CZ-CE2 3.21Å; F223-F247 AromaticContact CZ-CZ 3.6Å; F223-F247 HydrophobicContact CZ-CZ 3.6Å; F223-T259 HydrophobicContact CB-CG2 4.11Å; F223-T259 HydrophobicContact CD2-CG2 3.66Å; F223-T259 HydrophobicContact CE2-CG2 4.34Å; F223-T259 HydrophobicContact CG-CG2 3.93Å |
| 224 | W | 47.7 | Very low | 46.8 | Very low | 87 Ų | 87 | 78.3 Ų | 78.3 | 33% | 0.33 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -69 | -25.3 | 169.9 | -71.2 | 102.4 | 0 | 0 | 0 | 113.2 | V185 S220 A222 | V185-W224 HydrophobicContact CG1-CH2 4.15Å; S220-W224 PolarHBondContact O-N 3.48Å; A222-W224 VanDerWaalsContact C-N 3.32Å; A222-W224 PolarHBondContact O-N 3.08Å |
| 225 | V | 45.3 | Very low | 47.3 | Very low | 115 Ų | 115 | 74.4 Ų | 74.4 | 70% | 0.697 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -92.2 | -32.3 | -178.2 | 175.4 | 0 | 0 | 0 | 0 | 112.2 | S221 A222 F223 | S221-V225 WeakPolarHBondContact O-CG2 3.44Å; A222-V225 CarbonylContact O-C 3.38Å; A222-V225 VanDerWaalsContact O-CA 3.32Å; A222-V225 WeakPolarHBondContact O-CA 3.48Å; A222-V225 WeakPolarHBondContact O-CB 3.41Å; A222-V225 PolarHBondContact O-N 3.02Å; F223-V225 VanDerWaalsContact C-N 3.28Å; F223-V225 PolarHBondContact O-N 2.89Å |
| 226 | E | 43.2 | Very low | 48.2 | Very low | 135 Ų | 135 | 73.3 Ų | 73.3 | 63% | 0.631 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -85.8 | -13.3 | -179.5 | -86.1 | -179.6 | 148.7 | 0 | 0 | 113.4 | A222 K228 | A222-E226 WeakPolarHBondContact O-CB 3.48Å; A222-E226 PolarHBondContact O-N 3.14Å; E226-K228 PolarHBondContact O-N 3.07Å |
| 227 | L | 45.4 | Very low | 49 | Very low | 71 Ų | 71 | 77 Ų | 77 | 37% | 0.372 | 43% | 0.43 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -63 | 6.2 | 166.9 | -134.3 | 96.6 | 0 | 0 | 0 | 113.4 | F223 L229 | F223-L227 HydrophobicContact CE1-CD1 4.37Å; F223-L227 HydrophobicContact CE2-CD1 4.2Å; F223-L227 HydrophobicContact CZ-CD1 3.92Å; F223-L227 PolarHBondContact O-N 3.3Å; L227-L229 HydrophobicContact CB-CD1 4.11Å; L227-L229 HydrophobicContact CB-CG 4.3Å; L227-L229 HydrophobicContact CD2-CD1 3.77Å; L227-L229 HydrophobicContact CD2-CG 4.18Å; L227-L229 PolarHBondContact O-N 3.28Å |
| 228 | K | 39.3 | Very low | 49.9 | Very low | 187 Ų | 187 | 83.5 Ų | 83.5 | 81% | 0.813 | 46% | 0.455 | S | S | * | . | trans | 52.7 | 30.2 | 169.4 | -137.5 | 178.7 | -167.6 | 177.8 | 0 | 112.2 | E226 P230 | E226-K228 PolarHBondContact O-N 3.07Å; K228-P230 WeakPolarHBondContact O-CD 3.39Å | ||
| 229 | L | 43.9 | Very low | 50.9 | Low | 44 Ų | 44 | 84.5 Ų | 84.5 | 23% | 0.23 | 46% | 0.457 | C | S | . | . | trans | -76.9 | 93.7 | 177 | -76.8 | 164.3 | 0 | 0 | 0 | 107.4 | L227 N231 L232 M235 | L227-L229 HydrophobicContact CB-CD1 4.11Å; L227-L229 HydrophobicContact CB-CG 4.3Å; L227-L229 HydrophobicContact CD2-CD1 3.77Å; L227-L229 HydrophobicContact CD2-CG 4.18Å; L227-L229 PolarHBondContact O-N 3.28Å; L229-N231 PolarHBondContact O-N 3.28Å; L229-L232 HydrophobicContact CB-CD1 4.21Å; L229-L232 HydrophobicContact CD1-CD1 3.84Å; L229-M235 HydrophobicContact CD2-CE 3.19Å; L229-M235 HydrophobicContact CD2-SD 3.48Å; L229-M235 WeakPolarHBondContact CD2-SD 3.12Å | ||
| 230 | P | 39 | Very low | 51.7 | Low | 110 Ų | 110 | 84 Ų | 84 | 71% | 0.714 | 45% | 0.453 | S | S | * | . | S | Bend | trans | -72.7 | 110.8 | 179.3 | 7.1 | 14.5 | 0 | 0 | 0 | 104.7 | K228 | K228-P230 WeakPolarHBondContact O-CD 3.39Š|
| 231 | N | 48.2 | Very low | 52.8 | Low | 117 Ų | 117 | 87.4 Ų | 87.4 | 63% | 0.626 | 46% | 0.46 | S | S | * | . | trans | 77.3 | 78 | 179.9 | -42.1 | -54.6 | 0 | 0 | 0 | 115 | L229 A233 V234 | L229-N231 PolarHBondContact O-N 3.28Å; N231-A233 PolarHBondContact O-N 3.44Å; N231-V234 HydrophobicContact CB-CB 4.2Å; N231-V234 HydrophobicContact CB-CG2 3.9Å; N231-V234 PolarHBondContact O-N 2.86Å | ||
| 232 | L | 50.5 | Low | 53.9 | Low | 74 Ų | 74 | 91 Ų | 91 | 39% | 0.387 | 47% | 0.471 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -54.2 | -20.7 | 169.7 | -147.2 | 80.7 | 0 | 0 | 0 | 113.6 | L229 | L229-L232 HydrophobicContact CB-CD1 4.21Å; L229-L232 HydrophobicContact CD1-CD1 3.84Å |
| 233 | A | 52 | Low | 54.8 | Low | 78 Ų | 78 | 91.8 Ų | 91.8 | 65% | 0.645 | 48% | 0.475 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -79.1 | -9.9 | 177.4 | 0 | 0 | 0 | 0 | 0 | 114.7 | N231 | N231-A233 PolarHBondContact O-N 3.44Š|
| 234 | V | 54.3 | Low | 55.7 | Low | 117 Ų | 117 | 93 Ų | 93 | 71% | 0.709 | 48% | 0.482 | S | S | * | . | S | Bend | trans | -122.8 | 4.2 | -169.9 | -167.4 | 0 | 0 | 0 | 0 | 112.7 | N231 S236 | N231-V234 HydrophobicContact CB-CB 4.2Å; N231-V234 HydrophobicContact CB-CG2 3.9Å; N231-V234 PolarHBondContact O-N 2.86Å; V234-S236 PolarHBondContact O-N 3.4Å |
| 235 | M | 58.3 | Low | 56.7 | Low | 40 Ų | 40 | 97.4 Ų | 97.4 | 20% | 0.197 | 50% | 0.499 | C | S | . | . | trans | -79.9 | 120.6 | -172.2 | -161.2 | -175.8 | -156.2 | 0 | 0 | 112.6 | L229 D239 F240 S243 | L229-M235 HydrophobicContact CD2-CE 3.19Å; L229-M235 HydrophobicContact CD2-SD 3.48Å; L229-M235 WeakPolarHBondContact CD2-SD 3.12Å; M235-D239 VanDerWaalsContact CE-C 3.45Å; M235-D239 HydrophobicContact CE-CB 3.64Å; M235-D239 WeakPolarHBondContact CE-O 3.33Å; M235-D239 HydrophobicContact CG-CB 3.89Å; M235-F240 HydrophobicContact SD-CB 4.24Å; M235-S243 WeakPolarHBondContact CE-OG 3.39Å | ||
| 236 | S | 63.4 | Low | 57.8 | Low | 60 Ų | 60 | 97.4 Ų | 97.4 | 42% | 0.42 | 49% | 0.491 | S | S | . | . | trans | -64.5 | 148.8 | 174.3 | 170.7 | 0 | 0 | 0 | 0 | 111.4 | V234 K238 D239 F240 | V234-S236 PolarHBondContact O-N 3.4Å; S236-K238 PolarHBondContact O-N 3.47Å; S236-D239 PolarHBondContact O-N 3.04Å; S236-D239 VanDerWaalsContact O-N 3.14Å; S236-F240 PolarHBondContact O-N 3.15Å | ||
| 237 | K | 66.6 | Low | 58.8 | Low | 109 Ų | 109 | 93.6 Ų | 93.6 | 47% | 0.474 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -52.9 | -30.6 | 177.7 | -175.8 | 163.7 | -174.4 | 155.5 | 0 | 112.6 | D184 S186 Y241 | D184-K237 IonicContact OD2-NZ 3.95Å; S186-K237 WeakPolarHBondContact OG-CE 3.48Å; S186-K237 PolarHBondContact OG-NZ 3Å; K237-Y241 HydrophobicContact CD-CE2 4.22Å; K237-Y241 HydrophobicContact CG-CD2 4.08Å; K237-Y241 HydrophobicContact CG-CE2 3.59Å; K237-Y241 WeakPolarHBondContact O-CD2 3.43Å; K237-Y241 PolarHBondContact O-N 3.43Å |
| 238 | K | 66.7 | Low | 59.8 | Low | 162 Ų | 162 | 95.2 Ų | 95.2 | 70% | 0.704 | 48% | 0.481 | S | S | * | . | H | α-helix | trans | -70.2 | -48 | 179.3 | -67.7 | -176 | 178.6 | 178.9 | 0 | 112.4 | S236 F240 Y241 E242 | S236-K238 PolarHBondContact O-N 3.47Å; K238-F240 PolarHBondContact O-N 2.9Å; K238-Y241 PolarHBondContact O-N 3.19Å; K238-Y241 VanDerWaalsContact O-N 3.14Å; K238-E242 PolarHBondContact O-N 3.25Å |
| 239 | D | 67.3 | Low | 61.3 | Low | 75 Ų | 75 | 92.8 Ų | 92.8 | 40% | 0.401 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -64 | -32.8 | -177.8 | -48.7 | -21.3 | 0 | 0 | 0 | 110.8 | M235 S236 S243 | M235-D239 VanDerWaalsContact CE-C 3.45Å; M235-D239 HydrophobicContact CE-CB 3.64Å; M235-D239 WeakPolarHBondContact CE-O 3.33Å; M235-D239 HydrophobicContact CG-CB 3.89Å; S236-D239 PolarHBondContact O-N 3.04Å; S236-D239 VanDerWaalsContact O-N 3.14Å; D239-S243 WeakPolarHBondContact O-CB 3.46Å; D239-S243 PolarHBondContact O-N 3.3Å; D239-S243 PolarHBondContact O-OG 2.81Å |
| 240 | F | 67.3 | Low | 62.4 | Low | 28 Ų | 28 | 95 Ų | 95 | 12% | 0.123 | 48% | 0.481 | C | S | . | . | H | α-helix | trans | -63.1 | -48 | 174.4 | 176.8 | -102.4 | 0 | 0 | 0 | 112.1 | V185 M235 S236 K238 E242 S243 L244 | V185-F240 HydrophobicContact CB-CZ 4.21Å; V185-F240 HydrophobicContact CG1-CE2 4.45Å; V185-F240 HydrophobicContact CG1-CZ 4.01Å; M235-F240 HydrophobicContact SD-CB 4.24Å; S236-F240 PolarHBondContact O-N 3.15Å; K238-F240 PolarHBondContact O-N 2.9Å; F240-E242 VanDerWaalsContact C-N 3.32Å; F240-E242 PolarHBondContact O-N 3.39Å; F240-S243 PolarHBondContact O-N 3.14Å; F240-L244 VanDerWaalsContact O-CB 3.29Å; F240-L244 WeakPolarHBondContact O-CB 3.36Å; F240-L244 PolarHBondContact O-N 3.01Å |
| 241 | Y | 68.4 | Low | 63.4 | Low | 113 Ų | 113 | 91.6 Ų | 91.6 | 44% | 0.443 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -67.6 | -32.8 | 179 | -74.9 | -64.1 | 0 | 0 | 0 | 112.6 | K237 K238 L244 R245 | K237-Y241 HydrophobicContact CD-CE2 4.22Å; K237-Y241 HydrophobicContact CG-CD2 4.08Å; K237-Y241 HydrophobicContact CG-CE2 3.59Å; K237-Y241 WeakPolarHBondContact O-CD2 3.43Å; K237-Y241 PolarHBondContact O-N 3.43Å; K238-Y241 PolarHBondContact O-N 3.19Å; K238-Y241 VanDerWaalsContact O-N 3.14Å; Y241-L244 HydrophobicContact CD1-CD2 4.38Å; Y241-L244 PolarHBondContact O-N 3.49Å; Y241-R245 WeakPolarHBondContact O-CB 3.48Å; Y241-R245 PolarHBondContact O-N 3.08Å |
| 242 | E | 70.7 | Confident | 63.9 | Low | 125 Ų | 125 | 89.5 Ų | 89.5 | 58% | 0.584 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -68.1 | -42.6 | 176.2 | -163.8 | 161.2 | -153.2 | 0 | 0 | 111.4 | K238 F240 R245 H246 | K238-E242 PolarHBondContact O-N 3.25Å; F240-E242 VanDerWaalsContact C-N 3.32Å; F240-E242 PolarHBondContact O-N 3.39Å; E242-R245 WeakPolarHBondContact O-CB 3.5Å; E242-R245 PolarHBondContact O-N 2.84Å; E242-H246 PolarHBondContact O-N 3.4Å |
| 243 | S | 65.6 | Low | 64.1 | Low | 44 Ų | 44 | 94 Ų | 94 | 31% | 0.308 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -66.4 | -39.1 | 173.8 | -55 | 0 | 0 | 0 | 0 | 112.2 | M235 D239 F240 R245 H246 F247 | M235-S243 WeakPolarHBondContact CE-OG 3.39Å; D239-S243 WeakPolarHBondContact O-CB 3.46Å; D239-S243 PolarHBondContact O-N 3.3Å; D239-S243 PolarHBondContact O-OG 2.81Å; F240-S243 PolarHBondContact O-N 3.14Å; S243-R245 VanDerWaalsContact C-N 3.28Å; S243-R245 PolarHBondContact O-N 3.26Å; S243-H246 PolarHBondContact O-N 3.32Å; S243-F247 PolarHBondContact O-N 3.29Å |
| 244 | L | 67.2 | Low | 64.3 | Low | 62 Ų | 62 | 95.3 Ų | 95.3 | 33% | 0.325 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -63.9 | -35.9 | 175.1 | -168.9 | 78.2 | 0 | 0 | 0 | 111.4 | F240 Y241 F247 L248 | F240-L244 VanDerWaalsContact O-CB 3.29Å; F240-L244 WeakPolarHBondContact O-CB 3.36Å; F240-L244 PolarHBondContact O-N 3.01Å; Y241-L244 HydrophobicContact CD1-CD2 4.38Å; Y241-L244 PolarHBondContact O-N 3.49Å; L244-F247 PolarHBondContact O-N 3.47Å; L244-L248 HydrophobicContact CD2-CD1 4.25Å; L244-L248 HydrophobicContact CG-CD1 4.02Å; L244-L248 HydrophobicContact CG-CG 4.5Å; L244-L248 WeakPolarHBondContact O-CB 3.49Å; L244-L248 WeakPolarHBondContact O-CG 2.88Å; L244-L248 PolarHBondContact O-N 3.27Å |
| 245 | R | 68.3 | Low | 64.4 | Low | 179 Ų | 179 | 93.3 Ų | 93.3 | 68% | 0.675 | 45% | 0.454 | S | S | * | . | H | α-helix | trans | -63.3 | -47 | 177 | -162.3 | 179.9 | -158.9 | -174.6 | 4.2 | 111.1 | Y241 E242 S243 F247 L248 E249 | Y241-R245 WeakPolarHBondContact O-CB 3.48Å; Y241-R245 PolarHBondContact O-N 3.08Å; E242-R245 WeakPolarHBondContact O-CB 3.5Å; E242-R245 PolarHBondContact O-N 2.84Å; S243-R245 VanDerWaalsContact C-N 3.28Å; S243-R245 PolarHBondContact O-N 3.26Å; R245-F247 VanDerWaalsContact C-N 3.28Å; R245-F247 PolarHBondContact O-N 3.11Å; R245-L248 PolarHBondContact O-N 3.15Å; R245-E249 WeakPolarHBondContact O-CG 3.34Å; R245-E249 PolarHBondContact O-N 3.48Å; R245-E249 VanDerWaalsContact O-N 3.1Å |
| 246 | H | 68.7 | Low | 64 | Low | 115 Ų | 115 | 96.6 Ų | 96.6 | 53% | 0.532 | 47% | 0.467 | S | S | . | . | H | α-helix | trans | -59.7 | -38.4 | 173.3 | -82.6 | -58.1 | 0 | 0 | 0 | 112.4 | E242 S243 E249 F250 | E242-H246 PolarHBondContact O-N 3.4Å; S243-H246 PolarHBondContact O-N 3.32Å; H246-E249 IonicContact ND1-OE2 3.7Å; H246-E249 PolarHBondContact O-N 3.36Å; H246-F250 WeakPolarHBondContact O-CD2 3.38Å; H246-F250 WeakPolarHBondContact O-CE2 3.24Å |
| 247 | F | 63.8 | Low | 63.5 | Low | 56 Ų | 56 | 97.8 Ų | 97.8 | 25% | 0.246 | 47% | 0.472 | C | S | . | . | H | α-helix | trans | -67.9 | -38.2 | 176.5 | -177.6 | -109.4 | 0 | 0 | 0 | 113.5 | F223 S243 L244 R245 E249 F250 R255 | F223-F247 HydrophobicContact CE1-CE2 4.3Å; F223-F247 HydrophobicContact CE1-CZ 4.31Å; F223-F247 HydrophobicContact CE2-CD2 4.34Å; F223-F247 AromaticContact CE2-CE2 3.67Å; F223-F247 HydrophobicContact CE2-CE2 3.67Å; F223-F247 HydrophobicContact CE2-CZ 4.3Å; F223-F247 AromaticContact CZ-CD2 3.77Å; F223-F247 HydrophobicContact CZ-CD2 3.77Å; F223-F247 HydrophobicContact CZ-CE1 4.46Å; F223-F247 AromaticContact CZ-CE2 3.21Å; F223-F247 HydrophobicContact CZ-CE2 3.21Å; F223-F247 AromaticContact CZ-CZ 3.6Å; F223-F247 HydrophobicContact CZ-CZ 3.6Å; S243-F247 PolarHBondContact O-N 3.29Å; L244-F247 PolarHBondContact O-N 3.47Å; R245-F247 VanDerWaalsContact C-N 3.28Å; R245-F247 PolarHBondContact O-N 3.11Å; F247-E249 VanDerWaalsContact C-N 3.29Å; F247-E249 PolarHBondContact O-N 2.68Å; F247-F250 PolarHBondContact O-N 2.79Å; F247-R255 HydrophobicContact CD2-CG 4.3Å; F247-R255 HydrophobicContact CE1-CG 4.42Å; F247-R255 HydrophobicContact CE2-CB 4.24Å; F247-R255 HydrophobicContact CE2-CG 3.54Å; F247-R255 HydrophobicContact CZ-CB 4.2Å; F247-R255 HydrophobicContact CZ-CG 3.65Å |
| 248 | L | 66.8 | Low | 62.6 | Low | 104 Ų | 104 | 97 Ų | 97 | 55% | 0.545 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -72.2 | -22.5 | 179.1 | -75.6 | 166.1 | 0 | 0 | 0 | 113.1 | L244 R245 F250 | L244-L248 HydrophobicContact CD2-CD1 4.25Å; L244-L248 HydrophobicContact CG-CD1 4.02Å; L244-L248 HydrophobicContact CG-CG 4.5Å; L244-L248 WeakPolarHBondContact O-CB 3.49Å; L244-L248 WeakPolarHBondContact O-CG 2.88Å; L244-L248 PolarHBondContact O-N 3.27Å; R245-L248 PolarHBondContact O-N 3.15Å; L248-F250 VanDerWaalsContact C-N 3.28Å |
| 249 | E | 70.7 | Confident | 61.8 | Low | 136 Ų | 136 | 90.7 Ų | 90.7 | 64% | 0.636 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -69 | -25.9 | 172.4 | -77.2 | 175.1 | 174.8 | 0 | 0 | 112.5 | R245 H246 F247 | R245-E249 WeakPolarHBondContact O-CG 3.34Å; R245-E249 PolarHBondContact O-N 3.48Å; R245-E249 VanDerWaalsContact O-N 3.1Å; H246-E249 IonicContact ND1-OE2 3.7Å; H246-E249 PolarHBondContact O-N 3.36Å; F247-E249 VanDerWaalsContact C-N 3.29Å; F247-E249 PolarHBondContact O-N 2.68Å |
| 250 | F | 66.2 | Low | 60.5 | Low | 91 Ų | 91 | 90.9 Ų | 90.9 | 40% | 0.399 | 45% | 0.453 | S | S | . | . | S | Bend | trans | -71.9 | 135 | 175 | -68.2 | -70.6 | 0 | 0 | 0 | 111.8 | H246 F247 L248 E254 R255 | H246-F250 WeakPolarHBondContact O-CD2 3.38Å; H246-F250 WeakPolarHBondContact O-CE2 3.24Å; F247-F250 PolarHBondContact O-N 2.79Å; L248-F250 VanDerWaalsContact C-N 3.28Å; F250-E254 HydrophobicContact CB-CB 4.38Å; F250-E254 HydrophobicContact CD1-CB 4.39Å; F250-E254 WeakPolarHBondContact CD1-OE2 3.29Å; F250-R255 HydrophobicContact CB-CG 3.94Å; F250-R255 VanDerWaalsContact O-CZ 3.28Å; F250-R255 PolarHBondContact O-NE 3.22Å; F250-R255 PolarHBondContact O-NH2 2.77Å |
| 251 | G | 60.6 | Low | 59.1 | Low | 38 Ų | 38 | 96.1 Ų | 96.1 | 39% | 0.392 | 49% | 0.494 | S | S | . | . | trans | -60.5 | 154.1 | 173.6 | 0 | 0 | 0 | 0 | 0 | 111.6 | F253 E254 R255 | G251-F253 PolarHBondContact O-N 2.86Å; G251-F253 VanDerWaalsContact O-N 3.14Å; G251-E254 PolarHBondContact O-N 2.99Å; G251-E254 VanDerWaalsContact O-N 3.08Å; G251-R255 PolarHBondContact O-N 3.46Å | ||
| 252 | A | 59.1 | Low | 58.6 | Low | 73 Ų | 73 | 95.3 Ų | 95.3 | 60% | 0.603 | 50% | 0.496 | S | S | * | . | H | α-helix | trans | -54.7 | -34.5 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | F256 | A252-F256 PolarHBondContact O-N 3.33Å; A252-F256 VanDerWaalsContact O-N 3.15Å |
| 253 | F | 53.6 | Low | 58 | Low | 168 Ų | 168 | 93.7 Ų | 93.7 | 74% | 0.737 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -68 | -43.7 | 176.9 | -168.4 | -98.1 | 0 | 0 | 0 | 112.8 | G251 R255 F256 V257 | G251-F253 PolarHBondContact O-N 2.86Å; G251-F253 VanDerWaalsContact O-N 3.14Å; F253-R255 VanDerWaalsContact C-N 3.33Å; F253-R255 PolarHBondContact O-N 3.02Å; F253-F256 WeakPolarHBondContact O-CB 2.99Å; F253-F256 PolarHBondContact O-N 2.86Å; F253-V257 HydrophobicContact CD1-CG2 4.33Å; F253-V257 HydrophobicContact CE1-CG2 4.08Å; F253-V257 WeakPolarHBondContact O-CG2 3.38Å; F253-V257 PolarHBondContact O-N 2.92Å; F253-V257 VanDerWaalsContact O-N 3.08Å |
| 254 | E | 57.7 | Low | 57.6 | Low | 106 Ų | 106 | 96.5 Ų | 96.5 | 50% | 0.495 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -68.7 | -34.7 | 178.2 | -66.8 | -172.6 | 147.1 | 0 | 0 | 111.8 | F250 G251 F256 V257 L258 | F250-E254 HydrophobicContact CB-CB 4.38Å; F250-E254 HydrophobicContact CD1-CB 4.39Å; F250-E254 WeakPolarHBondContact CD1-OE2 3.29Å; G251-E254 PolarHBondContact O-N 2.99Å; G251-E254 VanDerWaalsContact O-N 3.08Å; E254-F256 VanDerWaalsContact C-N 3.28Å; E254-F256 PolarHBondContact O-N 3.25Å; E254-V257 PolarHBondContact O-N 3.38Å; E254-L258 WeakPolarHBondContact O-CG 3.42Å; E254-L258 PolarHBondContact O-N 3.01Å; E254-L258 VanDerWaalsContact O-N 3.07Å |
| 255 | R | 55.7 | Low | 57 | Low | 76 Ų | 76 | 98.5 Ų | 98.5 | 29% | 0.287 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -60.3 | -39.5 | 171.5 | -71.7 | -175.2 | -100.5 | -174.6 | -14.1 | 111.9 | F247 F250 G251 F253 T259 | F247-R255 HydrophobicContact CD2-CG 4.3Å; F247-R255 HydrophobicContact CE1-CG 4.42Å; F247-R255 HydrophobicContact CE2-CB 4.24Å; F247-R255 HydrophobicContact CE2-CG 3.54Å; F247-R255 HydrophobicContact CZ-CB 4.2Å; F247-R255 HydrophobicContact CZ-CG 3.65Å; F250-R255 HydrophobicContact CB-CG 3.94Å; F250-R255 VanDerWaalsContact O-CZ 3.28Å; F250-R255 PolarHBondContact O-NE 3.22Å; F250-R255 PolarHBondContact O-NH2 2.77Å; G251-R255 PolarHBondContact O-N 3.46Å; F253-R255 VanDerWaalsContact C-N 3.33Å; F253-R255 PolarHBondContact O-N 3.02Å; R255-T259 PolarHBondContact O-N 2.66Å; R255-T259 PolarHBondContact O-OG1 3.04Å |
| 256 | F | 49.8 | Very low | 56.3 | Low | 109 Ų | 109 | 93.5 Ų | 93.5 | 48% | 0.478 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -69.1 | -41.5 | 179 | -130.5 | -81.7 | 0 | 0 | 0 | 112.4 | A252 F253 E254 L258 T259 C260 | A252-F256 PolarHBondContact O-N 3.33Å; A252-F256 VanDerWaalsContact O-N 3.15Å; F253-F256 WeakPolarHBondContact O-CB 2.99Å; F253-F256 PolarHBondContact O-N 2.86Å; E254-F256 VanDerWaalsContact C-N 3.28Å; E254-F256 PolarHBondContact O-N 3.25Å; F256-L258 VanDerWaalsContact C-N 3.33Å; F256-L258 PolarHBondContact O-N 2.95Å; F256-T259 WeakPolarHBondContact CA-OG1 3.39Å; F256-T259 PolarHBondContact O-N 3.33Å; F256-T259 VanDerWaalsContact O-N 3.15Å; F256-T259 PolarHBondContact O-OG1 2.85Å; F256-C260 WeakPolarHBondContact O-CB 3.36Å; F256-C260 PolarHBondContact O-N 3.07Å; F256-C260 VanDerWaalsContact O-N 3.11Å |
| 257 | V | 53.6 | Low | 55.5 | Low | 85 Ų | 85 | 92.1 Ų | 92.1 | 52% | 0.515 | 50% | 0.5 | S | S | . | . | H | α-helix | trans | -63.2 | -39.8 | 176.9 | 174.1 | 0 | 0 | 0 | 0 | 111.1 | F253 E254 T259 C260 S261 | F253-V257 HydrophobicContact CD1-CG2 4.33Å; F253-V257 HydrophobicContact CE1-CG2 4.08Å; F253-V257 WeakPolarHBondContact O-CG2 3.38Å; F253-V257 PolarHBondContact O-N 2.92Å; F253-V257 VanDerWaalsContact O-N 3.08Å; E254-V257 PolarHBondContact O-N 3.38Å; V257-T259 VanDerWaalsContact C-N 3.26Å; V257-T259 PolarHBondContact O-N 3.28Å; V257-C260 PolarHBondContact O-N 2.66Å; V257-S261 PolarHBondContact O-N 2.85Å |
| 258 | L | 47.4 | Very low | 54.9 | Low | 91 Ų | 91 | 94.6 Ų | 94.6 | 48% | 0.476 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -65.3 | -27.9 | 175.1 | -74.4 | 164.5 | 0 | 0 | 0 | 113.1 | E254 F256 | E254-L258 WeakPolarHBondContact O-CG 3.42Å; E254-L258 PolarHBondContact O-N 3.01Å; E254-L258 VanDerWaalsContact O-N 3.07Å; F256-L258 VanDerWaalsContact C-N 3.33Å; F256-L258 PolarHBondContact O-N 2.95Å |
| 259 | T | 49.6 | Very low | 53.9 | Low | 31 Ų | 31 | 93.9 Ų | 93.9 | 19% | 0.19 | 52% | 0.516 | C | S | . | . | H | α-helix | trans | -89.7 | -7.2 | 175.9 | 41.2 | 0 | 0 | 0 | 0 | 114.6 | N219 F223 R255 F256 V257 | N219-T259 WeakPolarHBondContact CB-O 3.32Å; N219-T259 PolarHBondContact ND2-O 3.27Å; F223-T259 HydrophobicContact CB-CG2 4.11Å; F223-T259 HydrophobicContact CD2-CG2 3.66Å; F223-T259 HydrophobicContact CE2-CG2 4.34Å; F223-T259 HydrophobicContact CG-CG2 3.93Å; R255-T259 PolarHBondContact O-N 2.66Å; R255-T259 PolarHBondContact O-OG1 3.04Å; F256-T259 WeakPolarHBondContact CA-OG1 3.39Å; F256-T259 PolarHBondContact O-N 3.33Å; F256-T259 VanDerWaalsContact O-N 3.15Å; F256-T259 PolarHBondContact O-OG1 2.85Å; V257-T259 VanDerWaalsContact C-N 3.26Å; V257-T259 PolarHBondContact O-N 3.28Å |
| 260 | C | 40 | Very low | 52.6 | Low | 78 Ų | 78 | 90.4 Ų | 90.4 | 53% | 0.527 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -125.5 | 7.4 | -173.9 | -81.7 | 0 | 0 | 0 | 0 | 114.7 | F256 V257 | F256-C260 WeakPolarHBondContact O-CB 3.36Å; F256-C260 PolarHBondContact O-N 3.07Å; F256-C260 VanDerWaalsContact O-N 3.11Å; V257-C260 PolarHBondContact O-N 2.66Å |
| 261 | S | 37.3 | Very low | 51.3 | Low | 139 Ų | 139 | 90.4 Ų | 90.4 | 97% | 0.972 | 52% | 0.516 | S | S | * | . | trans | -84.1 | 0 | 167.9 | -159.8 | 0 | 0 | 0 | 0 | 112.2 | N219 V257 | N219-S261 PolarHBondContact ND2-OXT 3.26Å; V257-S261 PolarHBondContact O-N 2.85Å |
Retrieved 261 of 261 residues in 830.2 ms
(Link to these results)