| 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 | 51.3 | Low | 64.6 | Low | 230 Ų | 230 | 115.6 Ų | 115.6 | 100% | 1.133 | 60% | 0.601 | S | S | * | * | 0 | -18.2 | 0 | -87.8 | 164.5 | 74.2 | 0 | 0 | 116.1 | |||||
| 2 | K | 50.5 | Low | 66.1 | Low | 205 Ų | 205 | 117 Ų | 117 | 89% | 0.891 | 60% | 0.599 | S | S | * | * | trans | -74 | -25.1 | -178.9 | -74.6 | -177.8 | 176 | 179.6 | 0 | 116 | ||||
| 3 | A | 56.1 | Low | 67.6 | Low | 78 Ų | 78 | 114.8 Ų | 114.8 | 65% | 0.645 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -72.5 | -31.3 | -175.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | G5 S6 | A3-G5 VanDerWaalsContact C-N 3.34Å; A3-G5 PolarHBondContact O-N 2.98Å; A3-S6 PolarHBondContact O-N 3.44Å |
| 4 | V | 56.6 | Low | 69 | Low | 96 Ų | 96 | 110.3 Ų | 110.3 | 58% | 0.582 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -71.2 | -29.3 | -175.1 | -179.3 | 0 | 0 | 0 | 0 | 112.3 | ||
| 5 | G | 59.4 | Low | 70.2 | Confident | 47 Ų | 47 | 105.5 Ų | 105.5 | 49% | 0.485 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -72.6 | -37.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | A3 R8 L9 | A3-G5 VanDerWaalsContact C-N 3.34Å; A3-G5 PolarHBondContact O-N 2.98Å; G5-R8 PolarHBondContact O-N 3.45Å; G5-L9 PolarHBondContact O-N 2.91Å |
| 6 | S | 62.4 | Low | 71.4 | Confident | 79 Ų | 79 | 103.2 Ų | 103.2 | 55% | 0.552 | 54% | 0.542 | S | S | * | . | H | α-helix | trans | -66.9 | -43.6 | -178.4 | -172.3 | 0 | 0 | 0 | 0 | 112.2 | A3 R8 L9 R10 | A3-S6 PolarHBondContact O-N 3.44Å; S6-R8 VanDerWaalsContact C-N 3.28Å; S6-R8 PolarHBondContact O-N 3.36Å; S6-L9 PolarHBondContact O-N 3.41Å; S6-L9 VanDerWaalsContact O-N 3.17Å; S6-R10 PolarHBondContact O-N 3.28Å |
| 7 | E | 68.4 | Low | 72.6 | Confident | 95 Ų | 95 | 104.4 Ų | 104.4 | 44% | 0.444 | 55% | 0.548 | S | S | . | . | H | α-helix | trans | -65.1 | -30.2 | 178.8 | -76.8 | -68.1 | 122.9 | 0 | 0 | 113 | R10 P11 | E7-R10 IonicContact OE1-CZ 3.89Å; E7-R10 IonicContact OE1-NH1 2.82Å; E7-R10 PolarHBondContact OE1-NH1 3.42Å; E7-R10 IonicContact OE2-NH1 3.35Å; E7-R10 PolarHBondContact OE2-NH1 3.12Å; E7-P11 WeakPolarHBondContact O-CD 3.31Å |
| 8 | R | 69.9 | Low | 73.7 | Confident | 189 Ų | 189 | 101.3 Ų | 101.3 | 71% | 0.713 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -74.4 | -32.2 | 174.6 | -72.7 | -174.8 | -179.6 | -172.2 | 0.2 | 112.8 | G5 S6 F12 | G5-R8 PolarHBondContact O-N 3.45Å; S6-R8 VanDerWaalsContact C-N 3.28Å; S6-R8 PolarHBondContact O-N 3.36Å; R8-F12 WeakPolarHBondContact O-CD2 3.45Å |
| 9 | L | 75.9 | Confident | 74.7 | Confident | 98 Ų | 98 | 100.5 Ų | 100.5 | 51% | 0.513 | 53% | 0.529 | S | S | . | . | H | α-helix | trans | -85.1 | -26.6 | -177.8 | -160.6 | 71.8 | 0 | 0 | 0 | 112.7 | G5 S6 F12 L13 | G5-L9 PolarHBondContact O-N 2.91Å; S6-L9 PolarHBondContact O-N 3.41Å; S6-L9 VanDerWaalsContact O-N 3.17Å; L9-F12 PolarHBondContact O-N 3.2Å; L9-F12 VanDerWaalsContact O-N 3.08Å; L9-L13 HydrophobicContact CD2-CD1 4.05Å; L9-L13 HydrophobicContact CD2-CG 4.33Å; L9-L13 HydrophobicContact CG-CD1 4.14Å; L9-L13 HydrophobicContact CG-CG 4.1Å; L9-L13 PolarHBondContact O-N 3.22Å |
| 10 | R | 80.4 | Confident | 75.6 | Confident | 131 Ų | 131 | 99.8 Ų | 99.8 | 49% | 0.494 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -52.7 | -45.9 | -176.6 | -162.5 | -178.9 | 89.4 | -166 | 14 | 113.7 | S6 E7 F12 L13 V14 | S6-R10 PolarHBondContact O-N 3.28Å; E7-R10 IonicContact OE1-CZ 3.89Å; E7-R10 IonicContact OE1-NH1 2.82Å; E7-R10 PolarHBondContact OE1-NH1 3.42Å; E7-R10 IonicContact OE2-NH1 3.35Å; E7-R10 PolarHBondContact OE2-NH1 3.12Å; R10-F12 PolarHBondContact O-N 2.91Å; R10-L13 PolarHBondContact O-N 3.07Å; R10-V14 WeakPolarHBondContact O-CG2 3.42Å; R10-V14 PolarHBondContact O-N 3.45Å |
| 11 | P | 80.1 | Confident | 76.4 | Confident | 24 Ų | 24 | 97.1 Ų | 97.1 | 16% | 0.156 | 52% | 0.524 | C | S | . | . | H | α-helix | trans | -52.2 | -51.2 | 172 | -35.4 | 42.6 | 0 | 0 | 0 | 114.8 | E7 L13 V14 V15 I128 | E7-P11 WeakPolarHBondContact O-CD 3.31Å; P11-L13 VanDerWaalsContact C-N 3.31Å; P11-L13 PolarHBondContact O-N 2.97Å; P11-V14 PolarHBondContact O-N 3.14Å; P11-V15 WeakPolarHBondContact O-CG2 3.46Å; P11-V15 PolarHBondContact O-N 2.77Å; P11-V15 VanDerWaalsContact O-N 3.11Å; P11-I128 HydrophobicContact CB-CB 4.31Å; P11-I128 HydrophobicContact CB-CG1 4.35Å; P11-I128 HydrophobicContact CB-CG2 4.16Å |
| 12 | F | 81.9 | Confident | 78.4 | Confident | 132 Ų | 132 | 88 Ų | 88 | 58% | 0.579 | 48% | 0.478 | S | S | * | . | H | α-helix | trans | -65.1 | -38.4 | -177.9 | -65 | -80.3 | 0 | 0 | 0 | 111.1 | R8 L9 R10 V15 S16 | R8-F12 WeakPolarHBondContact O-CD2 3.45Å; L9-F12 PolarHBondContact O-N 3.2Å; L9-F12 VanDerWaalsContact O-N 3.08Å; R10-F12 PolarHBondContact O-N 2.91Å; F12-V15 PolarHBondContact O-N 3.26Å; F12-S16 VanDerWaalsContact O-CB 3.31Å; F12-S16 WeakPolarHBondContact O-CB 3.42Å; F12-S16 PolarHBondContact O-N 3.27Å; F12-S16 PolarHBondContact O-OG 2.91Å |
| 13 | L | 86.5 | Confident | 80.3 | Confident | 89 Ų | 89 | 79.7 Ų | 79.7 | 47% | 0.466 | 45% | 0.448 | S | S | . | . | H | α-helix | trans | -63 | -44.7 | 175 | -70 | 172.1 | 0 | 0 | 0 | 112.1 | L9 R10 P11 V15 S16 L17 | L9-L13 HydrophobicContact CD2-CD1 4.05Å; L9-L13 HydrophobicContact CD2-CG 4.33Å; L9-L13 HydrophobicContact CG-CD1 4.14Å; L9-L13 HydrophobicContact CG-CG 4.1Å; L9-L13 PolarHBondContact O-N 3.22Å; R10-L13 PolarHBondContact O-N 3.07Å; P11-L13 VanDerWaalsContact C-N 3.31Å; P11-L13 PolarHBondContact O-N 2.97Å; L13-V15 VanDerWaalsContact C-N 3.34Å; L13-V15 PolarHBondContact O-N 3Å; L13-S16 PolarHBondContact O-N 2.87Å; L13-L17 VanDerWaalsContact O-CB 3.28Å; L13-L17 WeakPolarHBondContact O-CB 3.34Å; L13-L17 WeakPolarHBondContact O-CG 3.28Å; L13-L17 PolarHBondContact O-N 3.07Å |
| 14 | V | 87.1 | Confident | 82 | Confident | 51 Ų | 51 | 79.2 Ų | 79.2 | 31% | 0.309 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -61.1 | -44.4 | 178.9 | 171.3 | 0 | 0 | 0 | 0 | 111 | R10 P11 S18 | R10-V14 WeakPolarHBondContact O-CG2 3.42Å; R10-V14 PolarHBondContact O-N 3.45Å; P11-V14 PolarHBondContact O-N 3.14Å; V14-S18 VanDerWaalsContact O-CB 3.3Å; V14-S18 WeakPolarHBondContact O-CB 3.42Å; V14-S18 PolarHBondContact O-N 2.9Å; V14-S18 PolarHBondContact O-OG 3Å |
| 15 | V | 87.2 | Confident | 83.7 | Confident | 38 Ų | 38 | 78.4 Ų | 78.4 | 23% | 0.23 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -65.2 | -48.1 | 178.4 | 178.1 | 0 | 0 | 0 | 0 | 111.3 | P11 F12 L13 L17 S18 F19 L124 I128 | P11-V15 WeakPolarHBondContact O-CG2 3.46Å; P11-V15 PolarHBondContact O-N 2.77Å; P11-V15 VanDerWaalsContact O-N 3.11Å; F12-V15 PolarHBondContact O-N 3.26Å; L13-V15 VanDerWaalsContact C-N 3.34Å; L13-V15 PolarHBondContact O-N 3Å; V15-L17 PolarHBondContact O-N 3.4Å; V15-S18 PolarHBondContact O-N 2.85Å; V15-F19 WeakPolarHBondContact O-CB 3.4Å; V15-F19 PolarHBondContact O-N 3.27Å; V15-L124 HydrophobicContact CG2-CD2 4.43Å; V15-I128 HydrophobicContact CG2-CD1 3.2Å; V15-I128 HydrophobicContact CG2-CG1 3.38Å |
| 16 | S | 88.4 | Confident | 85.1 | Confident | 69 Ų | 69 | 77.3 Ų | 77.3 | 48% | 0.483 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -61.6 | -44.1 | 179.7 | -65.9 | 0 | 0 | 0 | 0 | 111.7 | F12 L13 F19 V20 | F12-S16 VanDerWaalsContact O-CB 3.31Å; F12-S16 WeakPolarHBondContact O-CB 3.42Å; F12-S16 PolarHBondContact O-N 3.27Å; F12-S16 PolarHBondContact O-OG 2.91Å; L13-S16 PolarHBondContact O-N 2.87Å; S16-F19 PolarHBondContact O-N 3.34Å; S16-V20 WeakPolarHBondContact O-CB 3.27Å; S16-V20 VanDerWaalsContact O-CG2 3.27Å; S16-V20 WeakPolarHBondContact O-CG2 3.21Å; S16-V20 PolarHBondContact O-N 3.25Å |
| 17 | L | 91.8 | Very high | 86.4 | Confident | 123 Ų | 123 | 76.5 Ų | 76.5 | 64% | 0.644 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -64.5 | -41.1 | 175.6 | -72.1 | 170.5 | 0 | 0 | 0 | 111.8 | L13 V15 V20 G21 | L13-L17 VanDerWaalsContact O-CB 3.28Å; L13-L17 WeakPolarHBondContact O-CB 3.34Å; L13-L17 WeakPolarHBondContact O-CG 3.28Å; L13-L17 PolarHBondContact O-N 3.07Å; V15-L17 PolarHBondContact O-N 3.4Å; L17-V20 PolarHBondContact O-N 3.22Å; L17-G21 PolarHBondContact O-N 3.1Å |
| 18 | S | 91.8 | Very high | 87.4 | Confident | 49 Ų | 49 | 77.8 Ų | 77.8 | 34% | 0.343 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -62.7 | -43.5 | 175.9 | -57.5 | 0 | 0 | 0 | 0 | 111.2 | V14 V15 G21 F22 | V14-S18 VanDerWaalsContact O-CB 3.3Å; V14-S18 WeakPolarHBondContact O-CB 3.42Å; V14-S18 PolarHBondContact O-N 2.9Å; V14-S18 PolarHBondContact O-OG 3Å; V15-S18 PolarHBondContact O-N 2.85Å; S18-G21 PolarHBondContact O-N 3.4Å; S18-F22 WeakPolarHBondContact O-CB 3.5Å; S18-F22 PolarHBondContact O-N 3.25Å |
| 19 | F | 92.7 | Very high | 88.2 | Confident | 87 Ų | 87 | 70 Ų | 70 | 38% | 0.382 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -62.3 | -50 | 177 | -175.4 | -88.1 | 0 | 0 | 0 | 111.6 | V15 S16 G21 F22 A23 F81 F85 I87 | V15-F19 WeakPolarHBondContact O-CB 3.4Å; V15-F19 PolarHBondContact O-N 3.27Å; S16-F19 PolarHBondContact O-N 3.34Å; F19-G21 VanDerWaalsContact C-N 3.35Å; F19-G21 PolarHBondContact O-N 2.92Å; F19-F22 PolarHBondContact O-N 3.13Å; F19-A23 VanDerWaalsContact O-CB 3.29Å; F19-A23 WeakPolarHBondContact O-CB 3.43Å; F19-A23 PolarHBondContact O-N 3.15Å; F19-F81 HydrophobicContact CD2-CE2 4.05Å; F19-F81 AromaticContact CD2-CZ 3.99Å; F19-F81 HydrophobicContact CD2-CZ 3.99Å; F19-F81 HydrophobicContact CE2-CE1 4.35Å; F19-F81 AromaticContact CE2-CE2 3.98Å; F19-F81 HydrophobicContact CE2-CE2 3.98Å; F19-F81 AromaticContact CE2-CZ 3.43Å; F19-F81 HydrophobicContact CE2-CZ 3.43Å; F19-F81 VanDerWaalsContact CE2-CZ 3.43Å; F19-F81 HydrophobicContact CZ-CE2 4.48Å; F19-F81 AromaticContact CZ-CZ 3.74Å; F19-F81 HydrophobicContact CZ-CZ 3.74Å; F19-F85 HydrophobicContact CB-CD1 4.38Å; F19-F85 HydrophobicContact CB-CE1 3.74Å; F19-F85 HydrophobicContact CB-CZ 3.87Å; F19-F85 HydrophobicContact CD2-CB 4.46Å; F19-F85 AromaticContact CD2-CD1 3.71Å; F19-F85 HydrophobicContact CD2-CD1 3.71Å; F19-F85 AromaticContact CD2-CD2 3.93Å; F19-F85 HydrophobicContact CD2-CD2 3.93Å; F19-F85 AromaticContact CD2-CE1 3.88Å; F19-F85 HydrophobicContact CD2-CE1 3.88Å; F19-F85 HydrophobicContact CD2-CE2 4.12Å; F19-F85 AromaticContact CD2-CG 3.75Å; F19-F85 HydrophobicContact CD2-CG 3.75Å; F19-F85 HydrophobicContact CD2-CZ 4.11Å; F19-F85 HydrophobicContact CE2-CD2 4.45Å; F19-F85 HydrophobicContact CE2-CG 4.3Å; F19-F85 HydrophobicContact CG-CE1 4.32Å; F19-F85 HydrophobicContact CG-CZ 4.44Å; F19-I87 HydrophobicContact CE2-CD1 4.41Å |
| 20 | V | 93.5 | Very high | 88.5 | Confident | 86 Ų | 86 | 68.7 Ų | 68.7 | 52% | 0.521 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -62.9 | -41.5 | 178.7 | 171.4 | 0 | 0 | 0 | 0 | 111.2 | S16 L17 A23 S24 | S16-V20 WeakPolarHBondContact O-CB 3.27Å; S16-V20 VanDerWaalsContact O-CG2 3.27Å; S16-V20 WeakPolarHBondContact O-CG2 3.21Å; S16-V20 PolarHBondContact O-N 3.25Å; L17-V20 PolarHBondContact O-N 3.22Å; V20-A23 PolarHBondContact O-N 3.45Å; V20-S24 VanDerWaalsContact O-CB 3.28Å; V20-S24 WeakPolarHBondContact O-CB 3.31Å; V20-S24 PolarHBondContact O-N 3.24Å; V20-S24 PolarHBondContact O-OG 3.34Å |
| 21 | G | 92.9 | Very high | 88.7 | Confident | 43 Ų | 43 | 72.2 Ų | 72.2 | 44% | 0.443 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -61.5 | -46 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.2 | L17 S18 F19 S24 L25 | L17-G21 PolarHBondContact O-N 3.1Å; S18-G21 PolarHBondContact O-N 3.4Å; F19-G21 VanDerWaalsContact C-N 3.35Å; F19-G21 PolarHBondContact O-N 2.92Å; G21-S24 PolarHBondContact O-N 3.2Å; G21-L25 PolarHBondContact O-N 2.93Å |
| 22 | F | 92.4 | Very high | 88.8 | Confident | 39 Ų | 39 | 79.6 Ų | 79.6 | 17% | 0.171 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -69.3 | -40.5 | 179.1 | -142.9 | -65.5 | 0 | 0 | 0 | 112.3 | S18 F19 S24 L25 L26 T77 I80 F81 F85 L120 | S18-F22 WeakPolarHBondContact O-CB 3.5Å; S18-F22 PolarHBondContact O-N 3.25Å; F19-F22 PolarHBondContact O-N 3.13Å; F22-S24 VanDerWaalsContact C-N 3.31Å; F22-S24 PolarHBondContact O-N 3.48Å; F22-L25 WeakPolarHBondContact O-CB 3.24Å; F22-L25 PolarHBondContact O-N 3.31Å; F22-L26 HydrophobicContact CD1-CD1 4.46Å; F22-L26 HydrophobicContact CD1-CG 4.4Å; F22-L26 PolarHBondContact O-N 2.84Å; F22-T77 HydrophobicContact CD1-CG2 4.34Å; F22-T77 HydrophobicContact CE1-CG2 3.55Å; F22-T77 WeakPolarHBondContact CE1-O 3.45Å; F22-T77 HydrophobicContact CZ-CG2 4.25Å; F22-I80 HydrophobicContact CE2-CG2 3.99Å; F22-I80 HydrophobicContact CZ-CB 4.04Å; F22-I80 HydrophobicContact CZ-CG2 3.56Å; F22-F81 HydrophobicContact CB-CD2 3.74Å; F22-F81 HydrophobicContact CB-CE2 4.03Å; F22-F81 HydrophobicContact CD1-CB 3.67Å; F22-F81 AromaticContact CD1-CD2 3.4Å; F22-F81 HydrophobicContact CD1-CD2 3.4Å; F22-F81 VanDerWaalsContact CD1-CD2 3.4Å; F22-F81 HydrophobicContact CD1-CE2 4.42Å; F22-F81 AromaticContact CD1-CG 3.97Å; F22-F81 HydrophobicContact CD1-CG 3.97Å; F22-F81 HydrophobicContact CE1-CB 3.57Å; F22-F81 HydrophobicContact CE1-CD2 4.2Å; F22-F81 HydrophobicContact CE1-CG 4.38Å; F22-F81 AromaticContact CG-CD2 3.72Å; F22-F81 HydrophobicContact CG-CD2 3.72Å; F22-F81 HydrophobicContact CG-CE2 4.49Å; F22-F81 HydrophobicContact CZ-CB 4.42Å; F22-F85 HydrophobicContact CB-CE2 4.07Å; F22-F85 HydrophobicContact CG-CE2 4.36Å; F22-L120 HydrophobicContact CE2-CD1 4.01Å |
| 23 | A | 91.1 | Very high | 88.5 | Confident | 30 Ų | 30 | 74.8 Ų | 74.8 | 25% | 0.248 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -62.7 | -39.5 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | F19 V20 L26 V27 | F19-A23 VanDerWaalsContact O-CB 3.29Å; F19-A23 WeakPolarHBondContact O-CB 3.43Å; F19-A23 PolarHBondContact O-N 3.15Å; V20-A23 PolarHBondContact O-N 3.45Å; A23-L26 WeakPolarHBondContact O-CB 3.25Å; A23-L26 PolarHBondContact O-N 3.08Å; A23-V27 WeakPolarHBondContact O-CG2 3.5Å; A23-V27 PolarHBondContact O-N 2.81Å |
| 24 | S | 91.8 | Very high | 87.7 | Confident | 69 Ų | 69 | 72.5 Ų | 72.5 | 48% | 0.483 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -64.8 | -39.7 | 175.1 | -58.7 | 0 | 0 | 0 | 0 | 111.7 | V20 G21 F22 V27 Y28 | V20-S24 VanDerWaalsContact O-CB 3.28Å; V20-S24 WeakPolarHBondContact O-CB 3.31Å; V20-S24 PolarHBondContact O-N 3.24Å; V20-S24 PolarHBondContact O-OG 3.34Å; G21-S24 PolarHBondContact O-N 3.2Å; F22-S24 VanDerWaalsContact C-N 3.31Å; F22-S24 PolarHBondContact O-N 3.48Å; S24-V27 PolarHBondContact O-N 3.17Å; S24-Y28 VanDerWaalsContact O-CB 3.29Å; S24-Y28 WeakPolarHBondContact O-CB 3.32Å; S24-Y28 PolarHBondContact O-N 2.91Å |
| 25 | L | 91.7 | Very high | 86.5 | Confident | 79 Ų | 79 | 74.5 Ų | 74.5 | 41% | 0.414 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -62.2 | -44 | 173.2 | 178.5 | 64.8 | 0 | 0 | 0 | 111.4 | G21 F22 Y28 I29 T77 | G21-L25 PolarHBondContact O-N 2.93Å; F22-L25 WeakPolarHBondContact O-CB 3.24Å; F22-L25 PolarHBondContact O-N 3.31Å; L25-Y28 HydrophobicContact CD1-CD1 4.5Å; L25-Y28 WeakPolarHBondContact O-CB 3.45Å; L25-Y28 PolarHBondContact O-N 2.85Å; L25-I29 HydrophobicContact CD1-CD1 4.14Å; L25-I29 HydrophobicContact CD1-CG1 4.36Å; L25-I29 HydrophobicContact CG-CD1 3.97Å; L25-I29 VanDerWaalsContact O-CG1 3.31Å; L25-I29 WeakPolarHBondContact O-CG1 3.32Å; L25-I29 PolarHBondContact O-N 3.21Å; L25-T77 HydrophobicContact CD2-CG2 4.18Å; L25-T77 HydrophobicContact CG-CG2 4.46Å |
| 26 | L | 89.5 | Confident | 85.3 | Confident | 23 Ų | 23 | 74.6 Ų | 74.6 | 12% | 0.12 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -60.2 | -47.8 | 175.2 | -78.9 | 173.4 | 0 | 0 | 0 | 111.7 | F22 A23 Y28 I29 T30 T77 I78 F81 | F22-L26 HydrophobicContact CD1-CD1 4.46Å; F22-L26 HydrophobicContact CD1-CG 4.4Å; F22-L26 PolarHBondContact O-N 2.84Å; A23-L26 WeakPolarHBondContact O-CB 3.25Å; A23-L26 PolarHBondContact O-N 3.08Å; L26-Y28 VanDerWaalsContact C-N 3.26Å; L26-Y28 PolarHBondContact O-N 3.29Å; L26-I29 PolarHBondContact O-N 3.3Å; L26-T30 WeakPolarHBondContact O-CG2 3.3Å; L26-T30 PolarHBondContact O-N 2.75Å; L26-T30 PolarHBondContact O-OG1 2.88Å; L26-T30 VanDerWaalsContact O-OG1 3.12Å; L26-T77 HydrophobicContact CD2-CG2 3.57Å; L26-T77 HydrophobicContact CG-CG2 4.13Å; L26-I78 HydrophobicContact CD2-CB 4.4Å; L26-I78 HydrophobicContact CD2-CG1 3.54Å; L26-F81 HydrophobicContact CD1-CB 3.85Å; L26-F81 HydrophobicContact CD1-CD1 3.79Å; L26-F81 HydrophobicContact CD1-CD2 3.97Å; L26-F81 HydrophobicContact CD1-CE1 4.29Å; L26-F81 HydrophobicContact CD1-CE2 4.44Å; L26-F81 HydrophobicContact CD1-CG 3.6Å |
| 27 | V | 88.4 | Confident | 84 | Confident | 62 Ų | 62 | 73.8 Ų | 73.8 | 38% | 0.376 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -60.7 | -37.5 | 176 | 171.4 | 0 | 0 | 0 | 0 | 111.6 | A23 S24 T30 R31 | A23-V27 WeakPolarHBondContact O-CG2 3.5Å; A23-V27 PolarHBondContact O-N 2.81Å; S24-V27 PolarHBondContact O-N 3.17Å; V27-T30 WeakPolarHBondContact CA-OG1 3.4Å; V27-T30 PolarHBondContact O-OG1 2.84Å; V27-R31 WeakPolarHBondContact O-CB 3.34Å; V27-R31 VanDerWaalsContact O-CG 3.28Å; V27-R31 WeakPolarHBondContact O-CG 3.27Å; V27-R31 PolarHBondContact O-N 3.29Å |
| 28 | Y | 90 | Very high | 82.4 | Confident | 123 Ų | 123 | 74.6 Ų | 74.6 | 48% | 0.482 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -67 | -44.9 | 176.8 | 172.6 | -100.4 | 0 | 0 | 0 | 112.2 | S24 L25 L26 R31 R32 | S24-Y28 VanDerWaalsContact O-CB 3.29Å; S24-Y28 WeakPolarHBondContact O-CB 3.32Å; S24-Y28 PolarHBondContact O-N 2.91Å; L25-Y28 HydrophobicContact CD1-CD1 4.5Å; L25-Y28 WeakPolarHBondContact O-CB 3.45Å; L25-Y28 PolarHBondContact O-N 2.85Å; L26-Y28 VanDerWaalsContact C-N 3.26Å; L26-Y28 PolarHBondContact O-N 3.29Å; Y28-R31 PolarHBondContact O-N 3.13Å; Y28-R32 PolarHBondContact O-N 3.48Å; Y28-R32 PolarHBondContact OH-NE 3.45Å; Y28-R32 PolarHBondContact OH-NH2 3.28Å |
| 29 | I | 86.3 | Confident | 80.7 | Confident | 24 Ų | 24 | 80 Ų | 80 | 12% | 0.123 | 41% | 0.414 | C | S | . | . | H | α-helix | trans | -62.4 | -50 | 176.7 | -67.4 | 165.2 | 0 | 0 | 0 | 109.3 | L25 L26 R31 R32 L33 I73 L74 T77 | L25-I29 HydrophobicContact CD1-CD1 4.14Å; L25-I29 HydrophobicContact CD1-CG1 4.36Å; L25-I29 HydrophobicContact CG-CD1 3.97Å; L25-I29 VanDerWaalsContact O-CG1 3.31Å; L25-I29 WeakPolarHBondContact O-CG1 3.32Å; L25-I29 PolarHBondContact O-N 3.21Å; L26-I29 PolarHBondContact O-N 3.3Å; I29-R31 VanDerWaalsContact C-N 3.3Å; I29-R31 PolarHBondContact O-N 3.36Å; I29-R32 WeakPolarHBondContact O-CA 3.42Å; I29-R32 WeakPolarHBondContact O-CB 3.23Å; I29-R32 PolarHBondContact O-N 3.05Å; I29-L33 HydrophobicContact CG2-CD1 4.26Å; I29-L33 WeakPolarHBondContact O-CD1 3.34Å; I29-L33 PolarHBondContact O-N 3.29Å; I29-I73 HydrophobicContact CD1-CG2 4.16Å; I29-L74 HydrophobicContact CG2-CB 4.16Å; I29-L74 HydrophobicContact CG2-CD1 3.87Å; I29-T77 HydrophobicContact CD1-CG2 3.81Å |
| 30 | T | 82.5 | Confident | 79.2 | Confident | 72 Ų | 72 | 77.8 Ų | 77.8 | 44% | 0.442 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -60.2 | -37 | -178.9 | 55.1 | 0 | 0 | 0 | 0 | 113 | L26 V27 R32 L33 L74 | L26-T30 WeakPolarHBondContact O-CG2 3.3Å; L26-T30 PolarHBondContact O-N 2.75Å; L26-T30 PolarHBondContact O-OG1 2.88Å; L26-T30 VanDerWaalsContact O-OG1 3.12Å; V27-T30 WeakPolarHBondContact CA-OG1 3.4Å; V27-T30 PolarHBondContact O-OG1 2.84Å; T30-R32 VanDerWaalsContact C-N 3.28Å; T30-R32 PolarHBondContact O-N 3.23Å; T30-L33 PolarHBondContact O-N 3.18Å; T30-L74 HydrophobicContact CG2-CD1 3.67Å |
| 31 | R | 84.2 | Confident | 77.5 | Confident | 204 Ų | 204 | 79.8 Ų | 79.8 | 77% | 0.77 | 40% | 0.403 | S | S | * | . | H | α-helix | trans | -69.8 | -21.9 | 174.2 | -76.6 | -177.9 | 177.2 | 147.9 | 1.3 | 114.4 | V27 Y28 I29 | V27-R31 WeakPolarHBondContact O-CB 3.34Å; V27-R31 VanDerWaalsContact O-CG 3.28Å; V27-R31 WeakPolarHBondContact O-CG 3.27Å; V27-R31 PolarHBondContact O-N 3.29Å; Y28-R31 PolarHBondContact O-N 3.13Å; I29-R31 VanDerWaalsContact C-N 3.3Å; I29-R31 PolarHBondContact O-N 3.36Å |
| 32 | R | 83.2 | Confident | 75.8 | Confident | 179 Ų | 179 | 80 Ų | 80 | 68% | 0.675 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -85.8 | -11.3 | 174.5 | -80.3 | -167.8 | 172.8 | -132.8 | 1 | 113.2 | Y28 I29 T30 | Y28-R32 PolarHBondContact O-N 3.48Å; Y28-R32 PolarHBondContact OH-NE 3.45Å; Y28-R32 PolarHBondContact OH-NH2 3.28Å; I29-R32 WeakPolarHBondContact O-CA 3.42Å; I29-R32 WeakPolarHBondContact O-CB 3.23Å; I29-R32 PolarHBondContact O-N 3.05Å; T30-R32 VanDerWaalsContact C-N 3.28Å; T30-R32 PolarHBondContact O-N 3.23Å |
| 33 | L | 76 | Confident | 74.1 | Confident | 31 Ų | 31 | 81.8 Ų | 81.8 | 16% | 0.162 | 41% | 0.414 | C | S | . | . | S | Bend | trans | -69.1 | 139 | 169.4 | -79.8 | 109.5 | 0 | 0 | 0 | 109.4 | I29 T30 I71 L74 | I29-L33 HydrophobicContact CG2-CD1 4.26Å; I29-L33 WeakPolarHBondContact O-CD1 3.34Å; I29-L33 PolarHBondContact O-N 3.29Å; T30-L33 PolarHBondContact O-N 3.18Å; L33-I71 HydrophobicContact CD2-CD1 3.61Å; L33-L74 HydrophobicContact CD1-CB 4.41Å; L33-L74 HydrophobicContact CD1-CD1 4.1Å; L33-L74 HydrophobicContact CD1-CD2 3.76Å; L33-L74 HydrophobicContact CD1-CG 4.3Å; L33-L74 HydrophobicContact CD2-CD2 4.09Å |
| 34 | P | 68.4 | Low | 72.6 | Confident | 41 Ų | 41 | 84.9 Ų | 84.9 | 27% | 0.266 | 42% | 0.422 | S | S | . | . | P | Polyproline II helix | trans | -58.4 | 144.4 | 172.8 | 21.9 | -26.4 | 0 | 0 | 0 | 109.3 | L36 Y63 Y67 | P34-L36 PolarHBondContact O-N 2.9Å; P34-L36 VanDerWaalsContact O-N 3.12Å; P34-Y63 HydrophobicContact CG-CD1 4.45Å; P34-Y63 HydrophobicContact CG-CE1 4.1Å; P34-Y67 HydrophobicContact CB-CE2 4.33Å; P34-Y67 HydrophobicContact CG-CD1 4.19Å; P34-Y67 HydrophobicContact CG-CD2 3.74Å; P34-Y67 HydrophobicContact CG-CE1 3.87Å; P34-Y67 HydrophobicContact CG-CE2 3.38Å; P34-Y67 HydrophobicContact CG-CG 4.14Å; P34-Y67 VanDerWaalsContact CG-CZ 3.47Å |
| 35 | S | 63 | Low | 71.4 | Confident | 94 Ų | 94 | 88.7 Ų | 88.7 | 66% | 0.657 | 43% | 0.43 | S | S | * | . | P | Polyproline II helix | trans | -54 | 120.6 | -176.9 | 50.2 | 0 | 0 | 0 | 0 | 110.8 | Y63 | S35-Y63 PolarHBondContact O-OH 3.42Å; S35-Y63 VanDerWaalsContact O-OH 3.06Å |
| 36 | L | 62.1 | Low | 70.5 | Confident | 39 Ų | 39 | 90.5 Ų | 90.5 | 20% | 0.204 | 44% | 0.435 | C | S | . | . | P | Polyproline II helix | trans | -55 | 134.6 | 165.1 | -71.4 | 153.1 | 0 | 0 | 0 | 109.4 | P34 E38 R41 F44 V59 Y63 | P34-L36 PolarHBondContact O-N 2.9Å; P34-L36 VanDerWaalsContact O-N 3.12Å; L36-E38 PolarHBondContact O-N 3.47Å; L36-R41 HydrophobicContact CB-CG 4.23Å; L36-F44 HydrophobicContact CD1-CD2 3.67Å; L36-F44 HydrophobicContact CD1-CE1 4.5Å; L36-F44 HydrophobicContact CD1-CE2 3.18Å; L36-F44 HydrophobicContact CD1-CZ 3.65Å; L36-F44 HydrophobicContact CD2-CE2 3.72Å; L36-F44 HydrophobicContact CD2-CZ 4.11Å; L36-F44 HydrophobicContact CG-CE2 4.06Å; L36-V59 HydrophobicContact CD2-CG1 3.62Å; L36-Y63 WeakPolarHBondContact CA-OH 3.41Å; L36-Y63 HydrophobicContact CD2-CD1 4.47Å; L36-Y63 HydrophobicContact CD2-CD2 3.96Å; L36-Y63 HydrophobicContact CD2-CE1 4.02Å; L36-Y63 HydrophobicContact CD2-CE2 3.47Å; L36-Y63 VanDerWaalsContact CD2-CE2 3.47Å; L36-Y63 HydrophobicContact CD2-CG 4.45Å; L36-Y63 HydrophobicContact CG-CE1 4.45Å |
| 37 | P | 60.4 | Low | 70 | Confident | 53 Ų | 53 | 90.1 Ų | 90.1 | 34% | 0.344 | 43% | 0.434 | S | S | . | . | trans | -41.4 | 132.8 | 163.1 | -28.5 | 28.3 | 0 | 0 | 0 | 108.7 | E39 H40 Y63 | P37-E39 PolarHBondContact O-N 2.86Å; P37-H40 PolarHBondContact O-N 3.22Å; P37-Y63 WeakPolarHBondContact CD-OH 3.41Å | ||
| 38 | E | 58.3 | Low | 69.6 | Low | 139 Ų | 139 | 94.7 Ų | 94.7 | 65% | 0.65 | 45% | 0.451 | S | S | * | . | H | α-helix | trans | -49.3 | -34 | -179.7 | -74.8 | -82 | 158.1 | 0 | 0 | 111.2 | L36 H40 R41 | L36-E38 PolarHBondContact O-N 3.47Å; E38-H40 PolarHBondContact O-N 3.48Å; E38-R41 VanDerWaalsContact CD-NH1 3.34Å; E38-R41 PolarHBondContact O-N 3.02Å; E38-R41 IonicContact OE1-CZ 3.99Å; E38-R41 IonicContact OE1-NE 3.84Å; E38-R41 IonicContact OE1-NH1 2.64Å; E38-R41 PolarHBondContact OE1-NH1 3.39Å; E38-R41 IonicContact OE1-NH2 3.1Å; E38-R41 PolarHBondContact OE1-NH2 3.31Å; E38-R41 IonicContact OE2-NH1 3.57Å |
| 39 | E | 55.9 | Low | 69.4 | Low | 163 Ų | 163 | 92.3 Ų | 92.3 | 76% | 0.762 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -56.6 | -30.3 | 176.4 | -162.2 | 167.7 | -171 | 0 | 0 | 113.6 | P37 | P37-E39 PolarHBondContact O-N 2.86Å |
| 40 | H | 60.8 | Low | 69.2 | Low | 41 Ų | 41 | 95.8 Ų | 95.8 | 19% | 0.19 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -97.8 | -11.3 | -177.6 | -61.4 | -46.9 | 0 | 0 | 0 | 114.7 | P37 E38 G42 H43 V59 | P37-H40 PolarHBondContact O-N 3.22Å; E38-H40 PolarHBondContact O-N 3.48Å; H40-G42 PolarHBondContact O-N 3.35Å; H40-H43 WeakPolarHBondContact O-CB 3.22Å; H40-H43 PolarHBondContact O-N 3.3Å; H40-V59 HydrophobicContact CB-CG1 3.89Å; H40-V59 HydrophobicContact CB-CG2 3.85Å |
| 41 | R | 57.5 | Low | 69.3 | Low | 128 Ų | 128 | 97.6 Ų | 97.6 | 48% | 0.483 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -63.2 | -29.1 | -178.7 | -69.6 | -172 | -175 | 162.5 | 10.8 | 112.9 | L36 E38 H43 | L36-R41 HydrophobicContact CB-CG 4.23Å; E38-R41 VanDerWaalsContact CD-NH1 3.34Å; E38-R41 PolarHBondContact O-N 3.02Å; E38-R41 IonicContact OE1-CZ 3.99Å; E38-R41 IonicContact OE1-NE 3.84Å; E38-R41 IonicContact OE1-NH1 2.64Å; E38-R41 PolarHBondContact OE1-NH1 3.39Å; E38-R41 IonicContact OE1-NH2 3.1Å; E38-R41 PolarHBondContact OE1-NH2 3.31Å; E38-R41 IonicContact OE2-NH1 3.57Å; R41-H43 PolarHBondContact O-N 3.07Å |
| 42 | G | 57.8 | Low | 69.3 | Low | 48 Ų | 48 | 91 Ų | 91 | 50% | 0.495 | 45% | 0.453 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.9 | -20.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 114.3 | H40 | H40-G42 PolarHBondContact O-N 3.35Š|
| 43 | H | 57 | Low | 69.4 | Low | 76 Ų | 76 | 83.2 Ų | 83.2 | 35% | 0.352 | 43% | 0.425 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.7 | -11.5 | -175.5 | -63.8 | -87.3 | 0 | 0 | 0 | 113.7 | H40 R41 K45 I56 | H40-H43 WeakPolarHBondContact O-CB 3.22Å; H40-H43 PolarHBondContact O-N 3.3Å; R41-H43 PolarHBondContact O-N 3.07Å; H43-K45 PolarHBondContact O-N 3.14Å; H43-I56 WeakPolarHBondContact O-CG1 3.37Å |
| 44 | F | 59.3 | Low | 69.9 | Low | 94 Ų | 94 | 84.6 Ų | 84.6 | 41% | 0.412 | 43% | 0.43 | S | S | . | . | trans | -79.5 | 54.7 | 173.1 | -79.4 | -91.5 | 0 | 0 | 0 | 111.7 | L36 V59 L60 | L36-F44 HydrophobicContact CD1-CD2 3.67Å; L36-F44 HydrophobicContact CD1-CE1 4.5Å; L36-F44 HydrophobicContact CD1-CE2 3.18Å; L36-F44 HydrophobicContact CD1-CZ 3.65Å; L36-F44 HydrophobicContact CD2-CE2 3.72Å; L36-F44 HydrophobicContact CD2-CZ 4.11Å; L36-F44 HydrophobicContact CG-CE2 4.06Å; F44-V59 HydrophobicContact CE2-CG1 3.97Å; F44-V59 HydrophobicContact CZ-CG1 4.36Å; F44-L60 HydrophobicContact CE1-CD2 4.19Å; F44-L60 HydrophobicContact CZ-CD2 3.94Å | ||
| 45 | K | 67.7 | Low | 70.7 | Confident | 150 Ų | 150 | 85.4 Ų | 85.4 | 65% | 0.652 | 43% | 0.432 | S | S | * | . | S | Bend | trans | -105 | 158.6 | 165.7 | -67.1 | -178.4 | -176.4 | 176.1 | 0 | 108.5 | H43 P47 I56 | H43-K45 PolarHBondContact O-N 3.14Å; K45-P47 WeakPolarHBondContact O-CD 3.48Å; K45-I56 WeakPolarHBondContact O-CD1 3.32Å |
| 46 | F | 73.1 | Confident | 71.8 | Confident | 116 Ų | 116 | 81.5 Ų | 81.5 | 51% | 0.509 | 40% | 0.404 | S | S | . | . | trans | -60.4 | 122.3 | 171.2 | -174.9 | -92.3 | 0 | 0 | 0 | 108.3 | H48 V92 | F46-H48 PolarHBondContact O-CD2 3.21Å; F46-H48 PolarHBondContact O-N 2.89Å; F46-V92 HydrophobicContact CE2-CG2 4.17Å; F46-V92 HydrophobicContact CZ-CG2 4.11Å | ||
| 47 | P | 78.7 | Confident | 72.9 | Confident | 16 Ų | 16 | 79.7 Ų | 79.7 | 10% | 0.104 | 39% | 0.394 | C | S | . | . | trans | -71.1 | 123.6 | -172.7 | 26.7 | -32 | 0 | 0 | 0 | 110 | K45 E52 L53 I56 V92 | K45-P47 WeakPolarHBondContact O-CD 3.48Å; P47-E52 WeakPolarHBondContact CA-OE2 3.35Å; P47-E52 HydrophobicContact CB-CB 3.88Å; P47-L53 HydrophobicContact CB-CB 4.01Å; P47-L53 HydrophobicContact CG-CB 4.38Å; P47-L53 HydrophobicContact CG-CD1 4.04Å; P47-I56 HydrophobicContact CB-CD1 3.96Å; P47-I56 HydrophobicContact CG-CD1 3.95Å; P47-V92 HydrophobicContact CG-CG1 3.69Å; P47-V92 HydrophobicContact CG-CG2 3.99Å | ||
| 48 | H | 80 | Confident | 74.1 | Confident | 157 Ų | 157 | 80.5 Ų | 80.5 | 73% | 0.727 | 40% | 0.395 | S | S | * | . | trans | -92.8 | -17.9 | 178 | -68.8 | -74.3 | 0 | 0 | 0 | 112.9 | F46 E52 | F46-H48 PolarHBondContact O-CD2 3.21Å; F46-H48 PolarHBondContact O-N 2.89Å; H48-E52 IonicContact CD2-OE2 3.25Å; H48-E52 PolarHBondContact N-OE2 3.13Å | ||
| 49 | N | 84.9 | Confident | 75.3 | Confident | 74 Ų | 74 | 74.2 Ų | 74.2 | 40% | 0.396 | 37% | 0.366 | S | S | . | . | S | Bend | trans | -140.6 | 172.3 | 179.6 | 58.5 | 51.6 | 0 | 0 | 0 | 111 | D51 E52 L53 | N49-D51 VanDerWaalsContact C-N 3.3Å; N49-D51 PolarHBondContact O-N 3.08Å; N49-D51 PolarHBondContact OD1-N 3.29Å; N49-E52 PolarHBondContact ND2-OE1 3.4Å; N49-E52 VanDerWaalsContact ND2-OE1 3.1Å; N49-E52 WeakPolarHBondContact OD1-CB 3.47Å; N49-E52 WeakPolarHBondContact OD1-CG 3.01Å; N49-E52 PolarHBondContact OD1-N 2.96Å; N49-L53 PolarHBondContact O-N 3.48Å |
| 50 | V | 82.1 | Confident | 76.7 | Confident | 96 Ų | 96 | 66.8 Ų | 66.8 | 58% | 0.582 | 33% | 0.332 | S | S | * | . | H | α-helix | trans | -66.9 | -32.9 | -177.9 | -179.5 | 0 | 0 | 0 | 0 | 111.5 | L53 K54 L209 | V50-L53 PolarHBondContact O-N 3.43Å; V50-K54 WeakPolarHBondContact O-CB 3.43Å; V50-K54 PolarHBondContact O-N 3.44Å; V50-L209 HydrophobicContact CG1-CD1 3.85Å |
| 51 | D | 83.9 | Confident | 77.9 | Confident | 110 Ų | 110 | 66.6 Ų | 66.6 | 59% | 0.588 | 34% | 0.335 | S | S | * | . | H | α-helix | trans | -69 | -41.1 | -179.5 | -59.8 | -53.1 | 0 | 0 | 0 | 112.2 | N49 L53 K54 N55 | N49-D51 VanDerWaalsContact C-N 3.3Å; N49-D51 PolarHBondContact O-N 3.08Å; N49-D51 PolarHBondContact OD1-N 3.29Å; D51-L53 VanDerWaalsContact C-N 3.33Å; D51-K54 WeakPolarHBondContact O-CB 3.25Å; D51-K54 PolarHBondContact O-N 2.64Å; D51-N55 VanDerWaalsContact O-CG 3.25Å; D51-N55 PolarHBondContact O-N 3.32Å; D51-N55 PolarHBondContact O-ND2 3.45Å |
| 52 | E | 85 | Confident | 79.1 | Confident | 66 Ų | 66 | 65.9 Ų | 65.9 | 31% | 0.308 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -62.3 | -42.2 | 172.2 | -75.6 | 171.3 | -156.4 | 0 | 0 | 111 | P47 H48 N49 K54 N55 I56 | P47-E52 WeakPolarHBondContact CA-OE2 3.35Å; P47-E52 HydrophobicContact CB-CB 3.88Å; H48-E52 IonicContact CD2-OE2 3.25Å; H48-E52 PolarHBondContact N-OE2 3.13Å; N49-E52 PolarHBondContact ND2-OE1 3.4Å; N49-E52 VanDerWaalsContact ND2-OE1 3.1Å; N49-E52 WeakPolarHBondContact OD1-CB 3.47Å; N49-E52 WeakPolarHBondContact OD1-CG 3.01Å; N49-E52 PolarHBondContact OD1-N 2.96Å; E52-K54 VanDerWaalsContact C-N 3.34Å; E52-N55 PolarHBondContact O-N 3.36Å; E52-I56 WeakPolarHBondContact O-CG1 3.03Å; E52-I56 PolarHBondContact O-N 3Å |
| 53 | L | 85.6 | Confident | 80.1 | Confident | 16 Ų | 16 | 65 Ų | 65 | 8% | 0.084 | 32% | 0.319 | C | S | . | . | H | α-helix | trans | -63.7 | -40.8 | 175.4 | -176.6 | 57.9 | 0 | 0 | 0 | 111.9 | P47 N49 V50 D51 I56 G57 V92 I95 L96 L209 | P47-L53 HydrophobicContact CB-CB 4.01Å; P47-L53 HydrophobicContact CG-CB 4.38Å; P47-L53 HydrophobicContact CG-CD1 4.04Å; N49-L53 PolarHBondContact O-N 3.48Å; V50-L53 PolarHBondContact O-N 3.43Å; D51-L53 VanDerWaalsContact C-N 3.33Å; L53-I56 PolarHBondContact O-N 3.22Å; L53-G57 PolarHBondContact O-N 3.37Å; L53-V92 HydrophobicContact CD1-CG1 3.83Å; L53-I95 HydrophobicContact CD2-CB 4.2Å; L53-I95 HydrophobicContact CD2-CD1 4.08Å; L53-I95 HydrophobicContact CD2-CG2 3.69Å; L53-I95 HydrophobicContact CG-CG2 4.5Å; L53-L96 HydrophobicContact CD1-CD2 3.76Å; L53-L96 HydrophobicContact CD1-CG 3.92Å; L53-L209 HydrophobicContact CD2-CD2 4.27Å; L53-L209 HydrophobicContact CG-CD2 4.1Å |
| 54 | K | 86.3 | Confident | 81.2 | Confident | 60 Ų | 60 | 62.3 Ų | 62.3 | 26% | 0.261 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -60.3 | -45.2 | 174.3 | -176.7 | 177.7 | 173.3 | 172.7 | 0 | 111.2 | V50 D51 E52 I56 G57 L58 L209 T213 | V50-K54 WeakPolarHBondContact O-CB 3.43Å; V50-K54 PolarHBondContact O-N 3.44Å; D51-K54 WeakPolarHBondContact O-CB 3.25Å; D51-K54 PolarHBondContact O-N 2.64Å; E52-K54 VanDerWaalsContact C-N 3.34Å; K54-I56 PolarHBondContact O-N 3.1Å; K54-G57 PolarHBondContact O-N 3.37Å; K54-L58 HydrophobicContact CG-CD1 4.39Å; K54-L58 WeakPolarHBondContact O-CB 3.46Å; K54-L58 PolarHBondContact O-N 3.08Å; K54-L209 HydrophobicContact CB-CD1 4.21Å; K54-L209 HydrophobicContact CG-CD1 4.44Å; K54-T213 WeakPolarHBondContact CE-OG1 3.23Å; K54-T213 WeakPolarHBondContact CG-OG1 3.37Å |
| 55 | N | 85.5 | Confident | 82.3 | Confident | 58 Ų | 58 | 64.5 Ų | 64.5 | 31% | 0.31 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -63 | -41.3 | 177.4 | -71 | -31.1 | 0 | 0 | 0 | 112.1 | D51 E52 L58 V59 | D51-N55 VanDerWaalsContact O-CG 3.25Å; D51-N55 PolarHBondContact O-N 3.32Å; D51-N55 PolarHBondContact O-ND2 3.45Å; E52-N55 PolarHBondContact O-N 3.36Å; N55-L58 PolarHBondContact O-N 3.08Å; N55-V59 VanDerWaalsContact O-CG2 3.31Å; N55-V59 WeakPolarHBondContact O-CG2 3.2Å; N55-V59 PolarHBondContact O-N 3.41Å |
| 56 | I | 85.1 | Confident | 83 | Confident | 12 Ų | 12 | 63.4 Ų | 63.4 | 6% | 0.062 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -62.3 | -45.4 | 173.2 | -65.7 | 167.3 | 0 | 0 | 0 | 110.2 | H43 K45 P47 E52 L53 K54 L58 V59 L60 L96 | H43-I56 WeakPolarHBondContact O-CG1 3.37Å; K45-I56 WeakPolarHBondContact O-CD1 3.32Å; P47-I56 HydrophobicContact CB-CD1 3.96Å; P47-I56 HydrophobicContact CG-CD1 3.95Å; E52-I56 WeakPolarHBondContact O-CG1 3.03Å; E52-I56 PolarHBondContact O-N 3Å; L53-I56 PolarHBondContact O-N 3.22Å; K54-I56 PolarHBondContact O-N 3.1Å; I56-L58 PolarHBondContact O-N 3.47Å; I56-V59 PolarHBondContact O-N 3.47Å; I56-L60 HydrophobicContact CG2-CD1 3.68Å; I56-L60 HydrophobicContact CG2-CG 4.22Å; I56-L60 WeakPolarHBondContact O-CB 3.15Å; I56-L60 VanDerWaalsContact O-CG 3.23Å; I56-L60 WeakPolarHBondContact O-CG 3.07Å; I56-L60 PolarHBondContact O-N 3.33Å; I56-L96 HydrophobicContact CB-CD2 4.48Å; I56-L96 HydrophobicContact CG2-CD1 4.03Å; I56-L96 HydrophobicContact CG2-CD2 3.91Å |
| 57 | G | 85.8 | Confident | 83.6 | Confident | 0 Ų | 0 | 61.8 Ų | 61.8 | 0% | 0 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -57.8 | -46.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | L53 K54 L60 S61 Y99 | L53-G57 PolarHBondContact O-N 3.37Å; K54-G57 PolarHBondContact O-N 3.37Å; G57-L60 PolarHBondContact O-N 2.95Å; G57-S61 VanDerWaalsContact O-CB 3.31Å; G57-S61 WeakPolarHBondContact O-CB 3.41Å; G57-S61 PolarHBondContact O-N 3.47Å; G57-Y99 VanDerWaalsContact O-CE1 3.31Å; G57-Y99 WeakPolarHBondContact O-CE1 3.41Å |
| 58 | L | 85.4 | Confident | 84.1 | Confident | 70 Ų | 70 | 64.4 Ų | 64.4 | 37% | 0.366 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -55.9 | -55 | 175.5 | -86.3 | 169.3 | 0 | 0 | 0 | 112.3 | K54 N55 I56 L60 S61 E62 T213 | K54-L58 HydrophobicContact CG-CD1 4.39Å; K54-L58 WeakPolarHBondContact O-CB 3.46Å; K54-L58 PolarHBondContact O-N 3.08Å; N55-L58 PolarHBondContact O-N 3.08Å; I56-L58 PolarHBondContact O-N 3.47Å; L58-L60 VanDerWaalsContact C-N 3.31Å; L58-L60 PolarHBondContact O-N 3.41Å; L58-S61 WeakPolarHBondContact O-CB 3.46Å; L58-S61 PolarHBondContact O-N 2.86Å; L58-S61 VanDerWaalsContact O-N 3.15Å; L58-E62 PolarHBondContact O-N 3.32Å; L58-E62 VanDerWaalsContact O-N 3.11Å; L58-T213 HydrophobicContact CD1-CG2 3.98Å; L58-T213 HydrophobicContact CD2-CG2 3.19Å; L58-T213 HydrophobicContact CG-CG2 3.55Å |
| 59 | V | 84.7 | Confident | 84.5 | Confident | 7 Ų | 7 | 65.2 Ų | 65.2 | 4% | 0.042 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -60.3 | -44.1 | -179.9 | 173.3 | 0 | 0 | 0 | 0 | 110.4 | L36 H40 F44 N55 I56 S61 Y63 | L36-V59 HydrophobicContact CD2-CG1 3.62Å; H40-V59 HydrophobicContact CB-CG1 3.89Å; H40-V59 HydrophobicContact CB-CG2 3.85Å; F44-V59 HydrophobicContact CE2-CG1 3.97Å; F44-V59 HydrophobicContact CZ-CG1 4.36Å; N55-V59 VanDerWaalsContact O-CG2 3.31Å; N55-V59 WeakPolarHBondContact O-CG2 3.2Å; N55-V59 PolarHBondContact O-N 3.41Å; I56-V59 PolarHBondContact O-N 3.47Å; V59-S61 VanDerWaalsContact C-N 3.31Å; V59-S61 PolarHBondContact O-N 3.27Å; V59-Y63 HydrophobicContact CG1-CD2 4.41Å; V59-Y63 WeakPolarHBondContact O-CD2 3.18Å; V59-Y63 PolarHBondContact O-N 2.93Å |
| 60 | L | 84.9 | Confident | 84.8 | Confident | 8 Ų | 8 | 65.7 Ų | 65.7 | 4% | 0.042 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -67.7 | -31.8 | 179.1 | -68.8 | 176.6 | 0 | 0 | 0 | 112.7 | F44 I56 G57 L58 Y63 Q64 I71 I75 L96 L100 | F44-L60 HydrophobicContact CE1-CD2 4.19Å; F44-L60 HydrophobicContact CZ-CD2 3.94Å; I56-L60 HydrophobicContact CG2-CD1 3.68Å; I56-L60 HydrophobicContact CG2-CG 4.22Å; I56-L60 WeakPolarHBondContact O-CB 3.15Å; I56-L60 VanDerWaalsContact O-CG 3.23Å; I56-L60 WeakPolarHBondContact O-CG 3.07Å; I56-L60 PolarHBondContact O-N 3.33Å; G57-L60 PolarHBondContact O-N 2.95Å; L58-L60 VanDerWaalsContact C-N 3.31Å; L58-L60 PolarHBondContact O-N 3.41Å; L60-Y63 PolarHBondContact O-N 3.13Å; L60-Q64 WeakPolarHBondContact O-CB 3.34Å; L60-Q64 PolarHBondContact O-N 3.35Å; L60-I71 HydrophobicContact CD2-CD1 4.04Å; L60-I71 HydrophobicContact CD2-CG2 4.49Å; L60-I75 HydrophobicContact CD1-CD1 4.25Å; L60-L96 HydrophobicContact CD1-CD1 4.21Å; L60-L96 HydrophobicContact CD1-CD2 4.27Å; L60-L100 HydrophobicContact CB-CD1 3.81Å; L60-L100 HydrophobicContact CB-CD2 3.84Å; L60-L100 HydrophobicContact CB-CG 4.45Å; L60-L100 HydrophobicContact CD1-CD1 4.02Å |
| 61 | S | 84.8 | Confident | 85.1 | Confident | 36 Ų | 36 | 61.2 Ų | 61.2 | 25% | 0.252 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -67.2 | -44.1 | 177.9 | -165.9 | 0 | 0 | 0 | 0 | 111.6 | G57 L58 V59 Y63 Q64 | G57-S61 VanDerWaalsContact O-CB 3.31Å; G57-S61 WeakPolarHBondContact O-CB 3.41Å; G57-S61 PolarHBondContact O-N 3.47Å; L58-S61 WeakPolarHBondContact O-CB 3.46Å; L58-S61 PolarHBondContact O-N 2.86Å; L58-S61 VanDerWaalsContact O-N 3.15Å; V59-S61 VanDerWaalsContact C-N 3.31Å; V59-S61 PolarHBondContact O-N 3.27Å; S61-Y63 PolarHBondContact O-N 3.45Å; S61-Q64 WeakPolarHBondContact O-CB 3.43Å; S61-Q64 PolarHBondContact O-N 3.37Å; S61-Q64 VanDerWaalsContact O-N 3.09Å |
| 62 | E | 82.9 | Confident | 85.5 | Confident | 114 Ų | 114 | 56.9 Ų | 56.9 | 53% | 0.533 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -60.4 | -35.6 | 175.1 | -173.1 | -179.3 | 177.8 | 0 | 0 | 111.6 | L58 | L58-E62 PolarHBondContact O-N 3.32Å; L58-E62 VanDerWaalsContact O-N 3.11Å |
| 63 | Y | 79 | Confident | 85.9 | Confident | 29 Ų | 29 | 58 Ų | 58 | 11% | 0.114 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -73.7 | -32.3 | 175.4 | -88.6 | -103 | 0 | 0 | 0 | 113.5 | P34 S35 L36 P37 V59 L60 S61 D65 N66 Y67 | P34-Y63 HydrophobicContact CG-CD1 4.45Å; P34-Y63 HydrophobicContact CG-CE1 4.1Å; S35-Y63 PolarHBondContact O-OH 3.42Å; S35-Y63 VanDerWaalsContact O-OH 3.06Å; L36-Y63 WeakPolarHBondContact CA-OH 3.41Å; L36-Y63 HydrophobicContact CD2-CD1 4.47Å; L36-Y63 HydrophobicContact CD2-CD2 3.96Å; L36-Y63 HydrophobicContact CD2-CE1 4.02Å; L36-Y63 HydrophobicContact CD2-CE2 3.47Å; L36-Y63 VanDerWaalsContact CD2-CE2 3.47Å; L36-Y63 HydrophobicContact CD2-CG 4.45Å; L36-Y63 HydrophobicContact CG-CE1 4.45Å; P37-Y63 WeakPolarHBondContact CD-OH 3.41Å; V59-Y63 HydrophobicContact CG1-CD2 4.41Å; V59-Y63 WeakPolarHBondContact O-CD2 3.18Å; V59-Y63 PolarHBondContact O-N 2.93Å; L60-Y63 PolarHBondContact O-N 3.13Å; S61-Y63 PolarHBondContact O-N 3.45Å; Y63-D65 VanDerWaalsContact C-N 3.26Å; Y63-D65 PolarHBondContact O-N 3.29Å; Y63-N66 PolarHBondContact O-N 2.94Å; Y63-Y67 HydrophobicContact CD1-CD2 4.3Å; Y63-Y67 WeakPolarHBondContact O-CB 3.35Å; Y63-Y67 PolarHBondContact O-N 3.34Å |
| 64 | Q | 81.5 | Confident | 86.2 | Confident | 19 Ų | 19 | 57.9 Ų | 57.9 | 9% | 0.089 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -63.7 | -32.4 | -174.1 | -172.7 | -179.1 | -0.1 | 0 | 0 | 112.2 | L60 S61 N66 Y67 Y68 L100 | L60-Q64 WeakPolarHBondContact O-CB 3.34Å; L60-Q64 PolarHBondContact O-N 3.35Å; S61-Q64 WeakPolarHBondContact O-CB 3.43Å; S61-Q64 PolarHBondContact O-N 3.37Å; S61-Q64 VanDerWaalsContact O-N 3.09Å; Q64-N66 PolarHBondContact O-N 3.47Å; Q64-Y67 PolarHBondContact O-N 3.39Å; Q64-Y68 HydrophobicContact CG-CD2 3.87Å; Q64-Y68 WeakPolarHBondContact O-CA 3.41Å; Q64-Y68 PolarHBondContact O-N 2.96Å; Q64-L100 PolarHBondContact NE2-O 3.43Å; Q64-L100 PolarHBondContact OE1-O 3.39Å |
| 65 | D | 80.4 | Confident | 86.5 | Confident | 141 Ų | 141 | 55.3 Ų | 55.3 | 75% | 0.754 | 27% | 0.265 | S | S | * | . | H | α-helix | trans | -56.7 | -37.5 | 178.5 | -73.5 | -16.9 | 0 | 0 | 0 | 112.4 | Y63 | Y63-D65 VanDerWaalsContact C-N 3.26Å; Y63-D65 PolarHBondContact O-N 3.29Å |
| 66 | N | 82.5 | Confident | 87 | Confident | 126 Ų | 126 | 53.5 Ų | 53.5 | 67% | 0.674 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -100.6 | -22.1 | -179.9 | -66.1 | -63.2 | 0 | 0 | 0 | 113.2 | Y63 Q64 | Y63-N66 PolarHBondContact O-N 2.94Å; Q64-N66 PolarHBondContact O-N 3.47Å |
| 67 | Y | 85.9 | Confident | 87.5 | Confident | 82 Ų | 82 | 53.7 Ų | 53.7 | 32% | 0.322 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -136.1 | 36.9 | -167.1 | -58 | -73.1 | 0 | 0 | 0 | 113.9 | P34 Y63 Q64 W69 Q70 I71 | P34-Y67 HydrophobicContact CB-CE2 4.33Å; P34-Y67 HydrophobicContact CG-CD1 4.19Å; P34-Y67 HydrophobicContact CG-CD2 3.74Å; P34-Y67 HydrophobicContact CG-CE1 3.87Å; P34-Y67 HydrophobicContact CG-CE2 3.38Å; P34-Y67 HydrophobicContact CG-CG 4.14Å; P34-Y67 VanDerWaalsContact CG-CZ 3.47Å; Y63-Y67 HydrophobicContact CD1-CD2 4.3Å; Y63-Y67 WeakPolarHBondContact O-CB 3.35Å; Y63-Y67 PolarHBondContact O-N 3.34Å; Q64-Y67 PolarHBondContact O-N 3.39Å; Y67-W69 VanDerWaalsContact C-N 3.34Å; Y67-W69 PolarHBondContact O-N 2.84Å; Y67-Q70 VanDerWaalsContact C-OE1 3.22Å; Y67-Q70 VanDerWaalsContact CA-OE1 3.3Å; Y67-Q70 HydrophobicContact CD1-CG 4.49Å; Y67-Q70 PolarHBondContact O-N 3.3Å; Y67-Q70 PolarHBondContact O-OE1 3.11Å; Y67-I71 WeakPolarHBondContact O-CG1 3.2Å; Y67-I71 PolarHBondContact O-N 3.42Å |
| 68 | Y | 89.2 | Confident | 87.9 | Confident | 72 Ų | 72 | 56.5 Ų | 56.5 | 28% | 0.282 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -43.8 | -53.1 | -177.8 | -178.9 | -86 | 0 | 0 | 0 | 113.8 | Q64 L72 F101 | Q64-Y68 HydrophobicContact CG-CD2 3.87Å; Q64-Y68 WeakPolarHBondContact O-CA 3.41Å; Q64-Y68 PolarHBondContact O-N 2.96Å; Y68-L72 HydrophobicContact CE1-CD2 4.44Å; Y68-L72 WeakPolarHBondContact O-CB 3.29Å; Y68-L72 PolarHBondContact O-N 2.68Å; Y68-L72 VanDerWaalsContact O-N 3.07Å; Y68-F101 HydrophobicContact CD1-CE1 4.39Å; Y68-F101 HydrophobicContact CD2-CD1 4.38Å; Y68-F101 AromaticContact CD2-CE1 3.94Å; Y68-F101 HydrophobicContact CD2-CE1 3.94Å; Y68-F101 HydrophobicContact CE1-CD1 4.34Å; Y68-F101 AromaticContact CE1-CE1 3.96Å; Y68-F101 HydrophobicContact CE1-CE1 3.96Å; Y68-F101 AromaticContact CE2-CD1 3.49Å; Y68-F101 HydrophobicContact CE2-CD1 3.49Å; Y68-F101 VanDerWaalsContact CE2-CD1 3.49Å; Y68-F101 AromaticContact CE2-CE1 3.47Å; Y68-F101 HydrophobicContact CE2-CE1 3.47Å; Y68-F101 VanDerWaalsContact CE2-CE1 3.47Å; Y68-F101 HydrophobicContact CG-CE1 4.38Å; Y68-F101 AromaticContact CZ-CD1 3.47Å; Y68-F101 VanDerWaalsContact CZ-CD1 3.47Å; Y68-F101 AromaticContact CZ-CE1 3.48Å; Y68-F101 VanDerWaalsContact CZ-CE1 3.48Å; Y68-F101 WeakPolarHBondContact OH-CD1 3.19Å |
| 69 | W | 90 | Very high | 88.4 | Confident | 173 Ų | 173 | 53.2 Ų | 53.2 | 66% | 0.655 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -70.4 | -34.9 | -176.6 | -66.8 | 111.2 | 0 | 0 | 0 | 112.7 | Y67 L72 I73 | Y67-W69 VanDerWaalsContact C-N 3.34Å; Y67-W69 PolarHBondContact O-N 2.84Å; W69-L72 HydrophobicContact CE3-CD2 3.96Å; W69-L72 HydrophobicContact CZ3-CD2 3.94Å; W69-L72 PolarHBondContact O-N 3.19Å; W69-I73 WeakPolarHBondContact O-CB 3.45Å; W69-I73 WeakPolarHBondContact O-CD1 3.36Å; W69-I73 VanDerWaalsContact O-CG1 3.22Å; W69-I73 WeakPolarHBondContact O-CG1 3.25Å; W69-I73 PolarHBondContact O-N 2.88Å |
| 70 | Q | 89.3 | Confident | 88.9 | Confident | 85 Ų | 85 | 54 Ų | 54 | 40% | 0.397 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -68.8 | -43.8 | 179.9 | -63.6 | 82.2 | -20.5 | 0 | 0 | 110.7 | Y67 I73 L74 | Y67-Q70 VanDerWaalsContact C-OE1 3.22Å; Y67-Q70 VanDerWaalsContact CA-OE1 3.3Å; Y67-Q70 HydrophobicContact CD1-CG 4.49Å; Y67-Q70 PolarHBondContact O-N 3.3Å; Y67-Q70 PolarHBondContact O-OE1 3.11Å; Q70-I73 PolarHBondContact O-N 3.28Å; Q70-L74 VanDerWaalsContact O-CB 3.29Å; Q70-L74 WeakPolarHBondContact O-CB 3.42Å; Q70-L74 PolarHBondContact O-N 2.97Å |
| 71 | I | 89.7 | Confident | 89.4 | Confident | 1 Ų | 1 | 54.7 Ų | 54.7 | 1% | 0.005 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -62.6 | -44.8 | 174.6 | -61.3 | -51.9 | 0 | 0 | 0 | 110.3 | L33 L60 Y67 I73 L74 I75 L100 F101 | L33-I71 HydrophobicContact CD2-CD1 3.61Å; L60-I71 HydrophobicContact CD2-CD1 4.04Å; L60-I71 HydrophobicContact CD2-CG2 4.49Å; Y67-I71 WeakPolarHBondContact O-CG1 3.2Å; Y67-I71 PolarHBondContact O-N 3.42Å; I71-I73 PolarHBondContact O-N 3.38Å; I71-L74 PolarHBondContact O-N 2.83Å; I71-I75 HydrophobicContact CG2-CD1 3.71Å; I71-I75 HydrophobicContact CG2-CG1 4.36Å; I71-I75 WeakPolarHBondContact O-CG1 3.25Å; I71-I75 PolarHBondContact O-N 3.14Å; I71-L100 HydrophobicContact CG2-CD1 4Å; I71-F101 HydrophobicContact CG2-CZ 4.5Å |
| 72 | L | 92.8 | Very high | 89.9 | Confident | 19 Ų | 19 | 54.2 Ų | 54.2 | 10% | 0.099 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -59.2 | -49 | 177.1 | 178.2 | 56.2 | 0 | 0 | 0 | 112.2 | Y68 W69 L74 S76 L97 F101 I109 | Y68-L72 HydrophobicContact CE1-CD2 4.44Å; Y68-L72 WeakPolarHBondContact O-CB 3.29Å; Y68-L72 PolarHBondContact O-N 2.68Å; Y68-L72 VanDerWaalsContact O-N 3.07Å; W69-L72 HydrophobicContact CE3-CD2 3.96Å; W69-L72 HydrophobicContact CZ3-CD2 3.94Å; W69-L72 PolarHBondContact O-N 3.19Å; L72-L74 VanDerWaalsContact C-N 3.34Å; L72-L74 PolarHBondContact O-N 3.25Å; L72-S76 WeakPolarHBondContact O-CB 3.47Å; L72-S76 PolarHBondContact O-N 3.34Å; L72-S76 PolarHBondContact O-OG 3.31Å; L72-L97 HydrophobicContact CD1-CD2 4.05Å; L72-F101 HydrophobicContact CB-CE1 3.94Å; L72-F101 HydrophobicContact CB-CZ 3.63Å; L72-F101 HydrophobicContact CD1-CE1 4.24Å; L72-F101 HydrophobicContact CD1-CE2 4.19Å; L72-F101 HydrophobicContact CD1-CZ 3.96Å; L72-F101 HydrophobicContact CG-CE1 4.45Å; L72-F101 HydrophobicContact CG-CZ 4.32Å; L72-I109 HydrophobicContact CD1-CD1 3.41Å; L72-I109 VanDerWaalsContact CD1-CD1 3.41Å; L72-I109 HydrophobicContact CD1-CG1 4.07Å; L72-I109 HydrophobicContact CD1-CG2 3.9Å; L72-I109 HydrophobicContact CD2-CD1 4.14Å; L72-I109 HydrophobicContact CG-CD1 4.43Å |
| 73 | I | 92.6 | Very high | 90.5 | Very high | 90 Ų | 90 | 49.7 Ų | 49.7 | 46% | 0.462 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -62.6 | -41.8 | 178.4 | -72.8 | 163.5 | 0 | 0 | 0 | 110.5 | I29 W69 Q70 I71 T77 | I29-I73 HydrophobicContact CD1-CG2 4.16Å; W69-I73 WeakPolarHBondContact O-CB 3.45Å; W69-I73 WeakPolarHBondContact O-CD1 3.36Å; W69-I73 VanDerWaalsContact O-CG1 3.22Å; W69-I73 WeakPolarHBondContact O-CG1 3.25Å; W69-I73 PolarHBondContact O-N 2.88Å; Q70-I73 PolarHBondContact O-N 3.28Å; I71-I73 PolarHBondContact O-N 3.38Å; I73-T77 VanDerWaalsContact O-CB 3.24Å; I73-T77 WeakPolarHBondContact O-CB 3.33Å; I73-T77 PolarHBondContact O-N 2.82Å; I73-T77 PolarHBondContact O-OG1 3.11Å |
| 74 | L | 91.9 | Very high | 91.2 | Very high | 13 Ų | 13 | 48.5 Ų | 48.5 | 7% | 0.068 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -60.5 | -55.8 | 178.4 | 175.7 | 68.6 | 0 | 0 | 0 | 111.2 | I29 T30 L33 Q70 I71 L72 S76 T77 I78 | I29-L74 HydrophobicContact CG2-CB 4.16Å; I29-L74 HydrophobicContact CG2-CD1 3.87Å; T30-L74 HydrophobicContact CG2-CD1 3.67Å; L33-L74 HydrophobicContact CD1-CB 4.41Å; L33-L74 HydrophobicContact CD1-CD1 4.1Å; L33-L74 HydrophobicContact CD1-CD2 3.76Å; L33-L74 HydrophobicContact CD1-CG 4.3Å; L33-L74 HydrophobicContact CD2-CD2 4.09Å; Q70-L74 VanDerWaalsContact O-CB 3.29Å; Q70-L74 WeakPolarHBondContact O-CB 3.42Å; Q70-L74 PolarHBondContact O-N 2.97Å; I71-L74 PolarHBondContact O-N 2.83Å; L72-L74 VanDerWaalsContact C-N 3.34Å; L72-L74 PolarHBondContact O-N 3.25Å; L74-S76 VanDerWaalsContact C-N 3.33Å; L74-S76 PolarHBondContact O-N 3.02Å; L74-T77 PolarHBondContact O-N 2.69Å; L74-I78 HydrophobicContact CD1-CD1 3.92Å; L74-I78 HydrophobicContact CD1-CG1 4.42Å; L74-I78 HydrophobicContact CG-CD1 3.99Å; L74-I78 WeakPolarHBondContact O-CG1 3.34Å; L74-I78 PolarHBondContact O-N 3.02Å |
| 75 | I | 93 | Very high | 91.8 | Very high | 7 Ų | 7 | 49.4 Ų | 49.4 | 4% | 0.036 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -63.3 | -42.4 | -177.6 | -62.4 | 170.9 | 0 | 0 | 0 | 110.4 | L60 I71 T77 I78 F79 C93 L96 L97 L100 | L60-I75 HydrophobicContact CD1-CD1 4.25Å; I71-I75 HydrophobicContact CG2-CD1 3.71Å; I71-I75 HydrophobicContact CG2-CG1 4.36Å; I71-I75 WeakPolarHBondContact O-CG1 3.25Å; I71-I75 PolarHBondContact O-N 3.14Å; I75-T77 VanDerWaalsContact C-N 3.34Å; I75-T77 PolarHBondContact O-N 3.04Å; I75-I78 PolarHBondContact O-N 3.35Å; I75-F79 VanDerWaalsContact O-CB 3.32Å; I75-F79 WeakPolarHBondContact O-CB 3.33Å; I75-F79 PolarHBondContact O-N 3.14Å; I75-C93 HydrophobicContact CG2-CB 3.96Å; I75-L96 HydrophobicContact CD1-CB 4.42Å; I75-L97 HydrophobicContact CB-CD2 4.34Å; I75-L97 HydrophobicContact CG2-CD1 4.24Å; I75-L97 HydrophobicContact CG2-CD2 3.9Å; I75-L97 HydrophobicContact CG2-CG 3.78Å; I75-L100 HydrophobicContact CD1-CD1 3.47Å; I75-L100 VanDerWaalsContact CD1-CD1 3.47Å |
| 76 | S | 95.8 | Very high | 92.3 | Very high | 19 Ų | 19 | 46.1 Ų | 46.1 | 13% | 0.133 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -62.1 | -41.8 | 177.4 | -59.6 | 0 | 0 | 0 | 0 | 111.7 | L72 L74 F79 I80 C113 | L72-S76 WeakPolarHBondContact O-CB 3.47Å; L72-S76 PolarHBondContact O-N 3.34Å; L72-S76 PolarHBondContact O-OG 3.31Å; L74-S76 VanDerWaalsContact C-N 3.33Å; L74-S76 PolarHBondContact O-N 3.02Å; S76-F79 WeakPolarHBondContact O-CB 3.23Å; S76-F79 PolarHBondContact O-N 2.85Å; S76-I80 WeakPolarHBondContact O-CB 3.37Å; S76-I80 VanDerWaalsContact O-CG1 3.24Å; S76-I80 WeakPolarHBondContact O-CG1 3.33Å; S76-I80 PolarHBondContact O-N 2.88Å; S76-C113 VanDerWaalsContact CB-SG 3.59Å |
| 77 | T | 94.4 | Very high | 92.8 | Very high | 17 Ų | 17 | 42.8 Ų | 42.8 | 10% | 0.104 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -67.5 | -43.7 | 178.8 | -54.4 | 0 | 0 | 0 | 0 | 110.9 | F22 L25 L26 I29 I73 L74 I75 F79 I80 F81 | F22-T77 HydrophobicContact CD1-CG2 4.34Å; F22-T77 HydrophobicContact CE1-CG2 3.55Å; F22-T77 WeakPolarHBondContact CE1-O 3.45Å; F22-T77 HydrophobicContact CZ-CG2 4.25Å; L25-T77 HydrophobicContact CD2-CG2 4.18Å; L25-T77 HydrophobicContact CG-CG2 4.46Å; L26-T77 HydrophobicContact CD2-CG2 3.57Å; L26-T77 HydrophobicContact CG-CG2 4.13Å; I29-T77 HydrophobicContact CD1-CG2 3.81Å; I73-T77 VanDerWaalsContact O-CB 3.24Å; I73-T77 WeakPolarHBondContact O-CB 3.33Å; I73-T77 PolarHBondContact O-N 2.82Å; I73-T77 PolarHBondContact O-OG1 3.11Å; L74-T77 PolarHBondContact O-N 2.69Å; I75-T77 VanDerWaalsContact C-N 3.34Å; I75-T77 PolarHBondContact O-N 3.04Å; T77-F79 VanDerWaalsContact C-N 3.34Å; T77-F79 PolarHBondContact O-N 3.01Å; T77-I80 PolarHBondContact O-N 3.43Å; T77-F81 WeakPolarHBondContact O-CB 3.34Å; T77-F81 PolarHBondContact O-N 3.39Å |
| 78 | I | 94.1 | Very high | 92.9 | Very high | 59 Ų | 59 | 44.4 Ų | 44.4 | 30% | 0.303 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -60.3 | -45.9 | 174.4 | -67.4 | 169.5 | 0 | 0 | 0 | 110.1 | L26 L74 I75 I80 F81 L82 | L26-I78 HydrophobicContact CD2-CB 4.4Å; L26-I78 HydrophobicContact CD2-CG1 3.54Å; L74-I78 HydrophobicContact CD1-CD1 3.92Å; L74-I78 HydrophobicContact CD1-CG1 4.42Å; L74-I78 HydrophobicContact CG-CD1 3.99Å; L74-I78 WeakPolarHBondContact O-CG1 3.34Å; L74-I78 PolarHBondContact O-N 3.02Å; I75-I78 PolarHBondContact O-N 3.35Å; I78-I80 PolarHBondContact O-N 2.83Å; I78-F81 WeakPolarHBondContact O-CB 3.37Å; I78-F81 PolarHBondContact O-N 2.89Å; I78-L82 HydrophobicContact CG2-CD1 3.95Å; I78-L82 HydrophobicContact CG2-CG 4.29Å; I78-L82 VanDerWaalsContact O-CG 3.28Å; I78-L82 WeakPolarHBondContact O-CG 3.45Å; I78-L82 PolarHBondContact O-N 3.24Å |
| 79 | F | 96 | Very high | 92.7 | Very high | 1 Ų | 1 | 41.6 Ų | 41.6 | 0% | 0.004 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -56.1 | -55.4 | 177.2 | -168 | 142.9 | 0 | 0 | 0 | 110.7 | I75 S76 T77 F81 L82 Q83 C93 V94 L97 V110 C113 S114 | I75-F79 VanDerWaalsContact O-CB 3.32Å; I75-F79 WeakPolarHBondContact O-CB 3.33Å; I75-F79 PolarHBondContact O-N 3.14Å; S76-F79 WeakPolarHBondContact O-CB 3.23Å; S76-F79 PolarHBondContact O-N 2.85Å; T77-F79 VanDerWaalsContact C-N 3.34Å; T77-F79 PolarHBondContact O-N 3.01Å; F79-F81 VanDerWaalsContact C-N 3.26Å; F79-F81 PolarHBondContact O-N 3.15Å; F79-L82 PolarHBondContact O-N 3Å; F79-L82 VanDerWaalsContact O-N 3.16Å; F79-Q83 HydrophobicContact CD2-CG 3.56Å; F79-Q83 HydrophobicContact CE2-CG 3.46Å; F79-Q83 VanDerWaalsContact CE2-CG 3.46Å; F79-Q83 PolarHBondContact O-N 3.36Å; F79-C93 HydrophobicContact CB-CB 4.03Å; F79-C93 HydrophobicContact CD1-CB 3.69Å; F79-C93 HydrophobicContact CE1-CB 4.48Å; F79-C93 HydrophobicContact CG-CB 4.11Å; F79-V94 HydrophobicContact CE1-CG2 3.5Å; F79-V94 HydrophobicContact CZ-CG2 3.78Å; F79-L97 HydrophobicContact CD1-CD1 4.11Å; F79-L97 HydrophobicContact CE1-CD1 4.41Å; F79-V110 HydrophobicContact CE1-CB 4.42Å; F79-V110 HydrophobicContact CE1-CG1 4.06Å; F79-V110 HydrophobicContact CE1-CG2 4.23Å; F79-V110 HydrophobicContact CZ-CG1 4.15Å; F79-C113 HydrophobicContact CB-CB 4.38Å; F79-C113 HydrophobicContact CD1-CB 4.16Å; F79-C113 HydrophobicContact CD2-CB 4.06Å; F79-C113 HydrophobicContact CE1-CB 4.47Å; F79-C113 HydrophobicContact CE2-CB 4.41Å; F79-C113 HydrophobicContact CG-CB 3.97Å; F79-S114 WeakPolarHBondContact CE2-OG 3.37Å; F79-S114 VanDerWaalsContact CZ-OG 3.24Å; F79-S114 WeakPolarHBondContact CZ-OG 3.3Å |
| 80 | I | 96.8 | Very high | 92.9 | Very high | 23 Ų | 23 | 34.5 Ų | 34.5 | 12% | 0.118 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -58.8 | -41.2 | -178.5 | -68.5 | 166.4 | 0 | 0 | 0 | 110.1 | F22 S76 T77 I78 Q83 S84 C113 I116 L120 | F22-I80 HydrophobicContact CE2-CG2 3.99Å; F22-I80 HydrophobicContact CZ-CB 4.04Å; F22-I80 HydrophobicContact CZ-CG2 3.56Å; S76-I80 WeakPolarHBondContact O-CB 3.37Å; S76-I80 VanDerWaalsContact O-CG1 3.24Å; S76-I80 WeakPolarHBondContact O-CG1 3.33Å; S76-I80 PolarHBondContact O-N 2.88Å; T77-I80 PolarHBondContact O-N 3.43Å; I78-I80 PolarHBondContact O-N 2.83Å; I80-Q83 PolarHBondContact O-N 3.27Å; I80-S84 VanDerWaalsContact O-CB 3.26Å; I80-S84 WeakPolarHBondContact O-CB 3.46Å; I80-S84 PolarHBondContact O-N 3.32Å; I80-S84 PolarHBondContact O-OG 2.96Å; I80-C113 HydrophobicContact CG1-CB 3.99Å; I80-I116 HydrophobicContact CD1-CB 4.37Å; I80-I116 HydrophobicContact CD1-CG2 4.03Å; I80-I116 HydrophobicContact CG1-CG2 4.38Å; I80-I116 HydrophobicContact CG2-CG2 4.09Å; I80-L120 HydrophobicContact CG2-CD1 3.62Å |
| 81 | F | 95.5 | Very high | 93 | Very high | 23 Ų | 23 | 33.2 Ų | 33.2 | 10% | 0.101 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -57.4 | -53.3 | 174.8 | 180 | -105.6 | 0 | 0 | 0 | 111.8 | F19 F22 L26 T77 I78 F79 Q83 S84 F85 I87 | F19-F81 HydrophobicContact CD2-CE2 4.05Å; F19-F81 AromaticContact CD2-CZ 3.99Å; F19-F81 HydrophobicContact CD2-CZ 3.99Å; F19-F81 HydrophobicContact CE2-CE1 4.35Å; F19-F81 AromaticContact CE2-CE2 3.98Å; F19-F81 HydrophobicContact CE2-CE2 3.98Å; F19-F81 AromaticContact CE2-CZ 3.43Å; F19-F81 HydrophobicContact CE2-CZ 3.43Å; F19-F81 VanDerWaalsContact CE2-CZ 3.43Å; F19-F81 HydrophobicContact CZ-CE2 4.48Å; F19-F81 AromaticContact CZ-CZ 3.74Å; F19-F81 HydrophobicContact CZ-CZ 3.74Å; F22-F81 HydrophobicContact CB-CD2 3.74Å; F22-F81 HydrophobicContact CB-CE2 4.03Å; F22-F81 HydrophobicContact CD1-CB 3.67Å; F22-F81 AromaticContact CD1-CD2 3.4Å; F22-F81 HydrophobicContact CD1-CD2 3.4Å; F22-F81 VanDerWaalsContact CD1-CD2 3.4Å; F22-F81 HydrophobicContact CD1-CE2 4.42Å; F22-F81 AromaticContact CD1-CG 3.97Å; F22-F81 HydrophobicContact CD1-CG 3.97Å; F22-F81 HydrophobicContact CE1-CB 3.57Å; F22-F81 HydrophobicContact CE1-CD2 4.2Å; F22-F81 HydrophobicContact CE1-CG 4.38Å; F22-F81 AromaticContact CG-CD2 3.72Å; F22-F81 HydrophobicContact CG-CD2 3.72Å; F22-F81 HydrophobicContact CG-CE2 4.49Å; F22-F81 HydrophobicContact CZ-CB 4.42Å; L26-F81 HydrophobicContact CD1-CB 3.85Å; L26-F81 HydrophobicContact CD1-CD1 3.79Å; L26-F81 HydrophobicContact CD1-CD2 3.97Å; L26-F81 HydrophobicContact CD1-CE1 4.29Å; L26-F81 HydrophobicContact CD1-CE2 4.44Å; L26-F81 HydrophobicContact CD1-CG 3.6Å; T77-F81 WeakPolarHBondContact O-CB 3.34Å; T77-F81 PolarHBondContact O-N 3.39Å; I78-F81 WeakPolarHBondContact O-CB 3.37Å; I78-F81 PolarHBondContact O-N 2.89Å; F79-F81 VanDerWaalsContact C-N 3.26Å; F79-F81 PolarHBondContact O-N 3.15Å; F81-Q83 VanDerWaalsContact C-N 3.31Å; F81-Q83 PolarHBondContact O-N 3.21Å; F81-S84 PolarHBondContact O-N 2.74Å; F81-F85 AromaticContact CD2-CD2 3.51Å; F81-F85 HydrophobicContact CD2-CD2 3.51Å; F81-F85 AromaticContact CD2-CE2 3.51Å; F81-F85 HydrophobicContact CD2-CE2 3.51Å; F81-F85 AromaticContact CE2-CD2 3.51Å; F81-F85 HydrophobicContact CE2-CD2 3.51Å; F81-F85 AromaticContact CE2-CE2 3.53Å; F81-F85 HydrophobicContact CE2-CE2 3.53Å; F81-F85 HydrophobicContact CG-CD2 4.17Å; F81-F85 HydrophobicContact CZ-CD2 4.15Å; F81-F85 VanDerWaalsContact O-CD2 3.29Å; F81-F85 WeakPolarHBondContact O-CD2 3.4Å; F81-F85 PolarHBondContact O-N 3.35Å; F81-F85 VanDerWaalsContact O-N 3.12Å; F81-I87 HydrophobicContact CD1-CD1 4.17Å; F81-I87 HydrophobicContact CE1-CD1 3.63Å; F81-I87 HydrophobicContact CZ-CD1 4.24Å |
| 82 | L | 94.8 | Very high | 93.2 | Very high | 25 Ų | 25 | 34.2 Ų | 34.2 | 13% | 0.131 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -57.8 | -44 | -179.8 | -66.6 | 173.5 | 0 | 0 | 0 | 111.3 | I78 F79 M86 I87 | I78-L82 HydrophobicContact CG2-CD1 3.95Å; I78-L82 HydrophobicContact CG2-CG 4.29Å; I78-L82 VanDerWaalsContact O-CG 3.28Å; I78-L82 WeakPolarHBondContact O-CG 3.45Å; I78-L82 PolarHBondContact O-N 3.24Å; F79-L82 PolarHBondContact O-N 3Å; F79-L82 VanDerWaalsContact O-N 3.16Å; L82-M86 CarbonylContact O-C 3.55Å; L82-M86 PolarHBondContact O-N 2.82Å; L82-I87 HydrophobicContact CB-CB 4.46Å; L82-I87 HydrophobicContact CD2-CB 3.65Å; L82-I87 HydrophobicContact CD2-CD1 4.34Å; L82-I87 HydrophobicContact CD2-CG2 3.52Å; L82-I87 PolarHBondContact O-N 3.46Å |
| 83 | Q | 95.2 | Very high | 93.3 | Very high | 20 Ų | 20 | 33.7 Ų | 33.7 | 9% | 0.093 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -67.8 | -40.9 | 177.6 | -70.4 | -69.6 | -14.3 | 0 | 0 | 113.1 | F79 I80 F81 F85 M86 S90 | F79-Q83 HydrophobicContact CD2-CG 3.56Å; F79-Q83 HydrophobicContact CE2-CG 3.46Å; F79-Q83 VanDerWaalsContact CE2-CG 3.46Å; F79-Q83 PolarHBondContact O-N 3.36Å; I80-Q83 PolarHBondContact O-N 3.27Å; F81-Q83 VanDerWaalsContact C-N 3.31Å; F81-Q83 PolarHBondContact O-N 3.21Å; Q83-F85 VanDerWaalsContact C-N 3.28Å; Q83-F85 PolarHBondContact O-N 3.5Å; Q83-M86 PolarHBondContact O-N 3.26Å; Q83-S90 PolarHBondContact NE2-OG 3.17Å |
| 84 | S | 94.6 | Very high | 93.5 | Very high | 4 Ų | 4 | 29.9 Ų | 29.9 | 3% | 0.028 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -62.4 | -38.2 | -178 | -59.7 | 0 | 0 | 0 | 0 | 111.8 | I80 F81 G117 L120 C121 | I80-S84 VanDerWaalsContact O-CB 3.26Å; I80-S84 WeakPolarHBondContact O-CB 3.46Å; I80-S84 PolarHBondContact O-N 3.32Å; I80-S84 PolarHBondContact O-OG 2.96Å; F81-S84 PolarHBondContact O-N 2.74Å; S84-G117 WeakPolarHBondContact CA-O 3.04Å; S84-L120 WeakPolarHBondContact OG-CB 3.31Å; S84-L120 WeakPolarHBondContact OG-CD1 3.25Å; S84-C121 WeakPolarHBondContact O-CA 3.44Å; S84-C121 WeakPolarHBondContact O-CB 3.38Å |
| 85 | F | 93.7 | Very high | 93.6 | Very high | 37 Ų | 37 | 30.5 Ų | 30.5 | 16% | 0.162 | 17% | 0.174 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -104.4 | 13.6 | -177.5 | -61.1 | -71.6 | 0 | 0 | 0 | 113.5 | F19 F22 F81 Q83 I87 L124 | F19-F85 HydrophobicContact CB-CD1 4.38Å; F19-F85 HydrophobicContact CB-CE1 3.74Å; F19-F85 HydrophobicContact CB-CZ 3.87Å; F19-F85 HydrophobicContact CD2-CB 4.46Å; F19-F85 AromaticContact CD2-CD1 3.71Å; F19-F85 HydrophobicContact CD2-CD1 3.71Å; F19-F85 AromaticContact CD2-CD2 3.93Å; F19-F85 HydrophobicContact CD2-CD2 3.93Å; F19-F85 AromaticContact CD2-CE1 3.88Å; F19-F85 HydrophobicContact CD2-CE1 3.88Å; F19-F85 HydrophobicContact CD2-CE2 4.12Å; F19-F85 AromaticContact CD2-CG 3.75Å; F19-F85 HydrophobicContact CD2-CG 3.75Å; F19-F85 HydrophobicContact CD2-CZ 4.11Å; F19-F85 HydrophobicContact CE2-CD2 4.45Å; F19-F85 HydrophobicContact CE2-CG 4.3Å; F19-F85 HydrophobicContact CG-CE1 4.32Å; F19-F85 HydrophobicContact CG-CZ 4.44Å; F22-F85 HydrophobicContact CB-CE2 4.07Å; F22-F85 HydrophobicContact CG-CE2 4.36Å; F81-F85 AromaticContact CD2-CD2 3.51Å; F81-F85 HydrophobicContact CD2-CD2 3.51Å; F81-F85 AromaticContact CD2-CE2 3.51Å; F81-F85 HydrophobicContact CD2-CE2 3.51Å; F81-F85 AromaticContact CE2-CD2 3.51Å; F81-F85 HydrophobicContact CE2-CD2 3.51Å; F81-F85 AromaticContact CE2-CE2 3.53Å; F81-F85 HydrophobicContact CE2-CE2 3.53Å; F81-F85 HydrophobicContact CG-CD2 4.17Å; F81-F85 HydrophobicContact CZ-CD2 4.15Å; F81-F85 VanDerWaalsContact O-CD2 3.29Å; F81-F85 WeakPolarHBondContact O-CD2 3.4Å; F81-F85 PolarHBondContact O-N 3.35Å; F81-F85 VanDerWaalsContact O-N 3.12Å; Q83-F85 VanDerWaalsContact C-N 3.28Å; Q83-F85 PolarHBondContact O-N 3.5Å; F85-I87 HydrophobicContact CB-CD1 3.9Å; F85-I87 HydrophobicContact CB-CG1 3.89Å; F85-I87 PolarHBondContact O-N 3.08Å; F85-L124 HydrophobicContact CD1-CD1 4.25Å; F85-L124 HydrophobicContact CE1-CD1 3.77Å; F85-L124 HydrophobicContact CZ-CD1 4.27Å |
| 86 | M | 91.3 | Very high | 93.7 | Very high | 72 Ų | 72 | 30.9 Ų | 30.9 | 36% | 0.355 | 18% | 0.176 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 55.3 | 31 | 177.9 | -55.7 | 159 | 52.3 | 0 | 0 | 114 | L82 Q83 C121 W171 I175 | L82-M86 CarbonylContact O-C 3.55Å; L82-M86 PolarHBondContact O-N 2.82Å; Q83-M86 PolarHBondContact O-N 3.26Å; M86-C121 VanDerWaalsContact CG-SG 3.59Å; M86-W171 HydrophobicContact CB-CB 4Å; M86-W171 HydrophobicContact CE-CB 3.55Å; M86-W171 HydrophobicContact CE-CD2 3.96Å; M86-W171 HydrophobicContact CE-CE3 3.7Å; M86-W171 HydrophobicContact CE-CG 3.95Å; M86-W171 HydrophobicContact CG-CB 3.76Å; M86-W171 HydrophobicContact SD-CB 4.27Å; M86-I175 HydrophobicContact CE-CD1 3.33Å; M86-I175 HydrophobicContact CE-CG1 4.11Å; M86-I175 HydrophobicContact SD-CD1 3.72Å; M86-I175 HydrophobicContact SD-CG1 3.96Å |
| 87 | I | 91.4 | Very high | 93.8 | Very high | 57 Ų | 57 | 30 Ų | 30 | 29% | 0.292 | 17% | 0.169 | S | C | . | . | trans | -82.1 | 127.8 | -177.9 | -55.3 | 172.7 | 0 | 0 | 0 | 108.6 | F19 F81 L82 F85 | F19-I87 HydrophobicContact CE2-CD1 4.41Å; F81-I87 HydrophobicContact CD1-CD1 4.17Å; F81-I87 HydrophobicContact CE1-CD1 3.63Å; F81-I87 HydrophobicContact CZ-CD1 4.24Å; L82-I87 HydrophobicContact CB-CB 4.46Å; L82-I87 HydrophobicContact CD2-CB 3.65Å; L82-I87 HydrophobicContact CD2-CD1 4.34Å; L82-I87 HydrophobicContact CD2-CG2 3.52Å; L82-I87 PolarHBondContact O-N 3.46Å; F85-I87 HydrophobicContact CB-CD1 3.9Å; F85-I87 HydrophobicContact CB-CG1 3.89Å; F85-I87 PolarHBondContact O-N 3.08Å | ||
| 88 | P | 87.8 | Confident | 93.8 | Very high | 115 Ų | 115 | 29.2 Ų | 29.2 | 75% | 0.747 | 17% | 0.165 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -64.2 | 146.1 | 175.8 | 27.6 | -34.3 | 0 | 0 | 0 | 110.9 | ||
| 89 | G | 86.9 | Confident | 93.8 | Very high | 13 Ų | 13 | 27 Ų | 27 | 13% | 0.134 | 15% | 0.153 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 123.7 | -6.1 | 177.2 | 0 | 0 | 0 | 0 | 0 | 115.5 | V91 V92 | G89-V91 PolarHBondContact O-N 3.44Å; G89-V91 VanDerWaalsContact O-N 3.11Å; G89-V92 WeakPolarHBondContact O-CB 3.48Å; G89-V92 PolarHBondContact O-N 3.24Å |
| 90 | S | 92.5 | Very high | 93.7 | Very high | 25 Ų | 25 | 27.5 Ų | 27.5 | 18% | 0.175 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -60.2 | -23.4 | 178.9 | 57.4 | 0 | 0 | 0 | 0 | 113.9 | Q83 V92 C93 V94 | Q83-S90 PolarHBondContact NE2-OG 3.17Å; S90-V92 PolarHBondContact O-N 2.97Å; S90-C93 WeakPolarHBondContact O-CB 3.27Å; S90-C93 PolarHBondContact O-N 2.99Å; S90-C93 VanDerWaalsContact O-N 3.09Å; S90-V94 PolarHBondContact O-N 3.24Å; S90-V94 VanDerWaalsContact O-N 3.16Å |
| 91 | V | 92.4 | Very high | 93.6 | Very high | 58 Ų | 58 | 26.8 Ų | 26.8 | 35% | 0.352 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -58.6 | -34 | 173.1 | 69.6 | 0 | 0 | 0 | 0 | 112.5 | G89 C93 V94 I95 F202 | G89-V91 PolarHBondContact O-N 3.44Å; G89-V91 VanDerWaalsContact O-N 3.11Å; V91-C93 VanDerWaalsContact C-N 3.32Å; V91-C93 PolarHBondContact O-N 3.44Å; V91-V94 WeakPolarHBondContact O-CB 3.21Å; V91-V94 PolarHBondContact O-N 3.32Å; V91-V94 VanDerWaalsContact O-N 3.15Å; V91-I95 HydrophobicContact CG2-CD1 4.28Å; V91-I95 WeakPolarHBondContact O-CG1 3.48Å; V91-I95 PolarHBondContact O-N 3.3Å; V91-F202 HydrophobicContact CG2-CD1 3.48Å; V91-F202 VanDerWaalsContact CG2-CD1 3.48Å; V91-F202 HydrophobicContact CG2-CD2 4.26Å; V91-F202 HydrophobicContact CG2-CE1 3.61Å; V91-F202 HydrophobicContact CG2-CE2 4.35Å; V91-F202 HydrophobicContact CG2-CG 3.83Å; V91-F202 HydrophobicContact CG2-CZ 4.05Å |
| 92 | V | 93.4 | Very high | 93.5 | Very high | 21 Ų | 21 | 29.3 Ų | 29.3 | 13% | 0.127 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -61.8 | -43.7 | 175.6 | 174 | 0 | 0 | 0 | 0 | 109.9 | F46 P47 L53 G89 S90 V94 I95 L96 | F46-V92 HydrophobicContact CE2-CG2 4.17Å; F46-V92 HydrophobicContact CZ-CG2 4.11Å; P47-V92 HydrophobicContact CG-CG1 3.69Å; P47-V92 HydrophobicContact CG-CG2 3.99Å; L53-V92 HydrophobicContact CD1-CG1 3.83Å; G89-V92 WeakPolarHBondContact O-CB 3.48Å; G89-V92 PolarHBondContact O-N 3.24Å; S90-V92 PolarHBondContact O-N 2.97Å; V92-V94 VanDerWaalsContact C-N 3.31Å; V92-V94 PolarHBondContact O-N 3.01Å; V92-I95 PolarHBondContact O-N 3.43Å; V92-L96 HydrophobicContact CG1-CD1 3.97Å; V92-L96 HydrophobicContact CG1-CG 4.38Å; V92-L96 WeakPolarHBondContact O-CB 3.23Å; V92-L96 WeakPolarHBondContact O-CG 3.48Å; V92-L96 PolarHBondContact O-N 2.87Å |
| 93 | C | 94.7 | Very high | 93.4 | Very high | 9 Ų | 9 | 31.4 Ų | 31.4 | 6% | 0.061 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -62 | -38.9 | 175.4 | -56.5 | 0 | 0 | 0 | 0 | 111.9 | I75 F79 S90 V91 L96 L97 | I75-C93 HydrophobicContact CG2-CB 3.96Å; F79-C93 HydrophobicContact CB-CB 4.03Å; F79-C93 HydrophobicContact CD1-CB 3.69Å; F79-C93 HydrophobicContact CE1-CB 4.48Å; F79-C93 HydrophobicContact CG-CB 4.11Å; S90-C93 WeakPolarHBondContact O-CB 3.27Å; S90-C93 PolarHBondContact O-N 2.99Å; S90-C93 VanDerWaalsContact O-N 3.09Å; V91-C93 VanDerWaalsContact C-N 3.32Å; V91-C93 PolarHBondContact O-N 3.44Å; C93-L96 PolarHBondContact O-N 3.07Å; C93-L97 WeakPolarHBondContact O-CB 3.01Å; C93-L97 WeakPolarHBondContact O-CG 3.23Å; C93-L97 PolarHBondContact O-N 3.39Å |
| 94 | V | 96.6 | Very high | 93.5 | Very high | 9 Ų | 9 | 34.6 Ų | 34.6 | 6% | 0.055 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -62.9 | -46 | 177.5 | -178.4 | 0 | 0 | 0 | 0 | 111.1 | F79 S90 V91 V92 L97 G98 V110 F202 I203 | F79-V94 HydrophobicContact CE1-CG2 3.5Å; F79-V94 HydrophobicContact CZ-CG2 3.78Å; S90-V94 PolarHBondContact O-N 3.24Å; S90-V94 VanDerWaalsContact O-N 3.16Å; V91-V94 WeakPolarHBondContact O-CB 3.21Å; V91-V94 PolarHBondContact O-N 3.32Å; V91-V94 VanDerWaalsContact O-N 3.15Å; V92-V94 VanDerWaalsContact C-N 3.31Å; V92-V94 PolarHBondContact O-N 3.01Å; V94-L97 PolarHBondContact O-N 3.29Å; V94-G98 PolarHBondContact O-N 3.49Å; V94-V110 HydrophobicContact CB-CG2 4.49Å; V94-V110 HydrophobicContact CG1-CG1 4.15Å; V94-V110 HydrophobicContact CG1-CG2 4.08Å; V94-V110 HydrophobicContact CG2-CG1 4.01Å; V94-V110 HydrophobicContact CG2-CG2 4.42Å; V94-F202 HydrophobicContact CB-CB 4.24Å; V94-F202 HydrophobicContact CG1-CB 3.58Å; V94-I203 HydrophobicContact CG1-CD1 4.5Å; V94-I203 HydrophobicContact CG1-CG1 3.64Å |
| 95 | I | 95.8 | Very high | 93.5 | Very high | 27 Ų | 27 | 37 Ų | 37 | 14% | 0.138 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -65.7 | -44.7 | 178.8 | -62.5 | 166.9 | 0 | 0 | 0 | 110.2 | L53 V91 V92 L97 G98 Y99 F202 G206 L209 | L53-I95 HydrophobicContact CD2-CB 4.2Å; L53-I95 HydrophobicContact CD2-CD1 4.08Å; L53-I95 HydrophobicContact CD2-CG2 3.69Å; L53-I95 HydrophobicContact CG-CG2 4.5Å; V91-I95 HydrophobicContact CG2-CD1 4.28Å; V91-I95 WeakPolarHBondContact O-CG1 3.48Å; V91-I95 PolarHBondContact O-N 3.3Å; V92-I95 PolarHBondContact O-N 3.43Å; I95-L97 VanDerWaalsContact C-N 3.32Å; I95-L97 PolarHBondContact O-N 3.49Å; I95-G98 CarbonylContact O-C 3.54Å; I95-G98 PolarHBondContact O-N 2.92Å; I95-G98 VanDerWaalsContact O-N 3.14Å; I95-Y99 WeakPolarHBondContact O-CB 3.45Å; I95-Y99 PolarHBondContact O-N 3.4Å; I95-F202 HydrophobicContact CG1-CB 4.2Å; I95-G206 WeakPolarHBondContact O-CA 3.25Å; I95-L209 HydrophobicContact CG2-CD2 4.5Å |
| 96 | L | 94.5 | Very high | 93.7 | Very high | 14 Ų | 14 | 35.2 Ų | 35.2 | 7% | 0.073 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -60.8 | -39.9 | 175.8 | -72.7 | 174.3 | 0 | 0 | 0 | 112.3 | L53 I56 L60 I75 V92 C93 G98 Y99 L100 | L53-L96 HydrophobicContact CD1-CD2 3.76Å; L53-L96 HydrophobicContact CD1-CG 3.92Å; I56-L96 HydrophobicContact CB-CD2 4.48Å; I56-L96 HydrophobicContact CG2-CD1 4.03Å; I56-L96 HydrophobicContact CG2-CD2 3.91Å; L60-L96 HydrophobicContact CD1-CD1 4.21Å; L60-L96 HydrophobicContact CD1-CD2 4.27Å; I75-L96 HydrophobicContact CD1-CB 4.42Å; V92-L96 HydrophobicContact CG1-CD1 3.97Å; V92-L96 HydrophobicContact CG1-CG 4.38Å; V92-L96 WeakPolarHBondContact O-CB 3.23Å; V92-L96 WeakPolarHBondContact O-CG 3.48Å; V92-L96 PolarHBondContact O-N 2.87Å; C93-L96 PolarHBondContact O-N 3.07Å; L96-G98 VanDerWaalsContact C-N 3.33Å; L96-G98 PolarHBondContact O-N 3.49Å; L96-Y99 WeakPolarHBondContact O-CB 3.41Å; L96-Y99 PolarHBondContact O-N 3.26Å; L96-L100 WeakPolarHBondContact O-CB 3.49Å; L96-L100 VanDerWaalsContact O-CG 3.28Å; L96-L100 WeakPolarHBondContact O-CG 3.28Å; L96-L100 PolarHBondContact O-N 3.03Å |
| 97 | L | 96.5 | Very high | 94 | Very high | 0 Ų | 0 | 32.9 Ų | 32.9 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -63.3 | -39.7 | 175 | -74.5 | 168.8 | 0 | 0 | 0 | 111.6 | L72 I75 F79 C93 V94 I95 Y99 F101 A106 I109 V110 | L72-L97 HydrophobicContact CD1-CD2 4.05Å; I75-L97 HydrophobicContact CB-CD2 4.34Å; I75-L97 HydrophobicContact CG2-CD1 4.24Å; I75-L97 HydrophobicContact CG2-CD2 3.9Å; I75-L97 HydrophobicContact CG2-CG 3.78Å; F79-L97 HydrophobicContact CD1-CD1 4.11Å; F79-L97 HydrophobicContact CE1-CD1 4.41Å; C93-L97 WeakPolarHBondContact O-CB 3.01Å; C93-L97 WeakPolarHBondContact O-CG 3.23Å; C93-L97 PolarHBondContact O-N 3.39Å; V94-L97 PolarHBondContact O-N 3.29Å; I95-L97 VanDerWaalsContact C-N 3.32Å; I95-L97 PolarHBondContact O-N 3.49Å; L97-Y99 VanDerWaalsContact C-N 3.34Å; L97-F101 HydrophobicContact CD2-CD2 3.69Å; L97-F101 HydrophobicContact CD2-CE2 3.7Å; L97-F101 WeakPolarHBondContact O-CB 3.27Å; L97-F101 WeakPolarHBondContact O-CD2 3.31Å; L97-F101 PolarHBondContact O-N 2.82Å; L97-A106 HydrophobicContact CB-CB 4.43Å; L97-A106 WeakPolarHBondContact O-CB 3.46Å; L97-I109 HydrophobicContact CD1-CG2 3.89Å; L97-I109 HydrophobicContact CD2-CG2 4.07Å; L97-V110 HydrophobicContact CB-CG2 4.2Å; L97-V110 HydrophobicContact CD1-CG2 3.56Å |
| 98 | G | 95.7 | Very high | 94.3 | Very high | 2 Ų | 2 | 35.1 Ų | 35.1 | 2% | 0.021 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -73.7 | -22.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 115 | V94 I95 L96 G206 T207 | V94-G98 PolarHBondContact O-N 3.49Å; I95-G98 CarbonylContact O-C 3.54Å; I95-G98 PolarHBondContact O-N 2.92Å; I95-G98 VanDerWaalsContact O-N 3.14Å; L96-G98 VanDerWaalsContact C-N 3.33Å; L96-G98 PolarHBondContact O-N 3.49Å; G98-G206 CarbonylContact O-C 3.57Å; G98-T207 WeakPolarHBondContact O-CA 3.28Å; G98-T207 PolarHBondContact O-N 3.45Å; G98-T207 PolarHBondContact O-OG1 3.08Å |
| 99 | Y | 94.4 | Very high | 94.7 | Very high | 11 Ų | 11 | 30.7 Ų | 30.7 | 4% | 0.043 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -75.5 | -45.6 | 173 | -176.9 | -76.1 | 0 | 0 | 0 | 111.2 | G57 I95 L96 L97 G206 L209 Q210 T213 | G57-Y99 VanDerWaalsContact O-CE1 3.31Å; G57-Y99 WeakPolarHBondContact O-CE1 3.41Å; I95-Y99 WeakPolarHBondContact O-CB 3.45Å; I95-Y99 PolarHBondContact O-N 3.4Å; L96-Y99 WeakPolarHBondContact O-CB 3.41Å; L96-Y99 PolarHBondContact O-N 3.26Å; L97-Y99 VanDerWaalsContact C-N 3.34Å; Y99-G206 WeakPolarHBondContact CA-O 3.31Å; Y99-L209 HydrophobicContact CD2-CB 4.07Å; Y99-L209 HydrophobicContact CD2-CD2 4.09Å; Y99-L209 HydrophobicContact CD2-CG 3.94Å; Y99-L209 HydrophobicContact CE2-CB 4.46Å; Y99-L209 HydrophobicContact CE2-CD2 4.44Å; Y99-L209 HydrophobicContact CE2-CG 4.02Å; Y99-Q210 HydrophobicContact CD1-CB 4.3Å; Y99-Q210 HydrophobicContact CD1-CG 4.5Å; Y99-Q210 HydrophobicContact CD2-CB 3.65Å; Y99-Q210 HydrophobicContact CE1-CB 4.34Å; Y99-Q210 HydrophobicContact CE1-CG 4.29Å; Y99-Q210 HydrophobicContact CE2-CB 3.73Å; Y99-Q210 HydrophobicContact CE2-CG 4.42Å; Y99-Q210 HydrophobicContact CG-CB 3.94Å; Y99-T213 VanDerWaalsContact OH-CB 3.31Å; Y99-T213 WeakPolarHBondContact OH-CB 3.24Å; Y99-T213 VanDerWaalsContact OH-CG2 3.25Å; Y99-T213 WeakPolarHBondContact OH-CG2 3.44Å; Y99-T213 PolarHBondContact OH-OG1 3.49Å; Y99-T213 VanDerWaalsContact OH-OG1 3.14Å |
| 100 | L | 93.1 | Very high | 95.3 | Very high | 13 Ų | 13 | 30 Ų | 30 | 7% | 0.068 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -89.5 | -34.8 | -170.3 | -66.3 | 167.7 | 0 | 0 | 0 | 113.2 | L60 Q64 I71 I75 L96 | L60-L100 HydrophobicContact CB-CD1 3.81Å; L60-L100 HydrophobicContact CB-CD2 3.84Å; L60-L100 HydrophobicContact CB-CG 4.45Å; L60-L100 HydrophobicContact CD1-CD1 4.02Å; Q64-L100 PolarHBondContact NE2-O 3.43Å; Q64-L100 PolarHBondContact OE1-O 3.39Å; I71-L100 HydrophobicContact CG2-CD1 4Å; I75-L100 HydrophobicContact CD1-CD1 3.47Å; I75-L100 VanDerWaalsContact CD1-CD1 3.47Å; L96-L100 WeakPolarHBondContact O-CB 3.49Å; L96-L100 VanDerWaalsContact O-CG 3.28Å; L96-L100 WeakPolarHBondContact O-CG 3.28Å; L96-L100 PolarHBondContact O-N 3.03Å |
| 101 | F | 94.2 | Very high | 95.5 | Very high | 7 Ų | 7 | 29 Ų | 29 | 3% | 0.031 | 17% | 0.165 | C | C | . | . | S | Bend | trans | -112.2 | 151.3 | -170.4 | -59.8 | -85.3 | 0 | 0 | 0 | 112 | Y68 I71 L72 L97 F103 V105 A106 | Y68-F101 HydrophobicContact CD1-CE1 4.39Å; Y68-F101 HydrophobicContact CD2-CD1 4.38Å; Y68-F101 AromaticContact CD2-CE1 3.94Å; Y68-F101 HydrophobicContact CD2-CE1 3.94Å; Y68-F101 HydrophobicContact CE1-CD1 4.34Å; Y68-F101 AromaticContact CE1-CE1 3.96Å; Y68-F101 HydrophobicContact CE1-CE1 3.96Å; Y68-F101 AromaticContact CE2-CD1 3.49Å; Y68-F101 HydrophobicContact CE2-CD1 3.49Å; Y68-F101 VanDerWaalsContact CE2-CD1 3.49Å; Y68-F101 AromaticContact CE2-CE1 3.47Å; Y68-F101 HydrophobicContact CE2-CE1 3.47Å; Y68-F101 VanDerWaalsContact CE2-CE1 3.47Å; Y68-F101 HydrophobicContact CG-CE1 4.38Å; Y68-F101 AromaticContact CZ-CD1 3.47Å; Y68-F101 VanDerWaalsContact CZ-CD1 3.47Å; Y68-F101 AromaticContact CZ-CE1 3.48Å; Y68-F101 VanDerWaalsContact CZ-CE1 3.48Å; Y68-F101 WeakPolarHBondContact OH-CD1 3.19Å; I71-F101 HydrophobicContact CG2-CZ 4.5Å; L72-F101 HydrophobicContact CB-CE1 3.94Å; L72-F101 HydrophobicContact CB-CZ 3.63Å; L72-F101 HydrophobicContact CD1-CE1 4.24Å; L72-F101 HydrophobicContact CD1-CE2 4.19Å; L72-F101 HydrophobicContact CD1-CZ 3.96Å; L72-F101 HydrophobicContact CG-CE1 4.45Å; L72-F101 HydrophobicContact CG-CZ 4.32Å; L97-F101 HydrophobicContact CD2-CD2 3.69Å; L97-F101 HydrophobicContact CD2-CE2 3.7Å; L97-F101 WeakPolarHBondContact O-CB 3.27Å; L97-F101 WeakPolarHBondContact O-CD2 3.31Å; L97-F101 PolarHBondContact O-N 2.82Å; F101-F103 PolarHBondContact O-N 3.37Å; F101-V105 HydrophobicContact CB-CG1 4.44Å; F101-A106 HydrophobicContact CB-CB 4.4Å |
| 102 | P | 93.5 | Very high | 95.8 | Very high | 77 Ų | 77 | 29.8 Ų | 29.8 | 50% | 0.5 | 17% | 0.167 | S | C | . | . | trans | -53 | 140.8 | 173.6 | -25.8 | 34.1 | 0 | 0 | 0 | 111.8 | V105 A106 | P102-V105 HydrophobicContact CB-CB 4.47Å; P102-V105 HydrophobicContact CB-CG2 4.31Å; P102-V105 WeakPolarHBondContact O-CA 3.15Å; P102-V105 WeakPolarHBondContact O-CB 3.34Å; P102-V105 PolarHBondContact O-N 3.33Å; P102-A106 PolarHBondContact O-N 3.27Å | ||
| 103 | F | 93.8 | Very high | 96 | Very high | 68 Ų | 68 | 29 Ų | 29 | 30% | 0.298 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -50.1 | -48.5 | -170.6 | -173.8 | -91.9 | 0 | 0 | 0 | 114.7 | F101 V105 A106 V107 L200 I203 K204 | F101-F103 PolarHBondContact O-N 3.37Å; F103-V105 VanDerWaalsContact C-N 3.3Å; F103-V105 PolarHBondContact O-N 2.9Å; F103-A106 PolarHBondContact O-N 3.34Å; F103-V107 HydrophobicContact CD1-CG2 4.27Å; F103-V107 HydrophobicContact CE1-CG2 3.98Å; F103-V107 HydrophobicContact CZ-CG2 4.26Å; F103-V107 WeakPolarHBondContact O-CG2 3.24Å; F103-V107 PolarHBondContact O-N 3.09Å; F103-L200 HydrophobicContact CE1-CD2 3.78Å; F103-L200 HydrophobicContact CZ-CD2 3.54Å; F103-I203 HydrophobicContact CD2-CG2 3.56Å; F103-I203 HydrophobicContact CE2-CB 4.16Å; F103-I203 HydrophobicContact CE2-CG2 3.64Å; F103-I203 HydrophobicContact CG-CG2 4.42Å; F103-K204 HydrophobicContact CD2-CD 4.47Å; F103-K204 HydrophobicContact CE2-CB 4Å; F103-K204 HydrophobicContact CE2-CD 4.1Å |
| 104 | P | 95.9 | Very high | 96.1 | Very high | 88 Ų | 88 | 29 Ų | 29 | 57% | 0.571 | 16% | 0.162 | S | C | * | . | H | α-helix | trans | -64.4 | -34.8 | 179.2 | -20.4 | 33.9 | 0 | 0 | 0 | 113.1 | V107 I108 | P104-V107 PolarHBondContact O-N 3.05Å; P104-I108 WeakPolarHBondContact O-CG1 3.24Å; P104-I108 PolarHBondContact O-N 3.25Å |
| 105 | V | 96.2 | Very high | 96.2 | Very high | 54 Ų | 54 | 28.6 Ų | 28.6 | 33% | 0.327 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -68.6 | -47.4 | 179.4 | 174.7 | 0 | 0 | 0 | 0 | 109.5 | F101 P102 F103 V107 I108 I109 | F101-V105 HydrophobicContact CB-CG1 4.44Å; P102-V105 HydrophobicContact CB-CB 4.47Å; P102-V105 HydrophobicContact CB-CG2 4.31Å; P102-V105 WeakPolarHBondContact O-CA 3.15Å; P102-V105 WeakPolarHBondContact O-CB 3.34Å; P102-V105 PolarHBondContact O-N 3.33Å; F103-V105 VanDerWaalsContact C-N 3.3Å; F103-V105 PolarHBondContact O-N 2.9Å; V105-V107 VanDerWaalsContact C-N 3.31Å; V105-V107 PolarHBondContact O-N 2.97Å; V105-I108 PolarHBondContact O-N 3.35Å; V105-I109 HydrophobicContact CG1-CD1 3.46Å; V105-I109 VanDerWaalsContact CG1-CD1 3.46Å; V105-I109 HydrophobicContact CG1-CG1 4.41Å; V105-I109 WeakPolarHBondContact O-CD1 3.25Å; V105-I109 VanDerWaalsContact O-CG1 3.3Å; V105-I109 WeakPolarHBondContact O-CG1 3.39Å; V105-I109 PolarHBondContact O-N 2.83Å |
| 106 | A | 97.1 | Very high | 96.3 | Very high | 0 Ų | 0 | 30.2 Ų | 30.2 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -56.9 | -42.8 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112 | L97 F101 P102 F103 I108 I109 V110 I203 | L97-A106 HydrophobicContact CB-CB 4.43Å; L97-A106 WeakPolarHBondContact O-CB 3.46Å; F101-A106 HydrophobicContact CB-CB 4.4Å; P102-A106 PolarHBondContact O-N 3.27Å; F103-A106 PolarHBondContact O-N 3.34Å; A106-I108 PolarHBondContact O-N 2.83Å; A106-I109 PolarHBondContact O-N 3.18Å; A106-V110 WeakPolarHBondContact O-CB 3.46Å; A106-V110 WeakPolarHBondContact O-CG2 3.29Å; A106-V110 PolarHBondContact O-N 2.91Å; A106-I203 HydrophobicContact CB-CG2 3.76Å |
| 107 | V | 97.4 | Very high | 96.4 | Very high | 23 Ų | 23 | 29.5 Ų | 29.5 | 14% | 0.139 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -58.9 | -48.8 | 177.3 | 172.6 | 0 | 0 | 0 | 0 | 111.7 | F103 P104 V105 V110 A111 V196 L200 I203 | F103-V107 HydrophobicContact CD1-CG2 4.27Å; F103-V107 HydrophobicContact CE1-CG2 3.98Å; F103-V107 HydrophobicContact CZ-CG2 4.26Å; F103-V107 WeakPolarHBondContact O-CG2 3.24Å; F103-V107 PolarHBondContact O-N 3.09Å; P104-V107 PolarHBondContact O-N 3.05Å; V105-V107 VanDerWaalsContact C-N 3.31Å; V105-V107 PolarHBondContact O-N 2.97Å; V107-V110 PolarHBondContact O-N 3.11Å; V107-A111 WeakPolarHBondContact O-CB 3.24Å; V107-A111 PolarHBondContact O-N 2.88Å; V107-V196 HydrophobicContact CG1-CG1 3.98Å; V107-V196 HydrophobicContact CG1-CG2 4.49Å; V107-L200 HydrophobicContact CG1-CD2 4.43Å; V107-L200 HydrophobicContact CG2-CD2 3.58Å; V107-I203 HydrophobicContact CB-CD1 4.23Å; V107-I203 HydrophobicContact CG2-CD1 3.65Å |
| 108 | I | 97.7 | Very high | 96.4 | Very high | 104 Ų | 104 | 29.6 Ų | 29.6 | 53% | 0.533 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -64.7 | -44.6 | -179.1 | -66.1 | 167.5 | 0 | 0 | 0 | 110.7 | P104 V105 A106 A111 L112 | P104-I108 WeakPolarHBondContact O-CG1 3.24Å; P104-I108 PolarHBondContact O-N 3.25Å; V105-I108 PolarHBondContact O-N 3.35Å; A106-I108 PolarHBondContact O-N 2.83Å; I108-A111 PolarHBondContact O-N 2.79Å; I108-L112 VanDerWaalsContact O-CB 3.28Å; I108-L112 WeakPolarHBondContact O-CB 3.37Å; I108-L112 PolarHBondContact O-N 3.16Å |
| 109 | I | 97.6 | Very high | 96.5 | Very high | 21 Ų | 21 | 30 Ų | 30 | 11% | 0.108 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -62.8 | -46.8 | 179.4 | -67.2 | 155.7 | 0 | 0 | 0 | 110.7 | L72 L97 V105 A106 L112 C113 | L72-I109 HydrophobicContact CD1-CD1 3.41Å; L72-I109 VanDerWaalsContact CD1-CD1 3.41Å; L72-I109 HydrophobicContact CD1-CG1 4.07Å; L72-I109 HydrophobicContact CD1-CG2 3.9Å; L72-I109 HydrophobicContact CD2-CD1 4.14Å; L72-I109 HydrophobicContact CG-CD1 4.43Å; L97-I109 HydrophobicContact CD1-CG2 3.89Å; L97-I109 HydrophobicContact CD2-CG2 4.07Å; V105-I109 HydrophobicContact CG1-CD1 3.46Å; V105-I109 VanDerWaalsContact CG1-CD1 3.46Å; V105-I109 HydrophobicContact CG1-CG1 4.41Å; V105-I109 WeakPolarHBondContact O-CD1 3.25Å; V105-I109 VanDerWaalsContact O-CG1 3.3Å; V105-I109 WeakPolarHBondContact O-CG1 3.39Å; V105-I109 PolarHBondContact O-N 2.83Å; A106-I109 PolarHBondContact O-N 3.18Å; I109-L112 PolarHBondContact O-N 2.92Å; I109-C113 VanDerWaalsContact O-CB 3.31Å; I109-C113 WeakPolarHBondContact O-CB 3.4Å; I109-C113 PolarHBondContact O-N 3.21Å; I109-C113 PolarHBondContact O-SG 2.77Å |
| 110 | V | 98 | Very high | 96.5 | Very high | 0 Ų | 0 | 32.4 Ų | 32.4 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -62.1 | -45 | 179.8 | 169 | 0 | 0 | 0 | 0 | 110.8 | F79 V94 L97 A106 V107 S114 S199 I203 | F79-V110 HydrophobicContact CE1-CB 4.42Å; F79-V110 HydrophobicContact CE1-CG1 4.06Å; F79-V110 HydrophobicContact CE1-CG2 4.23Å; F79-V110 HydrophobicContact CZ-CG1 4.15Å; V94-V110 HydrophobicContact CB-CG2 4.49Å; V94-V110 HydrophobicContact CG1-CG1 4.15Å; V94-V110 HydrophobicContact CG1-CG2 4.08Å; V94-V110 HydrophobicContact CG2-CG1 4.01Å; V94-V110 HydrophobicContact CG2-CG2 4.42Å; L97-V110 HydrophobicContact CB-CG2 4.2Å; L97-V110 HydrophobicContact CD1-CG2 3.56Å; A106-V110 WeakPolarHBondContact O-CB 3.46Å; A106-V110 WeakPolarHBondContact O-CG2 3.29Å; A106-V110 PolarHBondContact O-N 2.91Å; V107-V110 PolarHBondContact O-N 3.11Å; V110-S114 WeakPolarHBondContact O-CB 3.34Å; V110-S114 PolarHBondContact O-N 3.28Å; V110-S114 PolarHBondContact O-OG 3.34Å; V110-S199 WeakPolarHBondContact CG1-OG 3.47Å; V110-I203 HydrophobicContact CB-CD1 4.15Å; V110-I203 HydrophobicContact CG1-CD1 4.46Å; V110-I203 HydrophobicContact CG2-CD1 3.98Å; V110-I203 HydrophobicContact CG2-CG1 4.18Å |
| 111 | A | 97.8 | Very high | 96.6 | Very high | 2 Ų | 2 | 31.9 Ų | 31.9 | 2% | 0.017 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -60.7 | -46.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | V107 I108 S114 A115 F192 V195 V196 | V107-A111 WeakPolarHBondContact O-CB 3.24Å; V107-A111 PolarHBondContact O-N 2.88Å; I108-A111 PolarHBondContact O-N 2.79Å; A111-S114 PolarHBondContact O-N 2.89Å; A111-A115 WeakPolarHBondContact O-CB 3.38Å; A111-A115 PolarHBondContact O-N 3.11Å; A111-F192 HydrophobicContact CB-CD2 3.8Å; A111-F192 HydrophobicContact CB-CE2 3.7Å; A111-F192 HydrophobicContact CB-CG 4.39Å; A111-F192 HydrophobicContact CB-CZ 4.23Å; A111-F192 WeakPolarHBondContact CB-O 3.41Å; A111-V195 HydrophobicContact CB-CG2 4.44Å; A111-V196 HydrophobicContact CB-CG2 4.01Å |
| 112 | L | 98 | Very high | 96.6 | Very high | 75 Ų | 75 | 33 Ų | 33 | 39% | 0.393 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -65.8 | -48.4 | 179.6 | -173.9 | 62.4 | 0 | 0 | 0 | 112 | I108 I109 S114 A115 I116 F188 F192 | I108-L112 VanDerWaalsContact O-CB 3.28Å; I108-L112 WeakPolarHBondContact O-CB 3.37Å; I108-L112 PolarHBondContact O-N 3.16Å; I109-L112 PolarHBondContact O-N 2.92Å; L112-S114 VanDerWaalsContact C-N 3.3Å; L112-S114 PolarHBondContact O-N 3.38Å; L112-A115 PolarHBondContact O-N 3.38Å; L112-I116 HydrophobicContact CD1-CD1 3.95Å; L112-I116 HydrophobicContact CD1-CG1 4.33Å; L112-I116 HydrophobicContact CG-CD1 3.81Å; L112-I116 WeakPolarHBondContact O-CB 3.34Å; L112-I116 VanDerWaalsContact O-CG1 3.28Å; L112-I116 WeakPolarHBondContact O-CG1 3.35Å; L112-I116 PolarHBondContact O-N 3.48Å; L112-F188 HydrophobicContact CD1-CZ 4.22Å; L112-F192 HydrophobicContact CB-CE2 4.1Å; L112-F192 HydrophobicContact CD1-CE2 4.42Å |
| 113 | C | 97.7 | Very high | 96.6 | Very high | 6 Ų | 6 | 32.6 Ų | 32.6 | 4% | 0.041 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -61.9 | -39.9 | 177.9 | -68.6 | 0 | 0 | 0 | 0 | 111.6 | S76 F79 I80 I109 G117 | S76-C113 VanDerWaalsContact CB-SG 3.59Å; F79-C113 HydrophobicContact CB-CB 4.38Å; F79-C113 HydrophobicContact CD1-CB 4.16Å; F79-C113 HydrophobicContact CD2-CB 4.06Å; F79-C113 HydrophobicContact CE1-CB 4.47Å; F79-C113 HydrophobicContact CE2-CB 4.41Å; F79-C113 HydrophobicContact CG-CB 3.97Å; I80-C113 HydrophobicContact CG1-CB 3.99Å; I109-C113 VanDerWaalsContact O-CB 3.31Å; I109-C113 WeakPolarHBondContact O-CB 3.4Å; I109-C113 PolarHBondContact O-N 3.21Å; I109-C113 PolarHBondContact O-SG 2.77Å; C113-G117 PolarHBondContact O-N 2.93Å |
| 114 | S | 97.2 | Very high | 96.5 | Very high | 8 Ų | 8 | 30.4 Ų | 30.4 | 6% | 0.056 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -64.2 | -45.8 | 175.9 | -61.4 | 0 | 0 | 0 | 0 | 111.4 | F79 V110 A111 L112 A118 | F79-S114 WeakPolarHBondContact CE2-OG 3.37Å; F79-S114 VanDerWaalsContact CZ-OG 3.24Å; F79-S114 WeakPolarHBondContact CZ-OG 3.3Å; V110-S114 WeakPolarHBondContact O-CB 3.34Å; V110-S114 PolarHBondContact O-N 3.28Å; V110-S114 PolarHBondContact O-OG 3.34Å; A111-S114 PolarHBondContact O-N 2.89Å; L112-S114 VanDerWaalsContact C-N 3.3Å; L112-S114 PolarHBondContact O-N 3.38Å; S114-A118 WeakPolarHBondContact O-CB 3.2Å; S114-A118 PolarHBondContact O-N 3.03Å |
| 115 | A | 97.7 | Very high | 96.2 | Very high | 0 Ų | 0 | 27.1 Ų | 27.1 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -63.3 | -46.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | A111 L112 S119 F188 F192 | A111-A115 WeakPolarHBondContact O-CB 3.38Å; A111-A115 PolarHBondContact O-N 3.11Å; L112-A115 PolarHBondContact O-N 3.38Å; A115-S119 VanDerWaalsContact O-CB 3.25Å; A115-S119 WeakPolarHBondContact O-CB 3.46Å; A115-S119 PolarHBondContact O-N 2.91Å; A115-S119 PolarHBondContact O-OG 3.12Å; A115-S119 VanDerWaalsContact O-OG 3.11Å; A115-F188 HydrophobicContact CB-CD2 3.8Å; A115-F188 HydrophobicContact CB-CE1 4.36Å; A115-F188 HydrophobicContact CB-CE2 3.59Å; A115-F188 HydrophobicContact CB-CG 4.29Å; A115-F188 HydrophobicContact CB-CZ 3.89Å; A115-F192 HydrophobicContact CB-CB 3.92Å; A115-F192 HydrophobicContact CB-CD2 4.32Å |
| 116 | I | 97.8 | Very high | 95.7 | Very high | 61 Ų | 61 | 26 Ų | 26 | 31% | 0.313 | 15% | 0.145 | S | C | . | . | H | α-helix | trans | -63 | -52.5 | 178.1 | -66.3 | 170 | 0 | 0 | 0 | 110.9 | I80 L112 A118 S119 L120 F188 | I80-I116 HydrophobicContact CD1-CB 4.37Å; I80-I116 HydrophobicContact CD1-CG2 4.03Å; I80-I116 HydrophobicContact CG1-CG2 4.38Å; I80-I116 HydrophobicContact CG2-CG2 4.09Å; L112-I116 HydrophobicContact CD1-CD1 3.95Å; L112-I116 HydrophobicContact CD1-CG1 4.33Å; L112-I116 HydrophobicContact CG-CD1 3.81Å; L112-I116 WeakPolarHBondContact O-CB 3.34Å; L112-I116 VanDerWaalsContact O-CG1 3.28Å; L112-I116 WeakPolarHBondContact O-CG1 3.35Å; L112-I116 PolarHBondContact O-N 3.48Å; I116-A118 PolarHBondContact O-N 3.34Å; I116-S119 PolarHBondContact O-N 3.24Å; I116-S119 VanDerWaalsContact O-N 3.16Å; I116-L120 HydrophobicContact CG2-CD1 4.25Å; I116-L120 WeakPolarHBondContact O-CG 3.4Å; I116-L120 PolarHBondContact O-N 3.01Å; I116-F188 HydrophobicContact CG1-CE2 4Å |
| 117 | G | 97.1 | Very high | 95.1 | Very high | 0 Ų | 0 | 32.7 Ų | 32.7 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -63 | -41.2 | -179 | 0 | 0 | 0 | 0 | 0 | 112.8 | S84 C113 S119 L120 C121 | S84-G117 WeakPolarHBondContact CA-O 3.04Å; C113-G117 PolarHBondContact O-N 2.93Å; G117-S119 VanDerWaalsContact C-N 3.33Å; G117-S119 PolarHBondContact O-N 2.82Å; G117-L120 PolarHBondContact O-N 2.83Å; G117-C121 PolarHBondContact O-N 3.2Å |
| 118 | A | 96.6 | Very high | 94.1 | Very high | 1 Ų | 1 | 34 Ų | 34 | 1% | 0.008 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -63.8 | -39 | 173.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | S114 I116 C121 Y122 N174 F187 T191 | S114-A118 WeakPolarHBondContact O-CB 3.2Å; S114-A118 PolarHBondContact O-N 3.03Å; I116-A118 PolarHBondContact O-N 3.34Å; A118-C121 WeakPolarHBondContact O-CB 3.5Å; A118-C121 PolarHBondContact O-N 3.4Å; A118-Y122 WeakPolarHBondContact O-CB 3.3Å; A118-Y122 PolarHBondContact O-N 3.36Å; A118-N174 WeakPolarHBondContact CB-OD1 3.45Å; A118-F187 HydrophobicContact CB-CE1 3.78Å; A118-F187 HydrophobicContact CB-CZ 3.85Å; A118-F187 WeakPolarHBondContact O-CE1 3.43Å; A118-T191 HydrophobicContact CB-CG2 4.01Å |
| 119 | S | 97.1 | Very high | 92.4 | Very high | 11 Ų | 11 | 29.5 Ų | 29.5 | 8% | 0.077 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -67.8 | -36.4 | 176.9 | -78.2 | 0 | 0 | 0 | 0 | 112.6 | A115 I116 G117 Y122 L123 F188 | A115-S119 VanDerWaalsContact O-CB 3.25Å; A115-S119 WeakPolarHBondContact O-CB 3.46Å; A115-S119 PolarHBondContact O-N 2.91Å; A115-S119 PolarHBondContact O-OG 3.12Å; A115-S119 VanDerWaalsContact O-OG 3.11Å; I116-S119 PolarHBondContact O-N 3.24Å; I116-S119 VanDerWaalsContact O-N 3.16Å; G117-S119 VanDerWaalsContact C-N 3.33Å; G117-S119 PolarHBondContact O-N 2.82Å; S119-Y122 WeakPolarHBondContact O-CB 3.06Å; S119-Y122 PolarHBondContact O-N 3.17Å; S119-L123 VanDerWaalsContact O-CG 3.25Å; S119-L123 WeakPolarHBondContact O-CG 3.36Å; S119-L123 PolarHBondContact O-N 3.07Å; S119-F188 WeakPolarHBondContact OG-CD2 3.32Å |
| 120 | L | 95.6 | Very high | 90.8 | Very high | 62 Ų | 62 | 29.5 Ų | 29.5 | 33% | 0.325 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -64.3 | -43.7 | 171.9 | -70.4 | 174.3 | 0 | 0 | 0 | 111.1 | F22 I80 S84 I116 G117 L123 L124 | F22-L120 HydrophobicContact CE2-CD1 4.01Å; I80-L120 HydrophobicContact CG2-CD1 3.62Å; S84-L120 WeakPolarHBondContact OG-CB 3.31Å; S84-L120 WeakPolarHBondContact OG-CD1 3.25Å; I116-L120 HydrophobicContact CG2-CD1 4.25Å; I116-L120 WeakPolarHBondContact O-CG 3.4Å; I116-L120 PolarHBondContact O-N 3.01Å; G117-L120 PolarHBondContact O-N 2.83Å; L120-L123 PolarHBondContact O-N 3.11Å; L120-L124 VanDerWaalsContact O-CG 3.3Å; L120-L124 WeakPolarHBondContact O-CG 3.25Å; L120-L124 PolarHBondContact O-N 3.27Å |
| 121 | C | 94.5 | Very high | 89.2 | Confident | 1 Ų | 1 | 37.2 Ų | 37.2 | 1% | 0.007 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -59 | -47.7 | 172.7 | -172.4 | 0 | 0 | 0 | 0 | 111.6 | S84 M86 G117 A118 L123 L124 V125 N174 | S84-C121 WeakPolarHBondContact O-CA 3.44Å; S84-C121 WeakPolarHBondContact O-CB 3.38Å; M86-C121 VanDerWaalsContact CG-SG 3.59Å; G117-C121 PolarHBondContact O-N 3.2Å; A118-C121 WeakPolarHBondContact O-CB 3.5Å; A118-C121 PolarHBondContact O-N 3.4Å; C121-L123 VanDerWaalsContact C-N 3.28Å; C121-L123 PolarHBondContact O-N 2.95Å; C121-L124 PolarHBondContact O-N 3.45Å; C121-V125 WeakPolarHBondContact O-CB 3.37Å; C121-V125 VanDerWaalsContact O-CG2 3.28Å; C121-V125 WeakPolarHBondContact O-CG2 3.42Å; C121-V125 PolarHBondContact O-N 3.01Å; C121-N174 HydrophobicContact CB-CB 4.01Å; C121-N174 VanDerWaalsContact SG-CB 3.59Å |
| 122 | Y | 94.4 | Very high | 87.9 | Confident | 30 Ų | 30 | 40.7 Ų | 40.7 | 12% | 0.118 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -52.1 | -47.5 | 174.4 | 171.9 | -70.8 | 0 | 0 | 0 | 111 | A118 S119 G126 P178 I182 L184 F187 | A118-Y122 WeakPolarHBondContact O-CB 3.3Å; A118-Y122 PolarHBondContact O-N 3.36Å; S119-Y122 WeakPolarHBondContact O-CB 3.06Å; S119-Y122 PolarHBondContact O-N 3.17Å; Y122-G126 PolarHBondContact O-N 3.47Å; Y122-P178 HydrophobicContact CD1-CB 4.21Å; Y122-P178 HydrophobicContact CD2-CB 3.97Å; Y122-P178 VanDerWaalsContact CD2-CD 3.43Å; Y122-P178 HydrophobicContact CD2-CG 4.07Å; Y122-P178 HydrophobicContact CE1-CB 3.93Å; Y122-P178 VanDerWaalsContact CE2-CA 3.47Å; Y122-P178 HydrophobicContact CE2-CB 3.69Å; Y122-P178 HydrophobicContact CE2-CG 4.23Å; Y122-P178 VanDerWaalsContact CE2-N 3.28Å; Y122-P178 HydrophobicContact CG-CB 4.17Å; Y122-P178 HydrophobicContact CG-CG 4.27Å; Y122-I182 WeakPolarHBondContact CE2-O 3.36Å; Y122-I182 PolarHBondContact OH-O 3.24Å; Y122-L184 HydrophobicContact CD1-CD1 3.73Å; Y122-L184 HydrophobicContact CE1-CB 4.4Å; Y122-L184 HydrophobicContact CE1-CD1 4.14Å; Y122-L184 HydrophobicContact CG-CD1 4.06Å; Y122-F187 HydrophobicContact CD2-CB 4.48Å; Y122-F187 HydrophobicContact CD2-CD1 4.09Å; Y122-F187 HydrophobicContact CD2-CD2 4.13Å; Y122-F187 HydrophobicContact CD2-CE1 4.33Å; Y122-F187 HydrophobicContact CD2-CE2 4.34Å; Y122-F187 AromaticContact CD2-CG 3.97Å; Y122-F187 HydrophobicContact CD2-CG 3.97Å; Y122-F187 HydrophobicContact CD2-CZ 4.42Å; Y122-F187 HydrophobicContact CG-CD1 4.43Å; Y122-F187 HydrophobicContact CG-CE1 4.48Å |
| 123 | L | 93.2 | Very high | 86.5 | Confident | 70 Ų | 70 | 40.3 Ų | 40.3 | 37% | 0.366 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -67 | -47.4 | -178.4 | -72.1 | 170.8 | 0 | 0 | 0 | 111 | S119 L120 C121 V125 G126 F127 L184 | S119-L123 VanDerWaalsContact O-CG 3.25Å; S119-L123 WeakPolarHBondContact O-CG 3.36Å; S119-L123 PolarHBondContact O-N 3.07Å; L120-L123 PolarHBondContact O-N 3.11Å; C121-L123 VanDerWaalsContact C-N 3.28Å; C121-L123 PolarHBondContact O-N 2.95Å; L123-V125 VanDerWaalsContact C-N 3.34Å; L123-V125 PolarHBondContact O-N 2.86Å; L123-G126 PolarHBondContact O-N 2.98Å; L123-F127 WeakPolarHBondContact O-CD2 3.28Å; L123-F127 PolarHBondContact O-N 2.96Å; L123-L184 HydrophobicContact CD2-CD2 4.22Å |
| 124 | L | 91.6 | Very high | 85 | Confident | 22 Ų | 22 | 43 Ų | 43 | 12% | 0.115 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -56.5 | -48.7 | 176.6 | -71 | 171.2 | 0 | 0 | 0 | 110.9 | V15 F85 L120 C121 G126 F127 I128 | V15-L124 HydrophobicContact CG2-CD2 4.43Å; F85-L124 HydrophobicContact CD1-CD1 4.25Å; F85-L124 HydrophobicContact CE1-CD1 3.77Å; F85-L124 HydrophobicContact CZ-CD1 4.27Å; L120-L124 VanDerWaalsContact O-CG 3.3Å; L120-L124 WeakPolarHBondContact O-CG 3.25Å; L120-L124 PolarHBondContact O-N 3.27Å; C121-L124 PolarHBondContact O-N 3.45Å; L124-G126 PolarHBondContact O-N 2.81Å; L124-F127 PolarHBondContact O-N 2.87Å; L124-I128 VanDerWaalsContact O-CD1 3.31Å; L124-I128 WeakPolarHBondContact O-CD1 3.26Å; L124-I128 WeakPolarHBondContact O-CG1 3.31Å; L124-I128 PolarHBondContact O-N 3.34Å |
| 125 | V | 89.3 | Confident | 83.7 | Confident | 19 Ų | 19 | 51.8 Ų | 51.8 | 12% | 0.115 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -65 | -40.9 | 177.9 | 176.5 | 0 | 0 | 0 | 0 | 111.4 | C121 L123 F127 I128 G129 I175 P178 I179 | C121-V125 WeakPolarHBondContact O-CB 3.37Å; C121-V125 VanDerWaalsContact O-CG2 3.28Å; C121-V125 WeakPolarHBondContact O-CG2 3.42Å; C121-V125 PolarHBondContact O-N 3.01Å; L123-V125 VanDerWaalsContact C-N 3.34Å; L123-V125 PolarHBondContact O-N 2.86Å; V125-F127 VanDerWaalsContact C-N 3.29Å; V125-F127 PolarHBondContact O-N 3.47Å; V125-I128 PolarHBondContact O-N 3.43Å; V125-G129 VanDerWaalsContact O-CA 3.27Å; V125-G129 WeakPolarHBondContact O-CA 3.21Å; V125-G129 PolarHBondContact O-N 3.32Å; V125-I175 HydrophobicContact CG1-CB 4.39Å; V125-I175 HydrophobicContact CG1-CG1 4.38Å; V125-I175 HydrophobicContact CG1-CG2 4.17Å; V125-I175 HydrophobicContact CG2-CG1 3.82Å; V125-P178 HydrophobicContact CB-CG 4.06Å; V125-P178 HydrophobicContact CG1-CG 3.88Å; V125-I179 HydrophobicContact CG1-CD1 4.46Å |
| 126 | G | 87.2 | Confident | 82.7 | Confident | 30 Ų | 30 | 58.6 Ų | 58.6 | 31% | 0.309 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -59.8 | -38 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | Y122 L123 L124 | Y122-G126 PolarHBondContact O-N 3.47Å; L123-G126 PolarHBondContact O-N 2.98Å; L124-G126 PolarHBondContact O-N 2.81Å |
| 127 | F | 83 | Confident | 81.8 | Confident | 141 Ų | 141 | 59.4 Ų | 59.4 | 62% | 0.618 | 29% | 0.294 | S | S | * | . | H | α-helix | trans | -71.7 | -38.1 | 175 | -80.1 | -65.9 | 0 | 0 | 0 | 113.2 | L123 L124 V125 | L123-F127 WeakPolarHBondContact O-CD2 3.28Å; L123-F127 PolarHBondContact O-N 2.96Å; L124-F127 PolarHBondContact O-N 2.87Å; V125-F127 VanDerWaalsContact C-N 3.29Å; V125-F127 PolarHBondContact O-N 3.47Å |
| 128 | I | 77.6 | Confident | 81 | Confident | 50 Ų | 50 | 62.7 Ų | 62.7 | 26% | 0.256 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -77 | -47.3 | -179.6 | -57.4 | 153.9 | 0 | 0 | 0 | 112 | P11 V15 L124 V125 | P11-I128 HydrophobicContact CB-CB 4.31Å; P11-I128 HydrophobicContact CB-CG1 4.35Å; P11-I128 HydrophobicContact CB-CG2 4.16Å; V15-I128 HydrophobicContact CG2-CD1 3.2Å; V15-I128 HydrophobicContact CG2-CG1 3.38Å; L124-I128 VanDerWaalsContact O-CD1 3.31Å; L124-I128 WeakPolarHBondContact O-CD1 3.26Å; L124-I128 WeakPolarHBondContact O-CG1 3.31Å; L124-I128 PolarHBondContact O-N 3.34Å; V125-I128 PolarHBondContact O-N 3.43Å |
| 129 | G | 62.1 | Low | 80.2 | Confident | 10 Ų | 10 | 70.5 Ų | 70.5 | 10% | 0.103 | 35% | 0.351 | C | S | . | . | H | α-helix | trans | -124 | -17.7 | -130.7 | 0 | 0 | 0 | 0 | 0 | 115 | V125 K131 V132 L133 | V125-G129 VanDerWaalsContact O-CA 3.27Å; V125-G129 WeakPolarHBondContact O-CA 3.21Å; V125-G129 PolarHBondContact O-N 3.32Å; G129-K131 PolarHBondContact O-N 3.34Å; G129-V132 PolarHBondContact O-N 3.23Å; G129-L133 WeakPolarHBondContact O-CB 3.4Å; G129-L133 PolarHBondContact O-N 3.43Å |
| 130 | S | 62.5 | Low | 79.3 | Confident | 21 Ų | 21 | 77.6 Ų | 77.6 | 15% | 0.147 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -62.4 | -35.3 | 172.9 | -58.8 | 0 | 0 | 0 | 0 | 110.4 | M134 | S130-M134 WeakPolarHBondContact O-CB 3.06Å; S130-M134 WeakPolarHBondContact O-CG 3.48Å; S130-M134 PolarHBondContact O-N 2.91Å |
| 131 | K | 66.2 | Low | 78.6 | Confident | 162 Ų | 162 | 75.4 Ų | 75.4 | 70% | 0.704 | 37% | 0.369 | S | S | * | . | H | α-helix | trans | -73.9 | -41.8 | 176.7 | -64.7 | -172.7 | -177.8 | -178 | 0 | 113.5 | G129 Y135 | G129-K131 PolarHBondContact O-N 3.34Å; K131-Y135 PolarHBondContact O-N 2.99Å |
| 132 | V | 69.1 | Low | 77.9 | Confident | 74 Ų | 74 | 79 Ų | 79 | 45% | 0.448 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -69.7 | -46 | -179.3 | 178 | 0 | 0 | 0 | 0 | 110.4 | G129 Y135 F136 | G129-V132 PolarHBondContact O-N 3.23Å; V132-Y135 VanDerWaalsContact O-CB 3.32Å; V132-Y135 WeakPolarHBondContact O-CB 3.2Å; V132-Y135 PolarHBondContact O-N 2.98Å; V132-F136 HydrophobicContact CG1-CD2 4.31Å; V132-F136 HydrophobicContact CG1-CE2 3.88Å; V132-F136 WeakPolarHBondContact O-CD2 3.18Å |
| 133 | L | 68.6 | Low | 77.3 | Confident | 68 Ų | 68 | 83.2 Ų | 83.2 | 36% | 0.356 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -75.1 | -34.7 | -178.2 | -160.2 | 70.3 | 0 | 0 | 0 | 112.4 | G129 Y135 F136 I137 I141 I179 | G129-L133 WeakPolarHBondContact O-CB 3.4Å; G129-L133 PolarHBondContact O-N 3.43Å; L133-Y135 PolarHBondContact O-N 2.76Å; L133-F136 PolarHBondContact O-N 3.31Å; L133-F136 VanDerWaalsContact O-N 3.15Å; L133-I137 PolarHBondContact O-N 3.41Å; L133-I137 VanDerWaalsContact O-N 3.13Å; L133-I141 HydrophobicContact CB-CD1 4.31Å; L133-I141 HydrophobicContact CD2-CD1 4.18Å; L133-I141 HydrophobicContact CG-CD1 3.97Å; L133-I179 HydrophobicContact CB-CD1 4.28Å; L133-I179 HydrophobicContact CD2-CD1 3.25Å; L133-I179 HydrophobicContact CD2-CG1 4.22Å; L133-I179 HydrophobicContact CD2-CG2 4.03Å; L133-I179 HydrophobicContact CG-CD1 4.38Å |
| 134 | M | 66 | Low | 76.6 | Confident | 63 Ų | 63 | 82.1 Ų | 82.1 | 31% | 0.31 | 41% | 0.407 | S | S | . | . | H | α-helix | trans | -63.7 | -22.9 | 169.8 | -77 | -151.4 | -109.5 | 0 | 0 | 113.1 | S130 P138 I141 R145 | S130-M134 WeakPolarHBondContact O-CB 3.06Å; S130-M134 WeakPolarHBondContact O-CG 3.48Å; S130-M134 PolarHBondContact O-N 2.91Å; M134-P138 VanDerWaalsContact O-CB 3.27Å; M134-P138 WeakPolarHBondContact O-CB 3.43Å; M134-P138 VanDerWaalsContact O-CD 3.25Å; M134-P138 WeakPolarHBondContact O-CD 3.4Å; M134-I141 HydrophobicContact CG-CD1 4.07Å; M134-I141 HydrophobicContact CG-CG2 4.16Å; M134-R145 VanDerWaalsContact CE-CZ 3.46Å; M134-R145 VanDerWaalsContact CE-NH1 3.3Å |
| 135 | Y | 71.3 | Confident | 76.1 | Confident | 191 Ų | 191 | 82 Ų | 82 | 75% | 0.749 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -69.5 | -36.4 | 173.2 | -178.4 | -96.8 | 0 | 0 | 0 | 112.4 | K131 V132 L133 | K131-Y135 PolarHBondContact O-N 2.99Å; V132-Y135 VanDerWaalsContact O-CB 3.32Å; V132-Y135 WeakPolarHBondContact O-CB 3.2Å; V132-Y135 PolarHBondContact O-N 2.98Å; L133-Y135 PolarHBondContact O-N 2.76Å |
| 136 | F | 75.4 | Confident | 75.8 | Confident | 143 Ų | 143 | 85.7 Ų | 85.7 | 63% | 0.627 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -84 | -36.9 | -177.1 | -71.2 | -72.6 | 0 | 0 | 0 | 113.6 | V132 L133 | V132-F136 HydrophobicContact CG1-CD2 4.31Å; V132-F136 HydrophobicContact CG1-CE2 3.88Å; V132-F136 WeakPolarHBondContact O-CD2 3.18Å; L133-F136 PolarHBondContact O-N 3.31Å; L133-F136 VanDerWaalsContact O-N 3.15Å |
| 137 | I | 79.8 | Confident | 75.5 | Confident | 79 Ų | 79 | 87 Ų | 87 | 41% | 0.405 | 42% | 0.424 | S | S | . | . | trans | -143.5 | 58.6 | -172.1 | -39.3 | 178.8 | 0 | 0 | 0 | 111.9 | L133 E139 K140 I141 | L133-I137 PolarHBondContact O-N 3.41Å; L133-I137 VanDerWaalsContact O-N 3.13Å; I137-E139 PolarHBondContact O-N 2.91Å; I137-K140 HydrophobicContact CG2-CB 3.62Å; I137-K140 HydrophobicContact CG2-CD 3.65Å; I137-K140 HydrophobicContact CG2-CG 3.56Å; I137-I141 WeakPolarHBondContact O-CD1 3.33Å; I137-I141 VanDerWaalsContact O-CG1 3.32Å; I137-I141 WeakPolarHBondContact O-CG1 3.42Å; I137-I141 PolarHBondContact O-N 3.47Å | ||
| 138 | P | 79.8 | Confident | 75.1 | Confident | 69 Ų | 69 | 82 Ų | 82 | 45% | 0.448 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -61.4 | -46.4 | -173.5 | 22.2 | -30.3 | 0 | 0 | 0 | 112.7 | M134 K140 I141 E142 | M134-P138 VanDerWaalsContact O-CB 3.27Å; M134-P138 WeakPolarHBondContact O-CB 3.43Å; M134-P138 VanDerWaalsContact O-CD 3.25Å; M134-P138 WeakPolarHBondContact O-CD 3.4Å; P138-K140 PolarHBondContact O-N 3.44Å; P138-I141 PolarHBondContact O-N 2.93Å; P138-E142 WeakPolarHBondContact O-CB 3.42Å; P138-E142 PolarHBondContact O-N 3.33Å |
| 139 | E | 79.3 | Confident | 75.2 | Confident | 165 Ų | 165 | 85 Ų | 85 | 77% | 0.771 | 42% | 0.416 | S | S | * | . | H | α-helix | trans | -62.9 | -42.8 | -173.3 | -65.8 | 179.2 | 176.5 | 0 | 0 | 112.9 | I137 E142 L143 | I137-E139 PolarHBondContact O-N 2.91Å; E139-E142 PolarHBondContact O-N 3.37Å; E139-L143 WeakPolarHBondContact O-CB 3.47Å; E139-L143 PolarHBondContact O-N 2.99Å |
| 140 | K | 79.5 | Confident | 76 | Confident | 160 Ų | 160 | 94 Ų | 94 | 70% | 0.696 | 45% | 0.447 | S | S | * | . | H | α-helix | trans | -70.1 | -36.8 | 179.3 | -57.5 | -169 | -175.9 | -174 | 0 | 111.8 | I137 P138 C144 | I137-K140 HydrophobicContact CG2-CB 3.62Å; I137-K140 HydrophobicContact CG2-CD 3.65Å; I137-K140 HydrophobicContact CG2-CG 3.56Å; P138-K140 PolarHBondContact O-N 3.44Å; K140-C144 WeakPolarHBondContact O-CB 3.21Å; K140-C144 PolarHBondContact O-N 3.48Å |
| 141 | I | 79.2 | Confident | 76.7 | Confident | 15 Ų | 15 | 100.4 Ų | 100.4 | 8% | 0.077 | 47% | 0.469 | C | S | . | . | H | α-helix | trans | -65.2 | -44.7 | 176.7 | -69.5 | 168.3 | 0 | 0 | 0 | 109.6 | L133 M134 I137 P138 C144 R145 I179 | L133-I141 HydrophobicContact CB-CD1 4.31Å; L133-I141 HydrophobicContact CD2-CD1 4.18Å; L133-I141 HydrophobicContact CG-CD1 3.97Å; M134-I141 HydrophobicContact CG-CD1 4.07Å; M134-I141 HydrophobicContact CG-CG2 4.16Å; I137-I141 WeakPolarHBondContact O-CD1 3.33Å; I137-I141 VanDerWaalsContact O-CG1 3.32Å; I137-I141 WeakPolarHBondContact O-CG1 3.42Å; I137-I141 PolarHBondContact O-N 3.47Å; P138-I141 PolarHBondContact O-N 2.93Å; I141-C144 WeakPolarHBondContact O-CB 3.24Å; I141-C144 PolarHBondContact O-N 3.39Å; I141-R145 HydrophobicContact CG2-CG 4.32Å; I141-R145 WeakPolarHBondContact O-CB 3.28Å; I141-R145 VanDerWaalsContact O-CG 3.24Å; I141-R145 WeakPolarHBondContact O-CG 3.49Å; I141-R145 PolarHBondContact O-N 2.88Å; I141-I179 HydrophobicContact CD1-CG2 3.96Å; I141-I179 HydrophobicContact CG1-CG2 4.04Å; I141-I179 HydrophobicContact CG2-CG2 3.93Å |
| 142 | E | 80.3 | Confident | 77.2 | Confident | 78 Ų | 78 | 100 Ų | 100 | 36% | 0.364 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -65.3 | -42.7 | 179.6 | -171.2 | 52.9 | -145.6 | 0 | 0 | 112 | P138 E139 C144 R145 Q146 | P138-E142 WeakPolarHBondContact O-CB 3.42Å; P138-E142 PolarHBondContact O-N 3.33Å; E139-E142 PolarHBondContact O-N 3.37Å; E142-C144 VanDerWaalsContact C-N 3.31Å; E142-C144 PolarHBondContact O-N 2.95Å; E142-R145 WeakPolarHBondContact O-CB 3.47Å; E142-R145 PolarHBondContact O-N 3.39Å; E142-Q146 VanDerWaalsContact O-CG 3.31Å; E142-Q146 WeakPolarHBondContact O-CG 3.48Å; E142-Q146 PolarHBondContact O-N 2.92Å; E142-Q146 PolarHBondContact OE1-NE2 3.42Å; E142-Q146 VanDerWaalsContact OE1-NE2 3.1Å |
| 143 | L | 81.7 | Confident | 77.7 | Confident | 117 Ų | 117 | 105.4 Ų | 105.4 | 61% | 0.613 | 48% | 0.483 | S | S | * | . | H | α-helix | trans | -60.5 | -41.2 | 173.4 | -174.7 | 144.9 | 0 | 0 | 0 | 112 | E139 T147 | E139-L143 WeakPolarHBondContact O-CB 3.47Å; E139-L143 PolarHBondContact O-N 2.99Å; L143-T147 WeakPolarHBondContact O-CB 3.42Å; L143-T147 PolarHBondContact O-N 2.86Å; L143-T147 PolarHBondContact O-OG1 3.01Å |
| 144 | C | 78.6 | Confident | 78.6 | Confident | 47 Ų | 47 | 104.2 Ų | 104.2 | 32% | 0.318 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -65.7 | -44.1 | 176.7 | -171 | 0 | 0 | 0 | 0 | 111.5 | K140 I141 E142 T147 I148 I180 | K140-C144 WeakPolarHBondContact O-CB 3.21Å; K140-C144 PolarHBondContact O-N 3.48Å; I141-C144 WeakPolarHBondContact O-CB 3.24Å; I141-C144 PolarHBondContact O-N 3.39Å; E142-C144 VanDerWaalsContact C-N 3.31Å; E142-C144 PolarHBondContact O-N 2.95Å; C144-T147 PolarHBondContact O-N 2.89Å; C144-I148 WeakPolarHBondContact O-CB 3.46Å; C144-I148 WeakPolarHBondContact O-CG1 3.21Å; C144-I148 PolarHBondContact O-N 3.35Å; C144-I180 HydrophobicContact CB-CG2 4.38Å |
| 145 | R | 82.5 | Confident | 79.6 | Confident | 20 Ų | 20 | 101.6 Ų | 101.6 | 8% | 0.075 | 47% | 0.47 | C | S | . | . | H | α-helix | trans | -58 | -49.1 | 175.2 | -74.2 | 165.8 | 176.5 | -133.4 | -19.5 | 111.3 | M134 I141 E142 T147 I148 Q149 I179 D181 | M134-R145 VanDerWaalsContact CE-CZ 3.46Å; M134-R145 VanDerWaalsContact CE-NH1 3.3Å; I141-R145 HydrophobicContact CG2-CG 4.32Å; I141-R145 WeakPolarHBondContact O-CB 3.28Å; I141-R145 VanDerWaalsContact O-CG 3.24Å; I141-R145 WeakPolarHBondContact O-CG 3.49Å; I141-R145 PolarHBondContact O-N 2.88Å; E142-R145 WeakPolarHBondContact O-CB 3.47Å; E142-R145 PolarHBondContact O-N 3.39Å; R145-T147 VanDerWaalsContact C-N 3.31Å; R145-T147 PolarHBondContact O-N 3.46Å; R145-I148 PolarHBondContact O-N 3.33Å; R145-Q149 WeakPolarHBondContact O-CB 3.42Å; R145-Q149 VanDerWaalsContact O-CG 3.23Å; R145-Q149 WeakPolarHBondContact O-CG 3.34Å; R145-Q149 PolarHBondContact O-N 3.15Å; R145-I179 PolarHBondContact NE-O 2.89Å; R145-I179 PolarHBondContact NH2-O 3.05Å; R145-D181 IonicContact CZ-OD1 3.56Å; R145-D181 IonicContact CZ-OD2 2.95Å; R145-D181 IonicContact NE-OD2 3.48Å; R145-D181 PolarHBondContact NE-OD2 2.88Å; R145-D181 IonicContact NH1-OD1 3.92Å; R145-D181 IonicContact NH1-OD2 2.85Å; R145-D181 PolarHBondContact NH1-OD2 3.09Å; R145-D181 VanDerWaalsContact NH2-CG 3.31Å; R145-D181 IonicContact NH2-OD1 2.91Å; R145-D181 PolarHBondContact NH2-OD1 3.17Å; R145-D181 IonicContact NH2-OD2 3.17Å; R145-D181 PolarHBondContact NH2-OD2 2.72Å |
| 146 | Q | 82.2 | Confident | 80.5 | Confident | 96 Ų | 96 | 96.2 Ų | 96.2 | 45% | 0.449 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -61.5 | -40.3 | 178.1 | -71 | 175.9 | 15.3 | 0 | 0 | 112 | E142 R150 | E142-Q146 VanDerWaalsContact O-CG 3.31Å; E142-Q146 WeakPolarHBondContact O-CG 3.48Å; E142-Q146 PolarHBondContact O-N 2.92Å; E142-Q146 PolarHBondContact OE1-NE2 3.42Å; E142-Q146 VanDerWaalsContact OE1-NE2 3.1Å; Q146-R150 PolarHBondContact O-N 3.27Å |
| 147 | T | 80.2 | Confident | 81.1 | Confident | 59 Ų | 59 | 95.9 Ų | 95.9 | 36% | 0.362 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -64.6 | -47.2 | 177 | -56.3 | 0 | 0 | 0 | 0 | 111.1 | L143 C144 R145 R150 Y151 | L143-T147 WeakPolarHBondContact O-CB 3.42Å; L143-T147 PolarHBondContact O-N 2.86Å; L143-T147 PolarHBondContact O-OG1 3.01Å; C144-T147 PolarHBondContact O-N 2.89Å; R145-T147 VanDerWaalsContact C-N 3.31Å; R145-T147 PolarHBondContact O-N 3.46Å; T147-R150 WeakPolarHBondContact O-CB 3.37Å; T147-R150 PolarHBondContact O-N 2.9Å; T147-Y151 VanDerWaalsContact O-CD2 3.28Å; T147-Y151 WeakPolarHBondContact O-CD2 3.26Å |
| 148 | I | 76.2 | Confident | 81.6 | Confident | 35 Ų | 35 | 94.5 Ų | 94.5 | 18% | 0.179 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -70.2 | -33.9 | -178.5 | -72.4 | 173.4 | 0 | 0 | 0 | 111.9 | C144 R145 R150 Y151 R152 M155 I180 I182 | C144-I148 WeakPolarHBondContact O-CB 3.46Å; C144-I148 WeakPolarHBondContact O-CG1 3.21Å; C144-I148 PolarHBondContact O-N 3.35Å; R145-I148 PolarHBondContact O-N 3.33Å; I148-R150 PolarHBondContact O-N 3.42Å; I148-Y151 CarbonylContact O-C 3.58Å; I148-Y151 VanDerWaalsContact O-C 3.27Å; I148-Y151 WeakPolarHBondContact O-CA 3.34Å; I148-Y151 PolarHBondContact O-N 3.16Å; I148-R152 PolarHBondContact O-N 3.11Å; I148-M155 HydrophobicContact CG2-CE 3.52Å; I148-M155 HydrophobicContact CG2-CG 4.38Å; I148-I180 HydrophobicContact CD1-CB 3.87Å; I148-I180 HydrophobicContact CD1-CD1 3.49Å; I148-I180 VanDerWaalsContact CD1-CD1 3.49Å; I148-I180 HydrophobicContact CD1-CG1 3.69Å; I148-I180 HydrophobicContact CD1-CG2 4.34Å; I148-I182 HydrophobicContact CG2-CG1 4.37Å |
| 149 | Q | 78.4 | Confident | 82.1 | Confident | 113 Ų | 113 | 91.2 Ų | 91.2 | 53% | 0.528 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -60.8 | -31.9 | 174.7 | -79.3 | -179.7 | 8.9 | 0 | 0 | 112.4 | R145 Y151 R152 | R145-Q149 WeakPolarHBondContact O-CB 3.42Å; R145-Q149 VanDerWaalsContact O-CG 3.23Å; R145-Q149 WeakPolarHBondContact O-CG 3.34Å; R145-Q149 PolarHBondContact O-N 3.15Å; Q149-Y151 PolarHBondContact O-N 3.46Å; Q149-R152 WeakPolarHBondContact O-CB 3.45Å; Q149-R152 PolarHBondContact O-N 3.09Å |
| 150 | R | 78.4 | Confident | 82.7 | Confident | 200 Ų | 200 | 83.8 Ų | 83.8 | 76% | 0.755 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -63.6 | -28.3 | 171.9 | -66.5 | 173.9 | -178.1 | 172.9 | 1.3 | 112.5 | Q146 T147 I148 | Q146-R150 PolarHBondContact O-N 3.27Å; T147-R150 WeakPolarHBondContact O-CB 3.37Å; T147-R150 PolarHBondContact O-N 2.9Å; I148-R150 PolarHBondContact O-N 3.42Å |
| 151 | Y | 77.6 | Confident | 83.2 | Confident | 155 Ų | 155 | 77.5 Ų | 77.5 | 61% | 0.608 | 37% | 0.366 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.8 | 25.8 | 178 | -60.6 | -75.3 | 0 | 0 | 0 | 112.8 | T147 I148 Q149 H153 A154 M155 | T147-Y151 VanDerWaalsContact O-CD2 3.28Å; T147-Y151 WeakPolarHBondContact O-CD2 3.26Å; I148-Y151 CarbonylContact O-C 3.58Å; I148-Y151 VanDerWaalsContact O-C 3.27Å; I148-Y151 WeakPolarHBondContact O-CA 3.34Å; I148-Y151 PolarHBondContact O-N 3.16Å; Q149-Y151 PolarHBondContact O-N 3.46Å; Y151-H153 PolarHBondContact O-N 3.32Å; Y151-H153 VanDerWaalsContact O-N 3.13Å; Y151-A154 CarbonylContact O-C 3.57Å; Y151-A154 WeakPolarHBondContact O-CA 3.34Å; Y151-A154 PolarHBondContact O-N 2.91Å; Y151-M155 PolarHBondContact O-N 3.16Å |
| 152 | R | 76.4 | Confident | 83.7 | Confident | 154 Ų | 154 | 79.1 Ų | 79.1 | 58% | 0.581 | 38% | 0.375 | S | S | * | . | G | 310 helix | trans | -52.1 | -39.7 | -177.4 | -173.8 | 175.9 | -176.7 | -179.8 | 1 | 113.2 | I148 Q149 A154 M155 | I148-R152 PolarHBondContact O-N 3.11Å; Q149-R152 WeakPolarHBondContact O-CB 3.45Å; Q149-R152 PolarHBondContact O-N 3.09Å; R152-A154 PolarHBondContact O-N 3.49Å; R152-M155 HydrophobicContact CB-CE 4.06Å; R152-M155 HydrophobicContact CB-SD 4.33Å; R152-M155 HydrophobicContact CG-CE 3.99Å; R152-M155 HydrophobicContact CG-SD 3.9Å; R152-M155 WeakPolarHBondContact O-CG 3.29Å; R152-M155 PolarHBondContact O-N 3.33Å |
| 153 | H | 81.4 | Confident | 84.3 | Confident | 187 Ų | 187 | 75.7 Ų | 75.7 | 87% | 0.866 | 36% | 0.359 | S | S | * | . | G | 310 helix | trans | -65.5 | -22.7 | 177.9 | -60.3 | -68.4 | 0 | 0 | 0 | 113.7 | Y151 | Y151-H153 PolarHBondContact O-N 3.32Å; Y151-H153 VanDerWaalsContact O-N 3.13Å |
| 154 | A | 86 | Confident | 84.6 | Confident | 43 Ų | 43 | 73.4 Ų | 73.4 | 36% | 0.355 | 35% | 0.346 | S | S | . | . | G | 310 helix | trans | -103.6 | 6.4 | -178.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | Y151 R152 F156 F157 C158 | Y151-A154 CarbonylContact O-C 3.57Å; Y151-A154 WeakPolarHBondContact O-CA 3.34Å; Y151-A154 PolarHBondContact O-N 2.91Å; R152-A154 PolarHBondContact O-N 3.49Å; A154-F156 VanDerWaalsContact C-N 3.31Å; A154-F156 PolarHBondContact O-N 3.4Å; A154-F157 PolarHBondContact O-N 2.97Å; A154-F157 VanDerWaalsContact O-N 3.07Å; A154-C158 PolarHBondContact O-N 2.93Å |
| 155 | M | 87.5 | Confident | 84.9 | Confident | 7 Ų | 7 | 71.9 Ų | 71.9 | 3% | 0.034 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -58.8 | -39.8 | -177.2 | -76.5 | 170.7 | 172.4 | 0 | 0 | 113 | I148 Y151 R152 C158 I159 P183 H186 | I148-M155 HydrophobicContact CG2-CE 3.52Å; I148-M155 HydrophobicContact CG2-CG 4.38Å; Y151-M155 PolarHBondContact O-N 3.16Å; R152-M155 HydrophobicContact CB-CE 4.06Å; R152-M155 HydrophobicContact CB-SD 4.33Å; R152-M155 HydrophobicContact CG-CE 3.99Å; R152-M155 HydrophobicContact CG-SD 3.9Å; R152-M155 WeakPolarHBondContact O-CG 3.29Å; R152-M155 PolarHBondContact O-N 3.33Å; M155-C158 PolarHBondContact O-N 3.28Å; M155-I159 WeakPolarHBondContact O-CG1 3.28Å; M155-I159 PolarHBondContact O-N 2.63Å; M155-P183 WeakPolarHBondContact SD-CD 3.39Å; M155-P183 HydrophobicContact SD-CG 4.17Å; M155-H186 HydrophobicContact CB-CB 4.1Å |
| 156 | F | 89.5 | Confident | 84.8 | Confident | 79 Ų | 79 | 73.6 Ų | 73.6 | 35% | 0.346 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -57.6 | -49.8 | 174.2 | 165.1 | -96 | 0 | 0 | 0 | 110.9 | A154 C158 I159 C160 F189 V193 | A154-F156 VanDerWaalsContact C-N 3.31Å; A154-F156 PolarHBondContact O-N 3.4Å; F156-C158 PolarHBondContact O-N 2.91Å; F156-I159 PolarHBondContact O-N 2.84Å; F156-C160 VanDerWaalsContact CZ-SG 3.58Å; F156-C160 PolarHBondContact O-N 3.41Å; F156-C160 PolarHBondContact O-SG 2.78Å; F156-C160 VanDerWaalsContact O-SG 3.35Å; F156-F189 HydrophobicContact CD2-CB 3.99Å; F156-F189 VanDerWaalsContact CE2-C 3.46Å; F156-F189 HydrophobicContact CE2-CB 3.87Å; F156-F189 WeakPolarHBondContact CE2-O 3.32Å; F156-V193 HydrophobicContact CE2-CG2 4.31Å; F156-V193 HydrophobicContact CZ-CB 4.29Å; F156-V193 HydrophobicContact CZ-CG2 4.12Å |
| 157 | F | 89 | Confident | 84.8 | Confident | 135 Ų | 135 | 73.4 Ų | 73.4 | 59% | 0.592 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -65 | -39.7 | -179.5 | -175 | -100.6 | 0 | 0 | 0 | 111.8 | A154 I159 C160 C161 | A154-F157 PolarHBondContact O-N 2.97Å; A154-F157 VanDerWaalsContact O-N 3.07Å; F157-I159 PolarHBondContact O-N 3Å; F157-C160 WeakPolarHBondContact O-CB 3.36Å; F157-C160 PolarHBondContact O-N 3.34Å; F157-C161 WeakPolarHBondContact CE1-SG 3.3Å; F157-C161 VanDerWaalsContact CZ-SG 3.59Å; F157-C161 PolarHBondContact O-N 3.47Å; F157-C161 PolarHBondContact O-SG 3.47Å; F157-C161 VanDerWaalsContact O-SG 3.36Å |
| 158 | C | 89.1 | Confident | 85 | Confident | 50 Ų | 50 | 72.7 Ų | 72.7 | 34% | 0.338 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -56.8 | -50 | 173.9 | -178.6 | 0 | 0 | 0 | 0 | 111.4 | A154 M155 F156 C160 C161 L162 | A154-C158 PolarHBondContact O-N 2.93Å; M155-C158 PolarHBondContact O-N 3.28Å; F156-C158 PolarHBondContact O-N 2.91Å; C158-C160 VanDerWaalsContact C-N 3.35Å; C158-C160 PolarHBondContact O-N 2.68Å; C158-C161 PolarHBondContact O-N 3.23Å; C158-L162 VanDerWaalsContact O-CG 3.29Å; C158-L162 WeakPolarHBondContact O-CG 3.33Å; C158-L162 PolarHBondContact O-N 3.33Å |
| 159 | I | 92.2 | Very high | 85.6 | Confident | 0 Ų | 0 | 73.4 Ų | 73.4 | 0% | 0 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -62.4 | -42.2 | 176.8 | -63.8 | -65.9 | 0 | 0 | 0 | 111.1 | M155 F156 F157 C161 L162 R163 V173 I182 F187 | M155-I159 WeakPolarHBondContact O-CG1 3.28Å; M155-I159 PolarHBondContact O-N 2.63Å; F156-I159 PolarHBondContact O-N 2.84Å; F157-I159 PolarHBondContact O-N 3Å; I159-C161 PolarHBondContact O-N 2.79Å; I159-L162 HydrophobicContact CD1-CD1 4.43Å; I159-L162 PolarHBondContact O-N 3.46Å; I159-R163 HydrophobicContact CG2-CG 4.22Å; I159-R163 WeakPolarHBondContact O-CG 3.39Å; I159-R163 PolarHBondContact O-N 3.35Å; I159-V173 HydrophobicContact CD1-CG1 3.94Å; I159-I182 HydrophobicContact CD1-CD1 3.8Å; I159-I182 HydrophobicContact CG1-CD1 4.37Å; I159-I182 HydrophobicContact CG1-CG2 4.42Å; I159-F187 HydrophobicContact CD1-CD2 4.03Å |
| 160 | C | 91.9 | Very high | 86.1 | Confident | 9 Ų | 9 | 70.9 Ų | 70.9 | 6% | 0.061 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -55.2 | -51.8 | 174.7 | -71.6 | 0 | 0 | 0 | 0 | 111.4 | F156 F157 C158 L162 R163 I164 G190 | F156-C160 VanDerWaalsContact CZ-SG 3.58Å; F156-C160 PolarHBondContact O-N 3.41Å; F156-C160 PolarHBondContact O-SG 2.78Å; F156-C160 VanDerWaalsContact O-SG 3.35Å; F157-C160 WeakPolarHBondContact O-CB 3.36Å; F157-C160 PolarHBondContact O-N 3.34Å; C158-C160 VanDerWaalsContact C-N 3.35Å; C158-C160 PolarHBondContact O-N 2.68Å; C160-L162 VanDerWaalsContact C-N 3.34Å; C160-L162 PolarHBondContact O-N 2.85Å; C160-R163 PolarHBondContact O-N 2.83Å; C160-R163 VanDerWaalsContact O-N 3.14Å; C160-I164 VanDerWaalsContact O-CG1 3.23Å; C160-I164 WeakPolarHBondContact O-CG1 3.29Å; C160-I164 PolarHBondContact O-N 3.48Å; C160-G190 PolarHBondContact SG-O 3.21Å; C160-G190 VanDerWaalsContact SG-O 3.39Å |
| 161 | C | 88.7 | Confident | 86.6 | Confident | 28 Ų | 28 | 67.2 Ų | 67.2 | 19% | 0.189 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -58.8 | -44.2 | 178.8 | -69.8 | 0 | 0 | 0 | 0 | 112.2 | F157 C158 I159 R163 I164 C165 F247 | F157-C161 WeakPolarHBondContact CE1-SG 3.3Å; F157-C161 VanDerWaalsContact CZ-SG 3.59Å; F157-C161 PolarHBondContact O-N 3.47Å; F157-C161 PolarHBondContact O-SG 3.47Å; F157-C161 VanDerWaalsContact O-SG 3.36Å; C158-C161 PolarHBondContact O-N 3.23Å; I159-C161 PolarHBondContact O-N 2.79Å; C161-R163 VanDerWaalsContact C-N 3.25Å; C161-R163 PolarHBondContact O-N 3.3Å; C161-I164 PolarHBondContact O-N 2.9Å; C161-C165 WeakPolarHBondContact O-CB 3.39Å; C161-C165 PolarHBondContact O-N 2.91Å; C161-C165 VanDerWaalsContact O-N 3.08Å; C161-F247 HydrophobicContact CB-CE1 4.37Å; C161-F247 HydrophobicContact CB-CZ 3.91Å |
| 162 | L | 89.9 | Confident | 87.3 | Confident | 49 Ų | 49 | 63.2 Ų | 63.2 | 26% | 0.257 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -62.6 | -30.9 | 178.3 | -70.3 | 174.2 | 0 | 0 | 0 | 113 | C158 I159 C160 I168 V173 | C158-L162 VanDerWaalsContact O-CG 3.29Å; C158-L162 WeakPolarHBondContact O-CG 3.33Å; C158-L162 PolarHBondContact O-N 3.33Å; I159-L162 HydrophobicContact CD1-CD1 4.43Å; I159-L162 PolarHBondContact O-N 3.46Å; C160-L162 VanDerWaalsContact C-N 3.34Å; C160-L162 PolarHBondContact O-N 2.85Å; L162-I168 HydrophobicContact CD2-CG1 4.39Å; L162-V173 HydrophobicContact CB-CG2 4.21Å; L162-V173 HydrophobicContact CD1-CG1 4.41Å |
| 163 | R | 92.1 | Very high | 88 | Confident | 6 Ų | 6 | 56 Ų | 56 | 2% | 0.023 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -85 | -33.1 | -179.8 | -66.5 | -70.8 | -169.5 | -164.6 | -5.8 | 113.6 | I159 C160 C161 C165 N170 N174 F187 T191 G194 V195 | I159-R163 HydrophobicContact CG2-CG 4.22Å; I159-R163 WeakPolarHBondContact O-CG 3.39Å; I159-R163 PolarHBondContact O-N 3.35Å; C160-R163 PolarHBondContact O-N 2.83Å; C160-R163 VanDerWaalsContact O-N 3.14Å; C161-R163 VanDerWaalsContact C-N 3.25Å; C161-R163 PolarHBondContact O-N 3.3Å; R163-C165 PolarHBondContact O-N 2.85Å; R163-N170 WeakPolarHBondContact CD-OD1 3.28Å; R163-N170 PolarHBondContact NH1-O 2.98Å; R163-N170 PolarHBondContact NH1-OD1 3.15Å; R163-N174 PolarHBondContact NH1-OD1 3.47Å; R163-N174 VanDerWaalsContact NH1-OD1 3.11Å; R163-N174 PolarHBondContact NH2-OD1 3.24Å; R163-F187 VanDerWaalsContact NH2-CE2 3.32Å; R163-T191 PolarHBondContact NE-OG1 3.37Å; R163-T191 PolarHBondContact NH2-OG1 3.18Å; R163-G194 CarbonylContact C-O 3.27Å; R163-G194 VanDerWaalsContact CB-C 3.44Å; R163-G194 WeakPolarHBondContact CB-O 3.38Å; R163-V195 HydrophobicContact CB-CG1 4.25Å; R163-V195 HydrophobicContact CG-CG1 4.35Å |
| 164 | I | 88.8 | Confident | 88.6 | Confident | 70 Ų | 70 | 47.1 Ų | 47.1 | 36% | 0.359 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -66.8 | -32.5 | 173.3 | -66.7 | 169.2 | 0 | 0 | 0 | 109.8 | C160 C161 P166 G194 P197 | C160-I164 VanDerWaalsContact O-CG1 3.23Å; C160-I164 WeakPolarHBondContact O-CG1 3.29Å; C160-I164 PolarHBondContact O-N 3.48Å; C161-I164 PolarHBondContact O-N 2.9Å; I164-P166 VanDerWaalsContact O-CD 3.31Å; I164-P166 WeakPolarHBondContact O-CD 3.42Å; I164-G194 VanDerWaalsContact CG1-O 3.27Å; I164-G194 WeakPolarHBondContact CG1-O 3.39Å; I164-G194 PolarHBondContact N-O 3.46Å; I164-P197 HydrophobicContact CD1-CG 4.35Å; I164-P197 HydrophobicContact CG1-CG 3.99Å |
| 165 | C | 85.5 | Confident | 88.8 | Confident | 14 Ų | 14 | 47.2 Ų | 47.2 | 10% | 0.095 | 24% | 0.239 | C | C | . | . | trans | -67.5 | 111.6 | 179.6 | -177.2 | 0 | 0 | 0 | 0 | 112.3 | C161 R163 F167 I168 | C161-C165 WeakPolarHBondContact O-CB 3.39Å; C161-C165 PolarHBondContact O-N 2.91Å; C161-C165 VanDerWaalsContact O-N 3.08Å; R163-C165 PolarHBondContact O-N 2.85Å; C165-F167 PolarHBondContact O-N 3.1Å; C165-F167 WeakPolarHBondContact SG-CD1 3.27Å; C165-F167 WeakPolarHBondContact SG-CD2 3.4Å; C165-F167 WeakPolarHBondContact SG-CE1 3.15Å; C165-F167 WeakPolarHBondContact SG-CE2 3.22Å; C165-F167 WeakPolarHBondContact SG-CG 3.45Å; C165-F167 WeakPolarHBondContact SG-CZ 3.34Å; C165-I168 HydrophobicContact CB-CG1 4.29Å; C165-I168 PolarHBondContact O-N 3.2Å | ||
| 166 | P | 80.9 | Confident | 88.8 | Confident | 56 Ų | 56 | 48.6 Ų | 48.6 | 36% | 0.364 | 25% | 0.25 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -72.7 | -16.5 | -172.3 | 29.9 | -36.1 | 0 | 0 | 0 | 113.7 | I164 P236 | I164-P166 VanDerWaalsContact O-CD 3.31Å; I164-P166 WeakPolarHBondContact O-CD 3.42Å; P166-P236 HydrophobicContact CG-CB 4.49Å |
| 167 | F | 81.2 | Confident | 88.9 | Confident | 92 Ų | 92 | 44.9 Ų | 44.9 | 40% | 0.404 | 23% | 0.233 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -89.1 | -14.5 | -176.9 | 57.1 | -103.8 | 0 | 0 | 0 | 113.8 | C165 P169 L243 | C165-F167 PolarHBondContact O-N 3.1Å; C165-F167 WeakPolarHBondContact SG-CD1 3.27Å; C165-F167 WeakPolarHBondContact SG-CD2 3.4Å; C165-F167 WeakPolarHBondContact SG-CE1 3.15Å; C165-F167 WeakPolarHBondContact SG-CE2 3.22Å; C165-F167 WeakPolarHBondContact SG-CG 3.45Å; C165-F167 WeakPolarHBondContact SG-CZ 3.34Å; F167-P169 WeakPolarHBondContact O-CD 3.32Å; F167-L243 HydrophobicContact CE1-CD1 4.4Å |
| 168 | I | 84.9 | Confident | 89 | Confident | 44 Ų | 44 | 38.7 Ų | 38.7 | 23% | 0.226 | 21% | 0.207 | C | C | . | . | S | Bend | trans | -87.5 | 115.5 | 175.9 | -59.7 | -61.4 | 0 | 0 | 0 | 108.3 | L162 C165 N170 V173 | L162-I168 HydrophobicContact CD2-CG1 4.39Å; C165-I168 HydrophobicContact CB-CG1 4.29Å; C165-I168 PolarHBondContact O-N 3.2Å; I168-N170 PolarHBondContact O-N 3.15Å; I168-V173 HydrophobicContact CG2-CG2 3.45Å; I168-V173 VanDerWaalsContact CG2-CG2 3.45Å |
| 169 | P | 87.6 | Confident | 88.8 | Confident | 50 Ų | 50 | 36.8 Ų | 36.8 | 33% | 0.325 | 19% | 0.193 | S | C | . | . | trans | -62.5 | 134.9 | 178.8 | -20.5 | 32.7 | 0 | 0 | 0 | 110.8 | F167 W171 L172 V173 | F167-P169 WeakPolarHBondContact O-CD 3.32Å; P169-W171 VanDerWaalsContact CB-CD1 3.48Å; P169-W171 HydrophobicContact CB-CD2 4.21Å; P169-W171 HydrophobicContact CB-CG 4.1Å; P169-W171 HydrophobicContact CB-CZ2 4.27Å; P169-W171 HydrophobicContact CG-CZ2 4.31Å; P169-W171 PolarHBondContact O-N 3.45Å; P169-W171 VanDerWaalsContact O-N 3.13Å; P169-L172 HydrophobicContact CB-CB 4.33Å; P169-L172 WeakPolarHBondContact O-CB 3.32Å; P169-L172 PolarHBondContact O-N 2.55Å; P169-V173 PolarHBondContact O-N 3.02Å | ||
| 170 | N | 89.4 | Confident | 88.5 | Confident | 60 Ų | 60 | 38 Ų | 38 | 32% | 0.321 | 20% | 0.199 | S | C | . | . | H | α-helix | trans | -54.6 | -37.6 | -179.4 | -85 | -71 | 0 | 0 | 0 | 113 | R163 I168 L172 V173 N174 | R163-N170 WeakPolarHBondContact CD-OD1 3.28Å; R163-N170 PolarHBondContact NH1-O 2.98Å; R163-N170 PolarHBondContact NH1-OD1 3.15Å; I168-N170 PolarHBondContact O-N 3.15Å; N170-L172 VanDerWaalsContact C-N 3.28Å; N170-L172 PolarHBondContact O-N 3.48Å; N170-V173 PolarHBondContact O-N 2.9Å; N170-N174 PolarHBondContact O-N 2.91Å; N170-N174 VanDerWaalsContact O-N 3.15Å; N170-N174 PolarHBondContact O-OD1 3.36Å |
| 171 | W | 90.1 | Very high | 88.2 | Confident | 123 Ų | 123 | 41 Ų | 41 | 47% | 0.466 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -64.8 | -31.9 | 178.6 | 67.4 | -105.3 | 0 | 0 | 0 | 112.9 | M86 P169 N174 I175 | M86-W171 HydrophobicContact CB-CB 4Å; M86-W171 HydrophobicContact CE-CB 3.55Å; M86-W171 HydrophobicContact CE-CD2 3.96Å; M86-W171 HydrophobicContact CE-CE3 3.7Å; M86-W171 HydrophobicContact CE-CG 3.95Å; M86-W171 HydrophobicContact CG-CB 3.76Å; M86-W171 HydrophobicContact SD-CB 4.27Å; P169-W171 VanDerWaalsContact CB-CD1 3.48Å; P169-W171 HydrophobicContact CB-CD2 4.21Å; P169-W171 HydrophobicContact CB-CG 4.1Å; P169-W171 HydrophobicContact CB-CZ2 4.27Å; P169-W171 HydrophobicContact CG-CZ2 4.31Å; P169-W171 PolarHBondContact O-N 3.45Å; P169-W171 VanDerWaalsContact O-N 3.13Å; W171-N174 PolarHBondContact O-N 3.07Å; W171-I175 HydrophobicContact CE3-CD1 4.03Å; W171-I175 HydrophobicContact CZ3-CD1 4.4Å; W171-I175 WeakPolarHBondContact O-CG1 3.16Å; W171-I175 PolarHBondContact O-N 3.37Å |
| 172 | L | 90.5 | Very high | 88.3 | Confident | 71 Ų | 71 | 39.8 Ų | 39.8 | 37% | 0.372 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -67.4 | -45.3 | 179.8 | -178.9 | 61.5 | 0 | 0 | 0 | 110.1 | P169 N170 N174 I175 S176 | P169-L172 HydrophobicContact CB-CB 4.33Å; P169-L172 WeakPolarHBondContact O-CB 3.32Å; P169-L172 PolarHBondContact O-N 2.55Å; N170-L172 VanDerWaalsContact C-N 3.28Å; N170-L172 PolarHBondContact O-N 3.48Å; L172-N174 VanDerWaalsContact C-N 3.32Å; L172-N174 PolarHBondContact O-N 2.89Å; L172-I175 PolarHBondContact O-N 3.1Å; L172-S176 WeakPolarHBondContact O-CB 3.32Å; L172-S176 PolarHBondContact O-N 2.96Å; L172-S176 PolarHBondContact O-OG 3.22Å; L172-S176 VanDerWaalsContact O-OG 3.08Å |
| 173 | V | 92 | Very high | 88.4 | Confident | 2 Ų | 2 | 39.3 Ų | 39.3 | 1% | 0.012 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -61.9 | -41.2 | 175.7 | -171.1 | 0 | 0 | 0 | 0 | 110.8 | I159 L162 I168 P169 N170 I175 S176 S177 F187 | I159-V173 HydrophobicContact CD1-CG1 3.94Å; L162-V173 HydrophobicContact CB-CG2 4.21Å; L162-V173 HydrophobicContact CD1-CG1 4.41Å; I168-V173 HydrophobicContact CG2-CG2 3.45Å; I168-V173 VanDerWaalsContact CG2-CG2 3.45Å; P169-V173 PolarHBondContact O-N 3.02Å; N170-V173 PolarHBondContact O-N 2.9Å; V173-I175 VanDerWaalsContact C-N 3.34Å; V173-I175 PolarHBondContact O-N 3.48Å; V173-S176 PolarHBondContact O-OG 3.35Å; V173-S177 VanDerWaalsContact O-CB 3.25Å; V173-S177 WeakPolarHBondContact O-CB 3.33Å; V173-S177 PolarHBondContact O-N 3.4Å; V173-S177 VanDerWaalsContact O-N 3.1Å; V173-S177 PolarHBondContact O-OG 2.99Å; V173-F187 HydrophobicContact CG1-CE2 4.22Å |
| 174 | N | 93.4 | Very high | 88.4 | Confident | 1 Ų | 1 | 42 Ų | 42 | 1% | 0.005 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -62.1 | -40.6 | 177.8 | -62.2 | -1.3 | 0 | 0 | 0 | 112.1 | A118 C121 R163 N170 W171 L172 P178 F187 | A118-N174 WeakPolarHBondContact CB-OD1 3.45Å; C121-N174 HydrophobicContact CB-CB 4.01Å; C121-N174 VanDerWaalsContact SG-CB 3.59Å; R163-N174 PolarHBondContact NH1-OD1 3.47Å; R163-N174 VanDerWaalsContact NH1-OD1 3.11Å; R163-N174 PolarHBondContact NH2-OD1 3.24Å; N170-N174 PolarHBondContact O-N 2.91Å; N170-N174 VanDerWaalsContact O-N 3.15Å; N170-N174 PolarHBondContact O-OD1 3.36Å; W171-N174 PolarHBondContact O-N 3.07Å; L172-N174 VanDerWaalsContact C-N 3.32Å; L172-N174 PolarHBondContact O-N 2.89Å; N174-P178 WeakPolarHBondContact O-CD 3.43Å; N174-F187 HydrophobicContact CB-CZ 4.46Å |
| 175 | I | 90.3 | Very high | 88.7 | Confident | 45 Ų | 45 | 43.1 Ų | 43.1 | 23% | 0.231 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -74.3 | -45.7 | 179.1 | -72.5 | -178.9 | 0 | 0 | 0 | 111.6 | M86 V125 W171 L172 V173 P178 I179 | M86-I175 HydrophobicContact CE-CD1 3.33Å; M86-I175 HydrophobicContact CE-CG1 4.11Å; M86-I175 HydrophobicContact SD-CD1 3.72Å; M86-I175 HydrophobicContact SD-CG1 3.96Å; V125-I175 HydrophobicContact CG1-CB 4.39Å; V125-I175 HydrophobicContact CG1-CG1 4.38Å; V125-I175 HydrophobicContact CG1-CG2 4.17Å; V125-I175 HydrophobicContact CG2-CG1 3.82Å; W171-I175 HydrophobicContact CE3-CD1 4.03Å; W171-I175 HydrophobicContact CZ3-CD1 4.4Å; W171-I175 WeakPolarHBondContact O-CG1 3.16Å; W171-I175 PolarHBondContact O-N 3.37Å; L172-I175 PolarHBondContact O-N 3.1Å; V173-I175 VanDerWaalsContact C-N 3.34Å; V173-I175 PolarHBondContact O-N 3.48Å; I175-P178 VanDerWaalsContact O-CD 3.23Å; I175-P178 WeakPolarHBondContact O-CD 3.45Å; I175-P178 WeakPolarHBondContact O-CG 3.3Å; I175-I179 HydrophobicContact CG2-CD1 3.77Å; I175-I179 VanDerWaalsContact O-CD1 3.23Å; I175-I179 WeakPolarHBondContact O-CD1 3.48Å; I175-I179 WeakPolarHBondContact O-CG1 3.43Å |
| 176 | S | 88.4 | Confident | 89.2 | Confident | 37 Ų | 37 | 45.3 Ų | 45.3 | 26% | 0.259 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -70.8 | -36 | -172.8 | 65.7 | 0 | 0 | 0 | 0 | 112.5 | L172 V173 I179 I180 | L172-S176 WeakPolarHBondContact O-CB 3.32Å; L172-S176 PolarHBondContact O-N 2.96Å; L172-S176 PolarHBondContact O-OG 3.22Å; L172-S176 VanDerWaalsContact O-OG 3.08Å; V173-S176 PolarHBondContact O-OG 3.35Å; S176-I179 WeakPolarHBondContact O-CB 3.42Å; S176-I179 PolarHBondContact O-N 3.48Å; S176-I179 VanDerWaalsContact O-N 3.08Å; S176-I180 WeakPolarHBondContact O-CD1 3.31Å; S176-I180 WeakPolarHBondContact O-CG1 3.39Å; S176-I180 PolarHBondContact O-N 3.4Å |
| 177 | S | 91.1 | Very high | 89.8 | Confident | 1 Ų | 1 | 42.7 Ų | 42.7 | 1% | 0.007 | 22% | 0.222 | C | C | . | . | H | α-helix | trans | -57.2 | -48.2 | -175.7 | -62.4 | 0 | 0 | 0 | 0 | 114.8 | V173 I179 D181 I182 F187 | V173-S177 VanDerWaalsContact O-CB 3.25Å; V173-S177 WeakPolarHBondContact O-CB 3.33Å; V173-S177 PolarHBondContact O-N 3.4Å; V173-S177 VanDerWaalsContact O-N 3.1Å; V173-S177 PolarHBondContact O-OG 2.99Å; S177-I179 VanDerWaalsContact C-N 3.28Å; S177-I179 PolarHBondContact O-N 3.24Å; S177-D181 PolarHBondContact O-N 2.88Å; S177-I182 PolarHBondContact O-N 3.48Å; S177-F187 VanDerWaalsContact CB-CD2 3.45Å; S177-F187 VanDerWaalsContact OG-CD2 3.25Å; S177-F187 WeakPolarHBondContact OG-CD2 3.33Å; S177-F187 WeakPolarHBondContact OG-CE2 3.46Å |
| 178 | P | 90.2 | Very high | 90.6 | Very high | 5 Ų | 5 | 40.6 Ų | 40.6 | 3% | 0.032 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -70.3 | -25.5 | 175.3 | 27.6 | -34.9 | 0 | 0 | 0 | 112.7 | Y122 V125 N174 I175 | Y122-P178 HydrophobicContact CD1-CB 4.21Å; Y122-P178 HydrophobicContact CD2-CB 3.97Å; Y122-P178 VanDerWaalsContact CD2-CD 3.43Å; Y122-P178 HydrophobicContact CD2-CG 4.07Å; Y122-P178 HydrophobicContact CE1-CB 3.93Å; Y122-P178 VanDerWaalsContact CE2-CA 3.47Å; Y122-P178 HydrophobicContact CE2-CB 3.69Å; Y122-P178 HydrophobicContact CE2-CG 4.23Å; Y122-P178 VanDerWaalsContact CE2-N 3.28Å; Y122-P178 HydrophobicContact CG-CB 4.17Å; Y122-P178 HydrophobicContact CG-CG 4.27Å; V125-P178 HydrophobicContact CB-CG 4.06Å; V125-P178 HydrophobicContact CG1-CG 3.88Å; N174-P178 WeakPolarHBondContact O-CD 3.43Å; I175-P178 VanDerWaalsContact O-CD 3.23Å; I175-P178 WeakPolarHBondContact O-CD 3.45Å; I175-P178 WeakPolarHBondContact O-CG 3.3Å |
| 179 | I | 86.4 | Confident | 91.2 | Very high | 10 Ų | 10 | 43.8 Ų | 43.8 | 5% | 0.051 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -74 | -34.2 | 179 | -70.7 | 164.9 | 0 | 0 | 0 | 111.1 | V125 L133 I141 R145 I175 S176 S177 D181 | V125-I179 HydrophobicContact CG1-CD1 4.46Å; L133-I179 HydrophobicContact CB-CD1 4.28Å; L133-I179 HydrophobicContact CD2-CD1 3.25Å; L133-I179 HydrophobicContact CD2-CG1 4.22Å; L133-I179 HydrophobicContact CD2-CG2 4.03Å; L133-I179 HydrophobicContact CG-CD1 4.38Å; I141-I179 HydrophobicContact CD1-CG2 3.96Å; I141-I179 HydrophobicContact CG1-CG2 4.04Å; I141-I179 HydrophobicContact CG2-CG2 3.93Å; R145-I179 PolarHBondContact NE-O 2.89Å; R145-I179 PolarHBondContact NH2-O 3.05Å; I175-I179 HydrophobicContact CG2-CD1 3.77Å; I175-I179 VanDerWaalsContact O-CD1 3.23Å; I175-I179 WeakPolarHBondContact O-CD1 3.48Å; I175-I179 WeakPolarHBondContact O-CG1 3.43Å; S176-I179 WeakPolarHBondContact O-CB 3.42Å; S176-I179 PolarHBondContact O-N 3.48Å; S176-I179 VanDerWaalsContact O-N 3.08Å; S177-I179 VanDerWaalsContact C-N 3.28Å; S177-I179 PolarHBondContact O-N 3.24Å; I179-D181 VanDerWaalsContact C-N 3.32Å |
| 180 | I | 84.9 | Confident | 91.6 | Very high | 24 Ų | 24 | 41.4 Ų | 41.4 | 12% | 0.123 | 21% | 0.21 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -95.7 | 14.8 | 177.8 | 73.1 | -151.4 | 0 | 0 | 0 | 112.8 | C144 I148 S176 I182 | C144-I180 HydrophobicContact CB-CG2 4.38Å; I148-I180 HydrophobicContact CD1-CB 3.87Å; I148-I180 HydrophobicContact CD1-CD1 3.49Å; I148-I180 VanDerWaalsContact CD1-CD1 3.49Å; I148-I180 HydrophobicContact CD1-CG1 3.69Å; I148-I180 HydrophobicContact CD1-CG2 4.34Å; S176-I180 WeakPolarHBondContact O-CD1 3.31Å; S176-I180 WeakPolarHBondContact O-CG1 3.39Å; S176-I180 PolarHBondContact O-N 3.4Å; I180-I182 VanDerWaalsContact C-N 3.34Å; I180-I182 HydrophobicContact CD1-CD1 3.69Å; I180-I182 HydrophobicContact CD1-CG1 4.2Å; I180-I182 HydrophobicContact CG1-CD1 3.83Å; I180-I182 HydrophobicContact CG1-CG1 3.74Å; I180-I182 PolarHBondContact O-N 3Å |
| 181 | D | 86 | Confident | 91.9 | Very high | 72 Ų | 72 | 38.6 Ų | 38.6 | 39% | 0.385 | 20% | 0.195 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 56.3 | 38.3 | 176.2 | -60.3 | -30.1 | 0 | 0 | 0 | 114.4 | R145 S177 I179 P183 | R145-D181 IonicContact CZ-OD1 3.56Å; R145-D181 IonicContact CZ-OD2 2.95Å; R145-D181 IonicContact NE-OD2 3.48Å; R145-D181 PolarHBondContact NE-OD2 2.88Å; R145-D181 IonicContact NH1-OD1 3.92Å; R145-D181 IonicContact NH1-OD2 2.85Å; R145-D181 PolarHBondContact NH1-OD2 3.09Å; R145-D181 VanDerWaalsContact NH2-CG 3.31Å; R145-D181 IonicContact NH2-OD1 2.91Å; R145-D181 PolarHBondContact NH2-OD1 3.17Å; R145-D181 IonicContact NH2-OD2 3.17Å; R145-D181 PolarHBondContact NH2-OD2 2.72Å; S177-D181 PolarHBondContact O-N 2.88Å; I179-D181 VanDerWaalsContact C-N 3.32Å; D181-P183 WeakPolarHBondContact O-CD 3.32Å |
| 182 | I | 89.9 | Confident | 92.3 | Very high | 4 Ų | 4 | 35.7 Ų | 35.7 | 2% | 0.021 | 19% | 0.186 | C | C | . | . | trans | -70.1 | 124.3 | 171.1 | -69.2 | 175.6 | 0 | 0 | 0 | 109 | Y122 I148 I159 S177 I180 L184 H186 F187 | Y122-I182 WeakPolarHBondContact CE2-O 3.36Å; Y122-I182 PolarHBondContact OH-O 3.24Å; I148-I182 HydrophobicContact CG2-CG1 4.37Å; I159-I182 HydrophobicContact CD1-CD1 3.8Å; I159-I182 HydrophobicContact CG1-CD1 4.37Å; I159-I182 HydrophobicContact CG1-CG2 4.42Å; S177-I182 PolarHBondContact O-N 3.48Å; I180-I182 VanDerWaalsContact C-N 3.34Å; I180-I182 HydrophobicContact CD1-CD1 3.69Å; I180-I182 HydrophobicContact CD1-CG1 4.2Å; I180-I182 HydrophobicContact CG1-CD1 3.83Å; I180-I182 HydrophobicContact CG1-CG1 3.74Å; I180-I182 PolarHBondContact O-N 3Å; I182-L184 PolarHBondContact O-N 3.2Å; I182-H186 HydrophobicContact CG2-CB 4.36Å; I182-F187 HydrophobicContact CG2-CB 4.19Å | ||
| 183 | P | 92 | Very high | 92.6 | Very high | 39 Ų | 39 | 35.8 Ų | 35.8 | 25% | 0.253 | 19% | 0.189 | S | C | . | . | trans | -59.4 | 133.9 | 179.6 | -20.7 | 31 | 0 | 0 | 0 | 111.7 | M155 D181 V185 H186 F187 | M155-P183 WeakPolarHBondContact SD-CD 3.39Å; M155-P183 HydrophobicContact SD-CG 4.17Å; D181-P183 WeakPolarHBondContact O-CD 3.32Å; P183-V185 PolarHBondContact O-N 3.45Å; P183-H186 PolarHBondContact O-N 3.21Å; P183-F187 PolarHBondContact O-N 3.43Å; P183-F187 VanDerWaalsContact O-N 3.14Å | ||
| 184 | L | 94.2 | Very high | 92.7 | Very high | 62 Ų | 62 | 35.7 Ų | 35.7 | 33% | 0.325 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -50.8 | -35.3 | -176.8 | -178.9 | 62.8 | 0 | 0 | 0 | 113.4 | Y122 L123 I182 F187 F188 | Y122-L184 HydrophobicContact CD1-CD1 3.73Å; Y122-L184 HydrophobicContact CE1-CB 4.4Å; Y122-L184 HydrophobicContact CE1-CD1 4.14Å; Y122-L184 HydrophobicContact CG-CD1 4.06Å; L123-L184 HydrophobicContact CD2-CD2 4.22Å; I182-L184 PolarHBondContact O-N 3.2Å; L184-F187 HydrophobicContact CD1-CD1 4.35Å; L184-F187 PolarHBondContact O-N 3.29Å; L184-F188 VanDerWaalsContact O-CB 3.3Å; L184-F188 WeakPolarHBondContact O-CB 3.45Å; L184-F188 PolarHBondContact O-N 3.03Å |
| 185 | V | 95.1 | Very high | 92.7 | Very high | 94 Ų | 94 | 36 Ų | 36 | 57% | 0.57 | 19% | 0.191 | S | C | * | . | H | α-helix | trans | -61.8 | -47.1 | 177.9 | 179.4 | 0 | 0 | 0 | 0 | 111.6 | P183 F187 F188 F189 | P183-V185 PolarHBondContact O-N 3.45Å; V185-F187 VanDerWaalsContact C-N 3.32Å; V185-F187 PolarHBondContact O-N 3.05Å; V185-F188 PolarHBondContact O-N 3.2Å; V185-F189 HydrophobicContact CG1-CD2 3.78Å; V185-F189 HydrophobicContact CG1-CE2 3.87Å; V185-F189 VanDerWaalsContact O-CD2 3.29Å; V185-F189 WeakPolarHBondContact O-CD2 3.47Å; V185-F189 PolarHBondContact O-N 2.93Å; V185-F189 VanDerWaalsContact O-N 3.07Å |
| 186 | H | 94.2 | Very high | 93 | Very high | 60 Ų | 60 | 35.6 Ų | 35.6 | 28% | 0.278 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -66.9 | -38.5 | 178.3 | -65.5 | 83.5 | 0 | 0 | 0 | 110.8 | M155 I182 P183 G190 | M155-H186 HydrophobicContact CB-CB 4.1Å; I182-H186 HydrophobicContact CG2-CB 4.36Å; P183-H186 PolarHBondContact O-N 3.21Å; H186-G190 WeakPolarHBondContact O-CA 3.24Å; H186-G190 PolarHBondContact O-N 3.26Å |
| 187 | F | 95.2 | Very high | 93.2 | Very high | 0 Ų | 0 | 36.4 Ų | 36.4 | 0% | 0 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -64.3 | -44.8 | 175.6 | 177.3 | -91 | 0 | 0 | 0 | 112.5 | A118 Y122 I159 R163 V173 N174 S177 I182 P183 L184 V185 T191 | A118-F187 HydrophobicContact CB-CE1 3.78Å; A118-F187 HydrophobicContact CB-CZ 3.85Å; A118-F187 WeakPolarHBondContact O-CE1 3.43Å; Y122-F187 HydrophobicContact CD2-CB 4.48Å; Y122-F187 HydrophobicContact CD2-CD1 4.09Å; Y122-F187 HydrophobicContact CD2-CD2 4.13Å; Y122-F187 HydrophobicContact CD2-CE1 4.33Å; Y122-F187 HydrophobicContact CD2-CE2 4.34Å; Y122-F187 AromaticContact CD2-CG 3.97Å; Y122-F187 HydrophobicContact CD2-CG 3.97Å; Y122-F187 HydrophobicContact CD2-CZ 4.42Å; Y122-F187 HydrophobicContact CG-CD1 4.43Å; Y122-F187 HydrophobicContact CG-CE1 4.48Å; I159-F187 HydrophobicContact CD1-CD2 4.03Å; R163-F187 VanDerWaalsContact NH2-CE2 3.32Å; V173-F187 HydrophobicContact CG1-CE2 4.22Å; N174-F187 HydrophobicContact CB-CZ 4.46Å; S177-F187 VanDerWaalsContact CB-CD2 3.45Å; S177-F187 VanDerWaalsContact OG-CD2 3.25Å; S177-F187 WeakPolarHBondContact OG-CD2 3.33Å; S177-F187 WeakPolarHBondContact OG-CE2 3.46Å; I182-F187 HydrophobicContact CG2-CB 4.19Å; P183-F187 PolarHBondContact O-N 3.43Å; P183-F187 VanDerWaalsContact O-N 3.14Å; L184-F187 HydrophobicContact CD1-CD1 4.35Å; L184-F187 PolarHBondContact O-N 3.29Å; V185-F187 VanDerWaalsContact C-N 3.32Å; V185-F187 PolarHBondContact O-N 3.05Å; F187-T191 WeakPolarHBondContact O-CB 3.48Å; F187-T191 PolarHBondContact O-N 3.48Å; F187-T191 PolarHBondContact O-OG1 2.82Å |
| 188 | F | 97.3 | Very high | 93.2 | Very high | 48 Ų | 48 | 38.2 Ų | 38.2 | 21% | 0.211 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -63.9 | -56.1 | -179.3 | 179.4 | -88.9 | 0 | 0 | 0 | 110.8 | L112 A115 I116 S119 L184 V185 G190 T191 F192 | L112-F188 HydrophobicContact CD1-CZ 4.22Å; A115-F188 HydrophobicContact CB-CD2 3.8Å; A115-F188 HydrophobicContact CB-CE1 4.36Å; A115-F188 HydrophobicContact CB-CE2 3.59Å; A115-F188 HydrophobicContact CB-CG 4.29Å; A115-F188 HydrophobicContact CB-CZ 3.89Å; I116-F188 HydrophobicContact CG1-CE2 4Å; S119-F188 WeakPolarHBondContact OG-CD2 3.32Å; L184-F188 VanDerWaalsContact O-CB 3.3Å; L184-F188 WeakPolarHBondContact O-CB 3.45Å; L184-F188 PolarHBondContact O-N 3.03Å; V185-F188 PolarHBondContact O-N 3.2Å; F188-G190 PolarHBondContact O-N 3.06Å; F188-T191 PolarHBondContact O-N 3.14Å; F188-F192 WeakPolarHBondContact O-CB 3.22Å; F188-F192 PolarHBondContact O-N 2.91Å |
| 189 | F | 97 | Very high | 93.4 | Very high | 112 Ų | 112 | 38.7 Ų | 38.7 | 49% | 0.491 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -68.2 | -37.6 | -179.2 | -73.1 | -67.5 | 0 | 0 | 0 | 112 | F156 V185 T191 F192 V193 | F156-F189 HydrophobicContact CD2-CB 3.99Å; F156-F189 VanDerWaalsContact CE2-C 3.46Å; F156-F189 HydrophobicContact CE2-CB 3.87Å; F156-F189 WeakPolarHBondContact CE2-O 3.32Å; V185-F189 HydrophobicContact CG1-CD2 3.78Å; V185-F189 HydrophobicContact CG1-CE2 3.87Å; V185-F189 VanDerWaalsContact O-CD2 3.29Å; V185-F189 WeakPolarHBondContact O-CD2 3.47Å; V185-F189 PolarHBondContact O-N 2.93Å; V185-F189 VanDerWaalsContact O-N 3.07Å; F189-T191 VanDerWaalsContact C-N 3.29Å; F189-T191 PolarHBondContact O-N 3.05Å; F189-F192 PolarHBondContact O-N 2.86Å; F189-V193 PolarHBondContact O-N 3.42Å |
| 190 | G | 95.9 | Very high | 93.8 | Very high | 0 Ų | 0 | 40.1 Ų | 40.1 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -63 | -37.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | C160 H186 F188 G194 | C160-G190 PolarHBondContact SG-O 3.21Å; C160-G190 VanDerWaalsContact SG-O 3.39Å; H186-G190 WeakPolarHBondContact O-CA 3.24Å; H186-G190 PolarHBondContact O-N 3.26Å; F188-G190 PolarHBondContact O-N 3.06Å; G190-G194 WeakPolarHBondContact O-CA 3.35Å; G190-G194 PolarHBondContact O-N 2.85Å |
| 191 | T | 96.8 | Very high | 94.2 | Very high | 1 Ų | 1 | 39.9 Ų | 39.9 | 1% | 0.006 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -70.9 | -45.3 | 173.9 | -59.8 | 0 | 0 | 0 | 0 | 111.1 | A118 R163 F187 F188 F189 V193 G194 V195 | A118-T191 HydrophobicContact CB-CG2 4.01Å; R163-T191 PolarHBondContact NE-OG1 3.37Å; R163-T191 PolarHBondContact NH2-OG1 3.18Å; F187-T191 WeakPolarHBondContact O-CB 3.48Å; F187-T191 PolarHBondContact O-N 3.48Å; F187-T191 PolarHBondContact O-OG1 2.82Å; F188-T191 PolarHBondContact O-N 3.14Å; F189-T191 VanDerWaalsContact C-N 3.29Å; F189-T191 PolarHBondContact O-N 3.05Å; T191-V193 VanDerWaalsContact C-N 3.28Å; T191-V193 PolarHBondContact O-N 2.88Å; T191-G194 PolarHBondContact O-N 3.37Å; T191-V195 HydrophobicContact CG2-CG1 3.88Å; T191-V195 WeakPolarHBondContact O-CG1 3.4Å; T191-V195 VanDerWaalsContact O-CG2 3.24Å; T191-V195 WeakPolarHBondContact O-CG2 3.45Å; T191-V195 PolarHBondContact O-N 2.88Å; T191-V195 VanDerWaalsContact O-N 3.11Å |
| 192 | F | 97.4 | Very high | 94.6 | Very high | 62 Ų | 62 | 39.9 Ų | 39.9 | 27% | 0.272 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -53.9 | -44.4 | 178.7 | -178.4 | -98.6 | 0 | 0 | 0 | 112.1 | A111 L112 A115 F188 F189 V196 | A111-F192 HydrophobicContact CB-CD2 3.8Å; A111-F192 HydrophobicContact CB-CE2 3.7Å; A111-F192 HydrophobicContact CB-CG 4.39Å; A111-F192 HydrophobicContact CB-CZ 4.23Å; A111-F192 WeakPolarHBondContact CB-O 3.41Å; L112-F192 HydrophobicContact CB-CE2 4.1Å; L112-F192 HydrophobicContact CD1-CE2 4.42Å; A115-F192 HydrophobicContact CB-CB 3.92Å; A115-F192 HydrophobicContact CB-CD2 4.32Å; F188-F192 WeakPolarHBondContact O-CB 3.22Å; F188-F192 PolarHBondContact O-N 2.91Å; F189-F192 PolarHBondContact O-N 2.86Å; F192-V196 WeakPolarHBondContact O-CG2 3.38Å |
| 193 | V | 96.4 | Very high | 95 | Very high | 72 Ų | 72 | 39.7 Ų | 39.7 | 44% | 0.436 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -81.7 | -45.2 | 178.2 | 177.4 | 0 | 0 | 0 | 0 | 111.6 | F156 F189 T191 V195 V196 | F156-V193 HydrophobicContact CE2-CG2 4.31Å; F156-V193 HydrophobicContact CZ-CB 4.29Å; F156-V193 HydrophobicContact CZ-CG2 4.12Å; F189-V193 PolarHBondContact O-N 3.42Å; T191-V193 VanDerWaalsContact C-N 3.28Å; T191-V193 PolarHBondContact O-N 2.88Å; V193-V195 VanDerWaalsContact C-N 3.33Å; V193-V195 PolarHBondContact O-N 3.48Å; V193-V196 WeakPolarHBondContact O-CB 3.42Å; V193-V196 PolarHBondContact O-N 2.91Å |
| 194 | G | 94 | Very high | 95.1 | Very high | 0 Ų | 0 | 39.2 Ų | 39.2 | 0% | 0 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -68.1 | -25.5 | -170.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | R163 I164 G190 T191 P197 | R163-G194 CarbonylContact C-O 3.27Å; R163-G194 VanDerWaalsContact CB-C 3.44Å; R163-G194 WeakPolarHBondContact CB-O 3.38Å; I164-G194 VanDerWaalsContact CG1-O 3.27Å; I164-G194 WeakPolarHBondContact CG1-O 3.39Å; I164-G194 PolarHBondContact N-O 3.46Å; G190-G194 WeakPolarHBondContact O-CA 3.35Å; G190-G194 PolarHBondContact O-N 2.85Å; T191-G194 PolarHBondContact O-N 3.37Å; G194-P197 WeakPolarHBondContact O-CD 3.45Å |
| 195 | V | 95 | Very high | 95.1 | Very high | 9 Ų | 9 | 37.7 Ų | 37.7 | 6% | 0.055 | 20% | 0.2 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -77.8 | -23.4 | 177.5 | -62.1 | 0 | 0 | 0 | 0 | 113 | A111 R163 T191 V193 L198 S199 | A111-V195 HydrophobicContact CB-CG2 4.44Å; R163-V195 HydrophobicContact CB-CG1 4.25Å; R163-V195 HydrophobicContact CG-CG1 4.35Å; T191-V195 HydrophobicContact CG2-CG1 3.88Å; T191-V195 WeakPolarHBondContact O-CG1 3.4Å; T191-V195 VanDerWaalsContact O-CG2 3.24Å; T191-V195 WeakPolarHBondContact O-CG2 3.45Å; T191-V195 PolarHBondContact O-N 2.88Å; T191-V195 VanDerWaalsContact O-N 3.11Å; V193-V195 VanDerWaalsContact C-N 3.33Å; V193-V195 PolarHBondContact O-N 3.48Å; V195-L198 PolarHBondContact O-N 3.32Å; V195-S199 WeakPolarHBondContact O-CB 3.34Å; V195-S199 PolarHBondContact O-N 3.24Å; V195-S199 PolarHBondContact O-OG 3.38Å; V195-S199 VanDerWaalsContact O-OG 3.05Å |
| 196 | V | 95.2 | Very high | 95.1 | Very high | 36 Ų | 36 | 33.2 Ų | 33.2 | 22% | 0.218 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -53.2 | -51.2 | -171.9 | 173 | 0 | 0 | 0 | 0 | 111.9 | V107 A111 F192 V193 L198 S199 L200 | V107-V196 HydrophobicContact CG1-CG1 3.98Å; V107-V196 HydrophobicContact CG1-CG2 4.49Å; A111-V196 HydrophobicContact CB-CG2 4.01Å; F192-V196 WeakPolarHBondContact O-CG2 3.38Å; V193-V196 WeakPolarHBondContact O-CB 3.42Å; V193-V196 PolarHBondContact O-N 2.91Å; V196-L198 VanDerWaalsContact C-N 3.35Å; V196-L198 PolarHBondContact O-N 2.9Å; V196-S199 PolarHBondContact O-N 2.84Å; V196-S199 VanDerWaalsContact O-N 3.09Å; V196-L200 HydrophobicContact CG1-CD1 4.33Å; V196-L200 HydrophobicContact CG1-CD2 4.41Å; V196-L200 HydrophobicContact CG1-CG 4.17Å; V196-L200 WeakPolarHBondContact O-CG 3.28Å; V196-L200 PolarHBondContact O-N 3.29Å |
| 197 | P | 92.5 | Very high | 95 | Very high | 53 Ų | 53 | 31.5 Ų | 31.5 | 34% | 0.344 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -58.3 | -43.4 | -173.9 | -28.9 | 40.3 | 0 | 0 | 0 | 113.8 | I164 G194 | I164-P197 HydrophobicContact CD1-CG 4.35Å; I164-P197 HydrophobicContact CG1-CG 3.99Å; G194-P197 WeakPolarHBondContact O-CD 3.45Å |
| 198 | L | 91.1 | Very high | 94.9 | Very high | 40 Ų | 40 | 32 Ų | 32 | 21% | 0.209 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -73 | -37.8 | 177.5 | -176.3 | 59.8 | 0 | 0 | 0 | 111.4 | V195 V196 L200 V201 F202 | V195-L198 PolarHBondContact O-N 3.32Å; V196-L198 VanDerWaalsContact C-N 3.35Å; V196-L198 PolarHBondContact O-N 2.9Å; L198-L200 VanDerWaalsContact C-N 3.29Å; L198-L200 PolarHBondContact O-N 3.36Å; L198-V201 PolarHBondContact O-N 2.94Å; L198-F202 HydrophobicContact CD1-CE2 3.98Å; L198-F202 HydrophobicContact CG-CE2 3.94Å; L198-F202 WeakPolarHBondContact O-CD2 3.49Å |
| 199 | S | 94.3 | Very high | 94.6 | Very high | 14 Ų | 14 | 30.5 Ų | 30.5 | 10% | 0.098 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -62.2 | -32.7 | 176.2 | -65.3 | 0 | 0 | 0 | 0 | 113.1 | V110 V195 V196 V201 F202 I203 | V110-S199 WeakPolarHBondContact CG1-OG 3.47Å; V195-S199 WeakPolarHBondContact O-CB 3.34Å; V195-S199 PolarHBondContact O-N 3.24Å; V195-S199 PolarHBondContact O-OG 3.38Å; V195-S199 VanDerWaalsContact O-OG 3.05Å; V196-S199 PolarHBondContact O-N 2.84Å; V196-S199 VanDerWaalsContact O-N 3.09Å; S199-V201 PolarHBondContact O-N 3.19Å; S199-F202 PolarHBondContact O-N 2.9Å; S199-I203 WeakPolarHBondContact O-CB 3.39Å; S199-I203 WeakPolarHBondContact O-CG1 3.41Å; S199-I203 PolarHBondContact O-N 3.3Å |
| 200 | L | 95.5 | Very high | 94.4 | Very high | 41 Ų | 41 | 27.9 Ų | 27.9 | 22% | 0.215 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -56.2 | -38.5 | 178 | -69.6 | 172.2 | 0 | 0 | 0 | 112.3 | F103 V107 V196 L198 K204 L229 | F103-L200 HydrophobicContact CE1-CD2 3.78Å; F103-L200 HydrophobicContact CZ-CD2 3.54Å; V107-L200 HydrophobicContact CG1-CD2 4.43Å; V107-L200 HydrophobicContact CG2-CD2 3.58Å; V196-L200 HydrophobicContact CG1-CD1 4.33Å; V196-L200 HydrophobicContact CG1-CD2 4.41Å; V196-L200 HydrophobicContact CG1-CG 4.17Å; V196-L200 WeakPolarHBondContact O-CG 3.28Å; V196-L200 PolarHBondContact O-N 3.29Å; L198-L200 VanDerWaalsContact C-N 3.29Å; L198-L200 PolarHBondContact O-N 3.36Å; L200-K204 WeakPolarHBondContact O-CB 3.21Å; L200-K204 PolarHBondContact O-N 3.48Å; L200-L229 HydrophobicContact CB-CD1 4.22Å; L200-L229 HydrophobicContact CB-CD2 4.2Å; L200-L229 HydrophobicContact CD1-CD2 4.36Å |
| 201 | V | 93.9 | Very high | 94.1 | Very high | 18 Ų | 18 | 29.3 Ų | 29.3 | 11% | 0.109 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -61.3 | -50.8 | 177.9 | -174.1 | 0 | 0 | 0 | 0 | 110.5 | L198 S199 K204 A205 L229 A230 | L198-V201 PolarHBondContact O-N 2.94Å; S199-V201 PolarHBondContact O-N 3.19Å; V201-K204 PolarHBondContact O-N 3.47Å; V201-A205 WeakPolarHBondContact O-CB 3.39Å; V201-A205 PolarHBondContact O-N 2.86Å; V201-L229 HydrophobicContact CG2-CB 4.04Å; V201-L229 WeakPolarHBondContact CG2-O 3.31Å; V201-A230 HydrophobicContact CG1-CB 4.2Å |
| 202 | F | 94.5 | Very high | 93.7 | Very high | 73 Ų | 73 | 32.5 Ų | 32.5 | 32% | 0.32 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -71.6 | -36.4 | -176.7 | -64.1 | -65.4 | 0 | 0 | 0 | 112.8 | V91 V94 I95 L198 S199 A205 G206 | V91-F202 HydrophobicContact CG2-CD1 3.48Å; V91-F202 VanDerWaalsContact CG2-CD1 3.48Å; V91-F202 HydrophobicContact CG2-CD2 4.26Å; V91-F202 HydrophobicContact CG2-CE1 3.61Å; V91-F202 HydrophobicContact CG2-CE2 4.35Å; V91-F202 HydrophobicContact CG2-CG 3.83Å; V91-F202 HydrophobicContact CG2-CZ 4.05Å; V94-F202 HydrophobicContact CB-CB 4.24Å; V94-F202 HydrophobicContact CG1-CB 3.58Å; I95-F202 HydrophobicContact CG1-CB 4.2Å; L198-F202 HydrophobicContact CD1-CE2 3.98Å; L198-F202 HydrophobicContact CG-CE2 3.94Å; L198-F202 WeakPolarHBondContact O-CD2 3.49Å; S199-F202 PolarHBondContact O-N 2.9Å; F202-A205 WeakPolarHBondContact O-CB 3.31Å; F202-A205 PolarHBondContact O-N 3.49Å; F202-G206 PolarHBondContact O-N 2.98Å; F202-G206 VanDerWaalsContact O-N 3.09Å |
| 203 | I | 96.7 | Very high | 93.1 | Very high | 0 Ų | 0 | 30.7 Ų | 30.7 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -64.1 | -46.2 | 173.5 | -65.5 | 166.5 | 0 | 0 | 0 | 109.4 | V94 F103 A106 V107 V110 S199 A205 G206 T207 | V94-I203 HydrophobicContact CG1-CD1 4.5Å; V94-I203 HydrophobicContact CG1-CG1 3.64Å; F103-I203 HydrophobicContact CD2-CG2 3.56Å; F103-I203 HydrophobicContact CE2-CB 4.16Å; F103-I203 HydrophobicContact CE2-CG2 3.64Å; F103-I203 HydrophobicContact CG-CG2 4.42Å; A106-I203 HydrophobicContact CB-CG2 3.76Å; V107-I203 HydrophobicContact CB-CD1 4.23Å; V107-I203 HydrophobicContact CG2-CD1 3.65Å; V110-I203 HydrophobicContact CB-CD1 4.15Å; V110-I203 HydrophobicContact CG1-CD1 4.46Å; V110-I203 HydrophobicContact CG2-CD1 3.98Å; V110-I203 HydrophobicContact CG2-CG1 4.18Å; S199-I203 WeakPolarHBondContact O-CB 3.39Å; S199-I203 WeakPolarHBondContact O-CG1 3.41Å; S199-I203 PolarHBondContact O-N 3.3Å; I203-A205 VanDerWaalsContact C-N 3.28Å; I203-A205 PolarHBondContact O-N 2.92Å; I203-G206 WeakPolarHBondContact O-CA 3.27Å; I203-G206 PolarHBondContact O-N 3.25Å; I203-T207 PolarHBondContact O-N 2.94Å; I203-T207 PolarHBondContact O-OG1 3.27Å |
| 204 | K | 95.4 | Very high | 92.6 | Very high | 28 Ų | 28 | 31.7 Ų | 31.7 | 12% | 0.122 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -63.8 | -35.5 | 177.5 | -169.8 | 71.3 | -153.5 | -171.7 | 0 | 111.6 | F103 L200 V201 G206 T207 V208 S222 T225 L226 L229 | F103-K204 HydrophobicContact CD2-CD 4.47Å; F103-K204 HydrophobicContact CE2-CB 4Å; F103-K204 HydrophobicContact CE2-CD 4.1Å; L200-K204 WeakPolarHBondContact O-CB 3.21Å; L200-K204 PolarHBondContact O-N 3.48Å; V201-K204 PolarHBondContact O-N 3.47Å; K204-G206 VanDerWaalsContact C-N 3.27Å; K204-G206 PolarHBondContact O-N 3.36Å; K204-T207 PolarHBondContact O-N 3.02Å; K204-V208 HydrophobicContact CG-CG2 4.49Å; K204-V208 WeakPolarHBondContact O-CG2 3.39Å; K204-V208 PolarHBondContact O-N 2.97Å; K204-S222 PolarHBondContact NZ-OG 2.88Å; K204-T225 WeakPolarHBondContact CE-OG1 3.33Å; K204-T225 PolarHBondContact NZ-OG1 3.23Å; K204-L226 HydrophobicContact CB-CD1 3.97Å; K204-L226 HydrophobicContact CG-CB 4.17Å; K204-L226 HydrophobicContact CG-CD1 3.99Å; K204-L229 HydrophobicContact CB-CD1 3.93Å; K204-L229 HydrophobicContact CG-CD1 4.17Å |
| 205 | A | 93.8 | Very high | 92.1 | Very high | 31 Ų | 31 | 37.9 Ų | 37.9 | 26% | 0.256 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -59.6 | -39.9 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | V201 F202 I203 V208 L209 L226 | V201-A205 WeakPolarHBondContact O-CB 3.39Å; V201-A205 PolarHBondContact O-N 2.86Å; F202-A205 WeakPolarHBondContact O-CB 3.31Å; F202-A205 PolarHBondContact O-N 3.49Å; I203-A205 VanDerWaalsContact C-N 3.28Å; I203-A205 PolarHBondContact O-N 2.92Å; A205-V208 PolarHBondContact O-N 3.05Å; A205-L209 WeakPolarHBondContact O-CB 3.17Å; A205-L209 PolarHBondContact O-N 3.41Å; A205-L226 HydrophobicContact CB-CD1 3.86Å; A205-L226 VanDerWaalsContact N-CD1 3.32Å |
| 206 | G | 94.5 | Very high | 91.5 | Very high | 0 Ų | 0 | 40.1 Ų | 40.1 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -61 | -45.9 | 172.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | I95 G98 Y99 F202 I203 K204 L209 Q210 | I95-G206 WeakPolarHBondContact O-CA 3.25Å; G98-G206 CarbonylContact O-C 3.57Å; Y99-G206 WeakPolarHBondContact CA-O 3.31Å; F202-G206 PolarHBondContact O-N 2.98Å; F202-G206 VanDerWaalsContact O-N 3.09Å; I203-G206 WeakPolarHBondContact O-CA 3.27Å; I203-G206 PolarHBondContact O-N 3.25Å; K204-G206 VanDerWaalsContact C-N 3.27Å; K204-G206 PolarHBondContact O-N 3.36Å; G206-L209 WeakPolarHBondContact O-CB 3.49Å; G206-L209 PolarHBondContact O-N 2.96Å; G206-Q210 PolarHBondContact O-N 2.7Å |
| 207 | T | 93.1 | Very high | 90.8 | Very high | 24 Ų | 24 | 43 Ų | 43 | 15% | 0.147 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -63.5 | -43.2 | 177.4 | -49.7 | 0 | 0 | 0 | 0 | 112 | G98 I203 K204 L209 Q210 E211 | G98-T207 WeakPolarHBondContact O-CA 3.28Å; G98-T207 PolarHBondContact O-N 3.45Å; G98-T207 PolarHBondContact O-OG1 3.08Å; I203-T207 PolarHBondContact O-N 2.94Å; I203-T207 PolarHBondContact O-OG1 3.27Å; K204-T207 PolarHBondContact O-N 3.02Å; T207-L209 VanDerWaalsContact C-N 3.3Å; T207-L209 PolarHBondContact O-N 3.43Å; T207-Q210 PolarHBondContact O-N 3.35Å; T207-E211 PolarHBondContact O-N 2.98Å |
| 208 | V | 92.2 | Very high | 90.3 | Very high | 11 Ų | 11 | 42.6 Ų | 42.6 | 7% | 0.067 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -61.9 | -40.4 | 174.8 | 169.9 | 0 | 0 | 0 | 0 | 110.5 | K204 A205 Q210 E211 L212 T218 L226 | K204-V208 HydrophobicContact CG-CG2 4.49Å; K204-V208 WeakPolarHBondContact O-CG2 3.39Å; K204-V208 PolarHBondContact O-N 2.97Å; A205-V208 PolarHBondContact O-N 3.05Å; V208-Q210 VanDerWaalsContact C-N 3.35Å; V208-E211 PolarHBondContact O-N 3.03Å; V208-L212 WeakPolarHBondContact O-CG 3.35Å; V208-L212 PolarHBondContact O-N 3.41Å; V208-T218 HydrophobicContact CB-CG2 4.41Å; V208-T218 HydrophobicContact CG1-CG2 3.55Å; V208-T218 WeakPolarHBondContact O-CG2 3.35Å; V208-L226 HydrophobicContact CG2-CB 4.24Å; V208-L226 HydrophobicContact CG2-CD2 4.42Å |
| 209 | L | 91.4 | Very high | 90.1 | Very high | 15 Ų | 15 | 43.1 Ų | 43.1 | 8% | 0.079 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -63.6 | -40 | 176.2 | -175.8 | 62.9 | 0 | 0 | 0 | 111.7 | V50 L53 K54 I95 Y99 A205 G206 T207 L212 T213 | V50-L209 HydrophobicContact CG1-CD1 3.85Å; L53-L209 HydrophobicContact CD2-CD2 4.27Å; L53-L209 HydrophobicContact CG-CD2 4.1Å; K54-L209 HydrophobicContact CB-CD1 4.21Å; K54-L209 HydrophobicContact CG-CD1 4.44Å; I95-L209 HydrophobicContact CG2-CD2 4.5Å; Y99-L209 HydrophobicContact CD2-CB 4.07Å; Y99-L209 HydrophobicContact CD2-CD2 4.09Å; Y99-L209 HydrophobicContact CD2-CG 3.94Å; Y99-L209 HydrophobicContact CE2-CB 4.46Å; Y99-L209 HydrophobicContact CE2-CD2 4.44Å; Y99-L209 HydrophobicContact CE2-CG 4.02Å; A205-L209 WeakPolarHBondContact O-CB 3.17Å; A205-L209 PolarHBondContact O-N 3.41Å; G206-L209 WeakPolarHBondContact O-CB 3.49Å; G206-L209 PolarHBondContact O-N 2.96Å; T207-L209 VanDerWaalsContact C-N 3.3Å; T207-L209 PolarHBondContact O-N 3.43Å; L209-L212 PolarHBondContact O-N 2.93Å; L209-T213 PolarHBondContact O-N 2.96Å; L209-T213 PolarHBondContact O-OG1 3.29Å |
| 210 | Q | 92.2 | Very high | 89.7 | Confident | 57 Ų | 57 | 49.4 Ų | 49.4 | 27% | 0.266 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -65 | -43.2 | 175.4 | 179.9 | -90.4 | -14.3 | 0 | 0 | 112.1 | Y99 G206 T207 V208 L212 T213 D214 | Y99-Q210 HydrophobicContact CD1-CB 4.3Å; Y99-Q210 HydrophobicContact CD1-CG 4.5Å; Y99-Q210 HydrophobicContact CD2-CB 3.65Å; Y99-Q210 HydrophobicContact CE1-CB 4.34Å; Y99-Q210 HydrophobicContact CE1-CG 4.29Å; Y99-Q210 HydrophobicContact CE2-CB 3.73Å; Y99-Q210 HydrophobicContact CE2-CG 4.42Å; Y99-Q210 HydrophobicContact CG-CB 3.94Å; G206-Q210 PolarHBondContact O-N 2.7Å; T207-Q210 PolarHBondContact O-N 3.35Å; V208-Q210 VanDerWaalsContact C-N 3.35Å; Q210-L212 VanDerWaalsContact C-N 3.34Å; Q210-L212 PolarHBondContact O-N 3.43Å; Q210-T213 WeakPolarHBondContact O-CB 3.48Å; Q210-T213 PolarHBondContact O-N 2.7Å; Q210-D214 PolarHBondContact NE2-OD2 2.64Å; Q210-D214 PolarHBondContact O-N 3.48Å |
| 211 | E | 89.7 | Confident | 89.3 | Confident | 30 Ų | 30 | 50.5 Ų | 50.5 | 14% | 0.14 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -59 | -44.2 | 174.2 | -72.1 | 177 | -154.5 | 0 | 0 | 111.9 | T207 V208 T213 D214 L215 V217 T218 S219 S222 | T207-E211 PolarHBondContact O-N 2.98Å; V208-E211 PolarHBondContact O-N 3.03Å; E211-T213 PolarHBondContact O-N 2.96Å; E211-D214 PolarHBondContact O-N 3.14Å; E211-L215 PolarHBondContact O-N 2.94Å; E211-V217 CarbonylContact C-O 3.57Å; E211-T218 HydrophobicContact CB-CG2 3.98Å; E211-S219 PolarHBondContact OE2-N 3.44Å; E211-S219 PolarHBondContact OE2-OG 3.49Å; E211-S222 WeakPolarHBondContact OE1-CB 3.36Å; E211-S222 PolarHBondContact OE1-OG 3.12Å; E211-S222 WeakPolarHBondContact OE2-CB 3.35Å; E211-S222 PolarHBondContact OE2-OG 3.01Å |
| 212 | L | 88.2 | Confident | 88.8 | Confident | 68 Ų | 68 | 50.1 Ų | 50.1 | 36% | 0.356 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -62.2 | -31.8 | 174.7 | -71.6 | 177 | 0 | 0 | 0 | 112.7 | V208 L209 Q210 G216 T218 | V208-L212 WeakPolarHBondContact O-CG 3.35Å; V208-L212 PolarHBondContact O-N 3.41Å; L209-L212 PolarHBondContact O-N 2.93Å; Q210-L212 VanDerWaalsContact C-N 3.34Å; Q210-L212 PolarHBondContact O-N 3.43Å; L212-G216 VanDerWaalsContact O-CA 3.27Å; L212-G216 WeakPolarHBondContact O-CA 3.43Å; L212-G216 PolarHBondContact O-N 2.89Å; L212-T218 HydrophobicContact CB-CG2 4.42Å; L212-T218 HydrophobicContact CD1-CG2 4.26Å; L212-T218 HydrophobicContact CD2-CG2 3.39Å; L212-T218 HydrophobicContact CG-CG2 3.36Å |
| 213 | T | 86.7 | Confident | 88.5 | Confident | 25 Ų | 25 | 51.2 Ų | 51.2 | 15% | 0.153 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -72.1 | -48.9 | 177.9 | -59.2 | 0 | 0 | 0 | 0 | 111.8 | K54 L58 Y99 L209 Q210 E211 | K54-T213 WeakPolarHBondContact CE-OG1 3.23Å; K54-T213 WeakPolarHBondContact CG-OG1 3.37Å; L58-T213 HydrophobicContact CD1-CG2 3.98Å; L58-T213 HydrophobicContact CD2-CG2 3.19Å; L58-T213 HydrophobicContact CG-CG2 3.55Å; Y99-T213 VanDerWaalsContact OH-CB 3.31Å; Y99-T213 WeakPolarHBondContact OH-CB 3.24Å; Y99-T213 VanDerWaalsContact OH-CG2 3.25Å; Y99-T213 WeakPolarHBondContact OH-CG2 3.44Å; Y99-T213 PolarHBondContact OH-OG1 3.49Å; Y99-T213 VanDerWaalsContact OH-OG1 3.14Å; L209-T213 PolarHBondContact O-N 2.96Å; L209-T213 PolarHBondContact O-OG1 3.29Å; Q210-T213 WeakPolarHBondContact O-CB 3.48Å; Q210-T213 PolarHBondContact O-N 2.7Å; E211-T213 PolarHBondContact O-N 2.96Å |
| 214 | D | 84.3 | Confident | 88.1 | Confident | 93 Ų | 93 | 53.5 Ų | 53.5 | 50% | 0.497 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -81.3 | -36.2 | -168.7 | -70 | 3.1 | 0 | 0 | 0 | 112.3 | Q210 E211 | Q210-D214 PolarHBondContact NE2-OD2 2.64Å; Q210-D214 PolarHBondContact O-N 3.48Å; E211-D214 PolarHBondContact O-N 3.14Å |
| 215 | L | 83.9 | Confident | 87.8 | Confident | 129 Ų | 129 | 54.6 Ų | 54.6 | 68% | 0.675 | 33% | 0.327 | S | S | * | . | S | Bend | trans | -111.2 | -11.2 | -174.2 | -57.4 | 178.1 | 0 | 0 | 0 | 113.3 | E211 V217 | E211-L215 PolarHBondContact O-N 2.94Å; L215-V217 HydrophobicContact CB-CG2 3.92Å; L215-V217 PolarHBondContact O-N 2.89Å; L215-V217 VanDerWaalsContact O-N 3.08Å |
| 216 | G | 82.5 | Confident | 87.6 | Confident | 57 Ų | 57 | 54.7 Ų | 54.7 | 59% | 0.588 | 32% | 0.323 | S | S | * | . | S | Bend | trans | 68.8 | -3.7 | -169.4 | 0 | 0 | 0 | 0 | 0 | 114.1 | L212 | L212-G216 VanDerWaalsContact O-CA 3.27Å; L212-G216 WeakPolarHBondContact O-CA 3.43Å; L212-G216 PolarHBondContact O-N 2.89Å |
| 217 | V | 80.4 | Confident | 87.4 | Confident | 97 Ų | 97 | 59.2 Ų | 59.2 | 59% | 0.588 | 35% | 0.346 | S | S | * | . | S | Bend | trans | -134.9 | 147.9 | -178.9 | -63.6 | 0 | 0 | 0 | 0 | 109.7 | E211 L215 | E211-V217 CarbonylContact C-O 3.57Å; L215-V217 HydrophobicContact CB-CG2 3.92Å; L215-V217 PolarHBondContact O-N 2.89Å; L215-V217 VanDerWaalsContact O-N 3.08Å |
| 218 | T | 82.7 | Confident | 87.3 | Confident | 43 Ų | 43 | 63.5 Ų | 63.5 | 26% | 0.264 | 37% | 0.367 | S | S | . | . | trans | -100.7 | 144.9 | 171.2 | 39.6 | 0 | 0 | 0 | 0 | 110.6 | V208 E211 L212 L220 | V208-T218 HydrophobicContact CB-CG2 4.41Å; V208-T218 HydrophobicContact CG1-CG2 3.55Å; V208-T218 WeakPolarHBondContact O-CG2 3.35Å; E211-T218 HydrophobicContact CB-CG2 3.98Å; L212-T218 HydrophobicContact CB-CG2 4.42Å; L212-T218 HydrophobicContact CD1-CG2 4.26Å; L212-T218 HydrophobicContact CD2-CG2 3.39Å; L212-T218 HydrophobicContact CG-CG2 3.36Å; T218-L220 PolarHBondContact O-N 2.83Å | ||
| 219 | S | 85.3 | Confident | 87.2 | Confident | 52 Ų | 52 | 64.5 Ų | 64.5 | 36% | 0.364 | 37% | 0.372 | S | S | . | . | trans | -64.8 | 135.7 | 170.6 | 65.4 | 0 | 0 | 0 | 0 | 109.6 | E211 A221 S222 F223 | E211-S219 PolarHBondContact OE2-N 3.44Å; E211-S219 PolarHBondContact OE2-OG 3.49Å; S219-A221 PolarHBondContact O-N 3.49Å; S219-A221 VanDerWaalsContact O-N 3.15Å; S219-S222 PolarHBondContact O-N 2.86Å; S219-S222 WeakPolarHBondContact OG-CB 3.49Å; S219-S222 PolarHBondContact OG-N 3.37Å; S219-S222 VanDerWaalsContact OG-N 3.1Å; S219-S222 PolarHBondContact OG-OG 2.9Å; S219-F223 PolarHBondContact O-N 3.27Å | ||
| 220 | L | 86.8 | Confident | 87.1 | Confident | 145 Ų | 145 | 65.3 Ų | 65.3 | 76% | 0.759 | 38% | 0.381 | S | S | * | . | H | α-helix | trans | -54.3 | -35 | 174.8 | -173.1 | 64.3 | 0 | 0 | 0 | 111 | T218 S224 | T218-L220 PolarHBondContact O-N 2.83Å; L220-S224 WeakPolarHBondContact O-CB 3.31Å; L220-S224 PolarHBondContact O-N 3.19Å; L220-S224 PolarHBondContact O-OG 2.92Å |
| 221 | A | 87.1 | Confident | 86.9 | Confident | 64 Ų | 64 | 64.4 Ų | 64.4 | 53% | 0.529 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -60.1 | -53.9 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | S219 F223 S224 T225 | S219-A221 PolarHBondContact O-N 3.49Å; S219-A221 VanDerWaalsContact O-N 3.15Å; A221-F223 PolarHBondContact O-N 3.37Å; A221-S224 PolarHBondContact O-N 2.87Å; A221-S224 PolarHBondContact O-OG 3.28Å; A221-T225 VanDerWaalsContact O-CG2 3.26Å; A221-T225 WeakPolarHBondContact O-CG2 3.29Å; A221-T225 PolarHBondContact O-N 2.88Å; A221-T225 PolarHBondContact O-OG1 3.44Å |
| 222 | S | 84.1 | Confident | 86.8 | Confident | 10 Ų | 10 | 67.8 Ų | 67.8 | 7% | 0.07 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -62.3 | -43.3 | 179.5 | -77.9 | 0 | 0 | 0 | 0 | 112.7 | K204 E211 S219 T225 L226 | K204-S222 PolarHBondContact NZ-OG 2.88Å; E211-S222 WeakPolarHBondContact OE1-CB 3.36Å; E211-S222 PolarHBondContact OE1-OG 3.12Å; E211-S222 WeakPolarHBondContact OE2-CB 3.35Å; E211-S222 PolarHBondContact OE2-OG 3.01Å; S219-S222 PolarHBondContact O-N 2.86Å; S219-S222 WeakPolarHBondContact OG-CB 3.49Å; S219-S222 PolarHBondContact OG-N 3.37Å; S219-S222 VanDerWaalsContact OG-N 3.1Å; S219-S222 PolarHBondContact OG-OG 2.9Å; S222-T225 WeakPolarHBondContact CA-OG1 3.47Å; S222-T225 PolarHBondContact O-N 3.04Å; S222-T225 PolarHBondContact O-OG1 2.93Å; S222-L226 PolarHBondContact O-N 3.44Å |
| 223 | F | 87.6 | Confident | 86.5 | Confident | 97 Ų | 97 | 65.9 Ų | 65.9 | 43% | 0.425 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -63.9 | -43.9 | 177.5 | -170.1 | -107.8 | 0 | 0 | 0 | 112.4 | S219 A221 T225 L226 I227 | S219-F223 PolarHBondContact O-N 3.27Å; A221-F223 PolarHBondContact O-N 3.37Å; F223-T225 PolarHBondContact O-N 3.31Å; F223-L226 WeakPolarHBondContact O-CB 3.45Å; F223-L226 PolarHBondContact O-N 3.24Å; F223-I227 HydrophobicContact CD1-CD1 3.7Å; F223-I227 HydrophobicContact CE1-CD1 3.34Å; F223-I227 HydrophobicContact CE1-CG1 4.27Å; F223-I227 HydrophobicContact CZ-CD1 3.92Å; F223-I227 HydrophobicContact CZ-CG1 4.49Å; F223-I227 PolarHBondContact O-N 2.65Å |
| 224 | S | 88.4 | Confident | 86.3 | Confident | 47 Ų | 47 | 69.2 Ų | 69.2 | 33% | 0.329 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -62.7 | -41.5 | 175.8 | 67.3 | 0 | 0 | 0 | 0 | 112 | L220 A221 L226 I227 I228 | L220-S224 WeakPolarHBondContact O-CB 3.31Å; L220-S224 PolarHBondContact O-N 3.19Å; L220-S224 PolarHBondContact O-OG 2.92Å; A221-S224 PolarHBondContact O-N 2.87Å; A221-S224 PolarHBondContact O-OG 3.28Å; S224-L226 VanDerWaalsContact C-N 3.33Å; S224-L226 PolarHBondContact O-N 3.41Å; S224-I227 PolarHBondContact O-N 3.04Å; S224-I228 VanDerWaalsContact O-CG1 3.25Å; S224-I228 WeakPolarHBondContact O-CG1 3.42Å; S224-I228 PolarHBondContact O-N 2.78Å |
| 225 | T | 88.8 | Confident | 86.2 | Confident | 51 Ų | 51 | 68.6 Ų | 68.6 | 31% | 0.313 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -64.1 | -37 | 175.6 | 61.6 | 0 | 0 | 0 | 0 | 112.4 | K204 A221 S222 F223 I228 L229 | K204-T225 WeakPolarHBondContact CE-OG1 3.33Å; K204-T225 PolarHBondContact NZ-OG1 3.23Å; A221-T225 VanDerWaalsContact O-CG2 3.26Å; A221-T225 WeakPolarHBondContact O-CG2 3.29Å; A221-T225 PolarHBondContact O-N 2.88Å; A221-T225 PolarHBondContact O-OG1 3.44Å; S222-T225 WeakPolarHBondContact CA-OG1 3.47Å; S222-T225 PolarHBondContact O-N 3.04Å; S222-T225 PolarHBondContact O-OG1 2.93Å; F223-T225 PolarHBondContact O-N 3.31Å; T225-I228 PolarHBondContact O-N 3.07Å; T225-L229 WeakPolarHBondContact O-CB 3.44Å; T225-L229 VanDerWaalsContact O-CG 3.24Å; T225-L229 WeakPolarHBondContact O-CG 3.37Å; T225-L229 PolarHBondContact O-N 3Å |
| 226 | L | 89.2 | Confident | 85.8 | Confident | 33 Ų | 33 | 63.7 Ų | 63.7 | 17% | 0.173 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -61.5 | -47.1 | 174.2 | -175.2 | 80.7 | 0 | 0 | 0 | 110.9 | K204 A205 V208 S222 F223 S224 I228 L229 A230 | K204-L226 HydrophobicContact CB-CD1 3.97Å; K204-L226 HydrophobicContact CG-CB 4.17Å; K204-L226 HydrophobicContact CG-CD1 3.99Å; A205-L226 HydrophobicContact CB-CD1 3.86Å; A205-L226 VanDerWaalsContact N-CD1 3.32Å; V208-L226 HydrophobicContact CG2-CB 4.24Å; V208-L226 HydrophobicContact CG2-CD2 4.42Å; S222-L226 PolarHBondContact O-N 3.44Å; F223-L226 WeakPolarHBondContact O-CB 3.45Å; F223-L226 PolarHBondContact O-N 3.24Å; S224-L226 VanDerWaalsContact C-N 3.33Å; S224-L226 PolarHBondContact O-N 3.41Å; L226-I228 PolarHBondContact O-N 3.45Å; L226-L229 PolarHBondContact O-N 3.06Å; L226-A230 VanDerWaalsContact O-CB 3.24Å; L226-A230 WeakPolarHBondContact O-CB 3.34Å; L226-A230 PolarHBondContact O-N 3.2Å |
| 227 | I | 90.8 | Very high | 85.5 | Confident | 95 Ų | 95 | 65.4 Ų | 65.4 | 49% | 0.487 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -61.2 | -45 | 177.5 | -69.5 | 170.1 | 0 | 0 | 0 | 110.8 | F223 S224 A230 G231 | F223-I227 HydrophobicContact CD1-CD1 3.7Å; F223-I227 HydrophobicContact CE1-CD1 3.34Å; F223-I227 HydrophobicContact CE1-CG1 4.27Å; F223-I227 HydrophobicContact CZ-CD1 3.92Å; F223-I227 HydrophobicContact CZ-CG1 4.49Å; F223-I227 PolarHBondContact O-N 2.65Å; S224-I227 PolarHBondContact O-N 3.04Å; I227-A230 PolarHBondContact O-N 3.11Å; I227-G231 PolarHBondContact O-N 3.3Å |
| 228 | I | 91.5 | Very high | 85.4 | Confident | 114 Ų | 114 | 66.1 Ų | 66.1 | 59% | 0.585 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -61.3 | -47.5 | 178.6 | -69.1 | 164.3 | 0 | 0 | 0 | 110.5 | S224 T225 L226 G231 L232 | S224-I228 VanDerWaalsContact O-CG1 3.25Å; S224-I228 WeakPolarHBondContact O-CG1 3.42Å; S224-I228 PolarHBondContact O-N 2.78Å; T225-I228 PolarHBondContact O-N 3.07Å; L226-I228 PolarHBondContact O-N 3.45Å; I228-G231 PolarHBondContact O-N 3.06Å; I228-L232 WeakPolarHBondContact O-CB 3.47Å; I228-L232 PolarHBondContact O-N 3.48Å |
| 229 | L | 90.5 | Very high | 85.2 | Confident | 33 Ų | 33 | 68.7 Ų | 68.7 | 17% | 0.173 | 39% | 0.393 | C | S | . | . | H | α-helix | trans | -65.1 | -42.2 | 178.7 | -71.4 | 172.8 | 0 | 0 | 0 | 111.7 | L200 V201 K204 T225 L226 L232 S233 | L200-L229 HydrophobicContact CB-CD1 4.22Å; L200-L229 HydrophobicContact CB-CD2 4.2Å; L200-L229 HydrophobicContact CD1-CD2 4.36Å; V201-L229 HydrophobicContact CG2-CB 4.04Å; V201-L229 WeakPolarHBondContact CG2-O 3.31Å; K204-L229 HydrophobicContact CB-CD1 3.93Å; K204-L229 HydrophobicContact CG-CD1 4.17Å; T225-L229 WeakPolarHBondContact O-CB 3.44Å; T225-L229 VanDerWaalsContact O-CG 3.24Å; T225-L229 WeakPolarHBondContact O-CG 3.37Å; T225-L229 PolarHBondContact O-N 3Å; L226-L229 PolarHBondContact O-N 3.06Å; L229-L232 PolarHBondContact O-N 3.06Å; L229-S233 WeakPolarHBondContact O-CB 3.29Å; L229-S233 PolarHBondContact O-N 3.43Å |
| 230 | A | 87.9 | Confident | 84.6 | Confident | 32 Ų | 32 | 72.9 Ų | 72.9 | 26% | 0.264 | 40% | 0.401 | S | S | . | . | H | α-helix | trans | -61 | -47 | 175.5 | 0 | 0 | 0 | 0 | 0 | 110.8 | V201 L226 I227 L232 S233 L234 | V201-A230 HydrophobicContact CG1-CB 4.2Å; L226-A230 VanDerWaalsContact O-CB 3.24Å; L226-A230 WeakPolarHBondContact O-CB 3.34Å; L226-A230 PolarHBondContact O-N 3.2Å; I227-A230 PolarHBondContact O-N 3.11Å; A230-L232 PolarHBondContact O-N 3.28Å; A230-S233 PolarHBondContact O-N 3.44Å; A230-S233 PolarHBondContact O-OG 3.15Å; A230-L234 WeakPolarHBondContact O-CG 3.39Å; A230-L234 PolarHBondContact O-N 3.4Å |
| 231 | G | 88.2 | Confident | 84 | Confident | 37 Ų | 37 | 71.5 Ų | 71.5 | 38% | 0.381 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -59.2 | -44.5 | 174 | 0 | 0 | 0 | 0 | 0 | 112.6 | I227 I228 S233 L234 L235 | I227-G231 PolarHBondContact O-N 3.3Å; I228-G231 PolarHBondContact O-N 3.06Å; G231-S233 VanDerWaalsContact C-N 3.33Å; G231-S233 PolarHBondContact O-N 3.36Å; G231-L234 PolarHBondContact O-N 3.31Å; G231-L234 VanDerWaalsContact O-N 3.11Å; G231-L235 PolarHBondContact O-N 2.96Å |
| 232 | L | 86.9 | Confident | 83.6 | Confident | 101 Ų | 101 | 74.2 Ų | 74.2 | 53% | 0.529 | 40% | 0.396 | S | S | . | . | H | α-helix | trans | -61.2 | -40.8 | 176.9 | -168.4 | 76.5 | 0 | 0 | 0 | 111.8 | I228 L229 A230 L234 L235 | I228-L232 WeakPolarHBondContact O-CB 3.47Å; I228-L232 PolarHBondContact O-N 3.48Å; L229-L232 PolarHBondContact O-N 3.06Å; A230-L232 PolarHBondContact O-N 3.28Å; L232-L234 PolarHBondContact O-N 3.25Å; L232-L235 HydrophobicContact CD1-CD1 3.47Å; L232-L235 VanDerWaalsContact CD1-CD1 3.47Å; L232-L235 HydrophobicContact CD1-CG 4.49Å; L232-L235 HydrophobicContact CG-CD1 4.34Å; L232-L235 WeakPolarHBondContact O-CB 3.37Å; L232-L235 PolarHBondContact O-N 3.22Å; L232-L235 VanDerWaalsContact O-N 3.13Å |
| 233 | S | 82.5 | Confident | 82.7 | Confident | 29 Ų | 29 | 76.1 Ų | 76.1 | 20% | 0.203 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -66.8 | -21.9 | 177.2 | 77.6 | 0 | 0 | 0 | 0 | 113.7 | L229 A230 G231 P236 | L229-S233 WeakPolarHBondContact O-CB 3.29Å; L229-S233 PolarHBondContact O-N 3.43Å; A230-S233 PolarHBondContact O-N 3.44Å; A230-S233 PolarHBondContact O-OG 3.15Å; G231-S233 VanDerWaalsContact C-N 3.33Å; G231-S233 PolarHBondContact O-N 3.36Å; S233-P236 WeakPolarHBondContact O-CD 3.37Å |
| 234 | L | 83.5 | Confident | 81.7 | Confident | 95 Ų | 95 | 79 Ų | 79 | 50% | 0.497 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -89.8 | -11.1 | 174.8 | -65.7 | 174.7 | 0 | 0 | 0 | 112.9 | A230 G231 L232 P236 L237 V238 | A230-L234 WeakPolarHBondContact O-CG 3.39Å; A230-L234 PolarHBondContact O-N 3.4Å; G231-L234 PolarHBondContact O-N 3.31Å; G231-L234 VanDerWaalsContact O-N 3.11Å; L232-L234 PolarHBondContact O-N 3.25Å; L234-P236 VanDerWaalsContact C-CD 3.48Å; L234-P236 VanDerWaalsContact C-N 3.35Å; L234-L237 HydrophobicContact CD2-CD2 4.29Å; L234-L237 WeakPolarHBondContact O-CA 3.43Å; L234-L237 WeakPolarHBondContact O-CB 3.22Å; L234-L237 PolarHBondContact O-N 3.21Å; L234-V238 PolarHBondContact O-N 3.25Å |
| 235 | L | 82.5 | Confident | 80.6 | Confident | 80 Ų | 80 | 84 Ų | 84 | 42% | 0.419 | 43% | 0.431 | S | S | . | . | H | α-helix | trans | -54.3 | -43.2 | 176.3 | -71.8 | 179.3 | 0 | 0 | 0 | 113.3 | G231 L232 L237 V238 F239 | G231-L235 PolarHBondContact O-N 2.96Å; L232-L235 HydrophobicContact CD1-CD1 3.47Å; L232-L235 VanDerWaalsContact CD1-CD1 3.47Å; L232-L235 HydrophobicContact CD1-CG 4.49Å; L232-L235 HydrophobicContact CG-CD1 4.34Å; L232-L235 WeakPolarHBondContact O-CB 3.37Å; L232-L235 PolarHBondContact O-N 3.22Å; L232-L235 VanDerWaalsContact O-N 3.13Å; L235-L237 PolarHBondContact O-N 2.84Å; L235-L237 VanDerWaalsContact O-N 3.14Å; L235-V238 PolarHBondContact O-N 3.31Å; L235-V238 VanDerWaalsContact O-N 3.08Å; L235-F239 VanDerWaalsContact O-CD2 3.3Å; L235-F239 WeakPolarHBondContact O-CD2 3.39Å; L235-F239 PolarHBondContact O-N 3.09Å |
| 236 | P | 74.9 | Confident | 79.4 | Confident | 25 Ų | 25 | 85.2 Ų | 85.2 | 16% | 0.162 | 45% | 0.446 | C | S | . | . | H | α-helix | trans | -59.1 | -25.4 | 174.6 | -24 | 35.2 | 0 | 0 | 0 | 113.6 | P166 S233 L234 F239 R240 L243 | P166-P236 HydrophobicContact CG-CB 4.49Å; S233-P236 WeakPolarHBondContact O-CD 3.37Å; L234-P236 VanDerWaalsContact C-CD 3.48Å; L234-P236 VanDerWaalsContact C-N 3.35Å; P236-F239 CarbonylContact O-C 3.39Å; P236-R240 PolarHBondContact O-N 3.27Å; P236-L243 HydrophobicContact CB-CD1 3.89Å; P236-L243 WeakPolarHBondContact O-CD1 3.19Å |
| 237 | L | 75.3 | Confident | 77.8 | Confident | 94 Ų | 94 | 89.4 Ų | 89.4 | 49% | 0.492 | 46% | 0.464 | S | S | . | . | H | α-helix | trans | -73.8 | -37.9 | 176.5 | -173.6 | 63 | 0 | 0 | 0 | 111.7 | L234 L235 F239 R240 | L234-L237 HydrophobicContact CD2-CD2 4.29Å; L234-L237 WeakPolarHBondContact O-CA 3.43Å; L234-L237 WeakPolarHBondContact O-CB 3.22Å; L234-L237 PolarHBondContact O-N 3.21Å; L235-L237 PolarHBondContact O-N 2.84Å; L235-L237 VanDerWaalsContact O-N 3.14Å; L237-F239 VanDerWaalsContact C-N 3.3Å; L237-F239 PolarHBondContact O-N 3.25Å; L237-R240 WeakPolarHBondContact O-CB 3.31Å; L237-R240 PolarHBondContact O-N 3.33Å |
| 238 | V | 79.5 | Confident | 75.6 | Confident | 111 Ų | 111 | 93.5 Ų | 93.5 | 67% | 0.673 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -63.4 | -40.1 | 175.8 | -179.7 | 0 | 0 | 0 | 0 | 110.5 | L234 L235 R240 | L234-V238 PolarHBondContact O-N 3.25Å; L235-V238 PolarHBondContact O-N 3.31Å; L235-V238 VanDerWaalsContact O-N 3.08Å; V238-R240 VanDerWaalsContact C-N 3.31Å; V238-R240 PolarHBondContact O-N 2.96Å |
| 239 | F | 78.4 | Confident | 74.8 | Confident | 97 Ų | 97 | 92.5 Ų | 92.5 | 43% | 0.425 | 48% | 0.48 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -92.3 | 20.1 | 178.3 | -61.3 | -71.7 | 0 | 0 | 0 | 113.7 | L235 P236 L237 N241 Q242 L243 | L235-F239 VanDerWaalsContact O-CD2 3.3Å; L235-F239 WeakPolarHBondContact O-CD2 3.39Å; L235-F239 PolarHBondContact O-N 3.09Å; P236-F239 CarbonylContact O-C 3.39Å; L237-F239 VanDerWaalsContact C-N 3.3Å; L237-F239 PolarHBondContact O-N 3.25Å; F239-N241 PolarHBondContact O-N 3.32Å; F239-N241 VanDerWaalsContact O-N 3.12Å; F239-Q242 PolarHBondContact O-N 2.92Å; F239-L243 WeakPolarHBondContact O-CG 3.36Å; F239-L243 PolarHBondContact O-N 2.77Å |
| 240 | R | 73.4 | Confident | 74 | Confident | 140 Ų | 140 | 95.6 Ų | 95.6 | 53% | 0.528 | 50% | 0.497 | S | S | . | . | H | α-helix | trans | -51.7 | -41.3 | -175.4 | 178.1 | -176.5 | 179.8 | -168.9 | 0.9 | 113.1 | P236 L237 V238 R244 | P236-R240 PolarHBondContact O-N 3.27Å; L237-R240 WeakPolarHBondContact O-CB 3.31Å; L237-R240 PolarHBondContact O-N 3.33Å; V238-R240 VanDerWaalsContact C-N 3.31Å; V238-R240 PolarHBondContact O-N 2.96Å; R240-R244 VanDerWaalsContact O-CB 3.27Å; R240-R244 WeakPolarHBondContact O-CB 3.41Å; R240-R244 PolarHBondContact O-N 3.06Å |
| 241 | N | 73.9 | Confident | 73.2 | Confident | 116 Ų | 116 | 99.1 Ų | 99.1 | 62% | 0.62 | 51% | 0.509 | S | S | * | . | H | α-helix | trans | -68.7 | -43.4 | -178.7 | -67.9 | -12 | 0 | 0 | 0 | 111.6 | F239 R244 E245 | F239-N241 PolarHBondContact O-N 3.32Å; F239-N241 VanDerWaalsContact O-N 3.12Å; N241-R244 WeakPolarHBondContact O-CB 3.47Å; N241-R244 PolarHBondContact O-N 3.12Å; N241-E245 WeakPolarHBondContact O-CG 2.87Å; N241-E245 PolarHBondContact O-N 2.91Å |
| 242 | Q | 77.2 | Confident | 72.3 | Confident | 122 Ų | 122 | 102.8 Ų | 102.8 | 57% | 0.57 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -66.1 | -39.9 | 177.3 | -64.8 | 177 | -0.2 | 0 | 0 | 111.7 | F239 R244 E245 A246 | F239-Q242 PolarHBondContact O-N 2.92Å; Q242-R244 VanDerWaalsContact C-N 3.32Å; Q242-E245 PolarHBondContact O-N 3.18Å; Q242-A246 WeakPolarHBondContact O-CB 3.48Å; Q242-A246 PolarHBondContact O-N 2.97Å |
| 243 | L | 66.6 | Low | 71.4 | Confident | 50 Ų | 50 | 102.9 Ų | 102.9 | 26% | 0.262 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.9 | -39.6 | 173.8 | -67.5 | 174.2 | 0 | 0 | 0 | 110.9 | F167 P236 F239 E245 A246 F247 | F167-L243 HydrophobicContact CE1-CD1 4.4Å; P236-L243 HydrophobicContact CB-CD1 3.89Å; P236-L243 WeakPolarHBondContact O-CD1 3.19Å; F239-L243 WeakPolarHBondContact O-CG 3.36Å; F239-L243 PolarHBondContact O-N 2.77Å; L243-E245 VanDerWaalsContact C-N 3.31Å; L243-E245 PolarHBondContact O-N 3.28Å; L243-A246 PolarHBondContact O-N 3.25Å; L243-F247 HydrophobicContact CB-CD2 4.45Å; L243-F247 HydrophobicContact CD2-CE2 4.02Å; L243-F247 WeakPolarHBondContact O-CD2 3.28Å; L243-F247 PolarHBondContact O-N 2.64Å; L243-F247 VanDerWaalsContact O-N 3.07Å |
| 244 | R | 65.6 | Low | 70.7 | Confident | 158 Ų | 158 | 107.8 Ų | 107.8 | 60% | 0.596 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -62.8 | -39.8 | 177.2 | -170.3 | 175.5 | -174.7 | -163.8 | 0.2 | 111.6 | R240 N241 Q242 L248 | R240-R244 VanDerWaalsContact O-CB 3.27Å; R240-R244 WeakPolarHBondContact O-CB 3.41Å; R240-R244 PolarHBondContact O-N 3.06Å; N241-R244 WeakPolarHBondContact O-CB 3.47Å; N241-R244 PolarHBondContact O-N 3.12Å; Q242-R244 VanDerWaalsContact C-N 3.32Å; R244-L248 HydrophobicContact CG-CD1 3.59Å; R244-L248 HydrophobicContact CG-CG 4.43Å; R244-L248 VanDerWaalsContact O-CB 3.31Å; R244-L248 WeakPolarHBondContact O-CB 3.18Å; R244-L248 PolarHBondContact O-N 3.01Å; R244-L248 VanDerWaalsContact O-N 3.14Å |
| 245 | E | 66.5 | Low | 69.8 | Low | 151 Ų | 151 | 108.7 Ų | 108.7 | 71% | 0.706 | 54% | 0.54 | S | S | * | . | H | α-helix | trans | -71.8 | -29.8 | 174.8 | -71.4 | 172.9 | -171 | 0 | 0 | 113.1 | N241 Q242 L243 | N241-E245 WeakPolarHBondContact O-CG 2.87Å; N241-E245 PolarHBondContact O-N 2.91Å; Q242-E245 PolarHBondContact O-N 3.18Å; L243-E245 VanDerWaalsContact C-N 3.31Å; L243-E245 PolarHBondContact O-N 3.28Å |
| 246 | A | 61.8 | Low | 68.8 | Low | 76 Ų | 76 | 110.9 Ų | 110.9 | 63% | 0.628 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -77.8 | -24.3 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.5 | Q242 L243 | Q242-A246 WeakPolarHBondContact O-CB 3.48Å; Q242-A246 PolarHBondContact O-N 2.97Å; L243-A246 PolarHBondContact O-N 3.25Å |
| 247 | F | 56.2 | Low | 68.3 | Low | 122 Ų | 122 | 118.1 Ų | 118.1 | 54% | 0.535 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -114.4 | -3.5 | -174 | -70.2 | -71.5 | 0 | 0 | 0 | 115 | C161 L243 | C161-F247 HydrophobicContact CB-CE1 4.37Å; C161-F247 HydrophobicContact CB-CZ 3.91Å; L243-F247 HydrophobicContact CB-CD2 4.45Å; L243-F247 HydrophobicContact CD2-CE2 4.02Å; L243-F247 WeakPolarHBondContact O-CD2 3.28Å; L243-F247 PolarHBondContact O-N 2.64Å; L243-F247 VanDerWaalsContact O-N 3.07Å |
| 248 | L | 45 | Very low | 67.6 | Low | 180 Ų | 180 | 120.3 Ų | 120.3 | 94% | 0.942 | 59% | 0.59 | S | S | * | * | trans | -119.7 | 0 | 172.7 | -66.7 | 176.1 | 0 | 0 | 0 | 110.7 | R244 | R244-L248 HydrophobicContact CG-CD1 3.59Å; R244-L248 HydrophobicContact CG-CG 4.43Å; R244-L248 VanDerWaalsContact O-CB 3.31Å; R244-L248 WeakPolarHBondContact O-CB 3.18Å; R244-L248 PolarHBondContact O-N 3.01Å; R244-L248 VanDerWaalsContact O-N 3.14Å |
Retrieved 248 of 248 residues in 106.4 ms
(Link to these results)