| 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 | 69.7 | Low | 86.8 | Confident | 190 Ų | 190 | 95 Ų | 95 | 94% | 0.936 | 48% | 0.475 | S | S | * | . | 0 | 145.7 | 0 | -79 | -177.1 | 175.1 | 0 | 0 | 109.4 | V6 | M1-V6 HydrophobicContact CB-CG2 3.65Å; M1-V6 HydrophobicContact SD-CG2 4.4Å | |||
| 2 | K | 82.8 | Confident | 87.6 | Confident | 120 Ų | 120 | 94.4 Ų | 94.4 | 52% | 0.522 | 47% | 0.473 | S | S | . | . | trans | -60.1 | 144.3 | 172.2 | -67.9 | -177.7 | 179.1 | 179.2 | 0 | 110 | Q4 N5 V6 | K2-Q4 PolarHBondContact O-N 3.45Å; K2-Q4 VanDerWaalsContact O-N 3.13Å; K2-N5 PolarHBondContact O-N 3.39Å; K2-V6 PolarHBondContact O-N 3.05Å; K2-V6 VanDerWaalsContact O-N 3.11Å | ||
| 3 | R | 82.5 | Confident | 88.4 | Confident | 186 Ų | 186 | 93.3 Ų | 93.3 | 70% | 0.702 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -53.6 | -34.7 | 179.3 | -172.3 | 177.4 | 179.9 | 176.1 | -0 | 112.4 | V6 R7 | R3-V6 PolarHBondContact O-N 3.12Å; R3-R7 WeakPolarHBondContact O-CB 3.45Å; R3-R7 PolarHBondContact O-N 2.87Å |
| 4 | Q | 78.7 | Confident | 89 | Confident | 31 Ų | 31 | 92.1 Ų | 92.1 | 15% | 0.145 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -63.4 | -49.7 | 175.6 | -61.4 | 168.9 | -31.4 | 0 | 0 | 112.3 | K2 V6 R7 T8 D253 E254 | K2-Q4 PolarHBondContact O-N 3.45Å; K2-Q4 VanDerWaalsContact O-N 3.13Å; Q4-V6 VanDerWaalsContact C-N 3.28Å; Q4-V6 PolarHBondContact O-N 3.27Å; Q4-R7 PolarHBondContact O-N 3.27Å; Q4-T8 PolarHBondContact O-N 3.44Å; Q4-T8 PolarHBondContact O-OG1 3.09Å; Q4-T8 VanDerWaalsContact O-OG1 3.1Å; Q4-D253 HydrophobicContact CG-CB 4.37Å; Q4-E254 VanDerWaalsContact NE2-CB 3.29Å |
| 5 | N | 88.8 | Confident | 89.5 | Confident | 90 Ų | 90 | 91.5 Ų | 91.5 | 48% | 0.481 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -62.6 | -38.9 | 179.1 | -63.8 | 1.4 | 0 | 0 | 0 | 111 | K2 T8 L9 | K2-N5 PolarHBondContact O-N 3.39Å; N5-T8 PolarHBondContact O-N 3.21Å; N5-L9 VanDerWaalsContact O-CB 3.27Å; N5-L9 WeakPolarHBondContact O-CB 3.24Å; N5-L9 PolarHBondContact O-N 3.28Å |
| 6 | V | 91.6 | Very high | 90.1 | Very high | 74 Ų | 74 | 94.1 Ų | 94.1 | 45% | 0.448 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -63.3 | -46.3 | 174.8 | 178.4 | 0 | 0 | 0 | 0 | 110.7 | M1 K2 R3 Q4 L9 A10 | M1-V6 HydrophobicContact CB-CG2 3.65Å; M1-V6 HydrophobicContact SD-CG2 4.4Å; K2-V6 PolarHBondContact O-N 3.05Å; K2-V6 VanDerWaalsContact O-N 3.11Å; R3-V6 PolarHBondContact O-N 3.12Å; Q4-V6 VanDerWaalsContact C-N 3.28Å; Q4-V6 PolarHBondContact O-N 3.27Å; V6-L9 PolarHBondContact O-N 3.28Å; V6-A10 VanDerWaalsContact O-CB 3.23Å; V6-A10 WeakPolarHBondContact O-CB 3.46Å; V6-A10 PolarHBondContact O-N 3.21Å |
| 7 | R | 88.7 | Confident | 90.5 | Very high | 43 Ų | 43 | 92.8 Ų | 92.8 | 16% | 0.162 | 48% | 0.483 | C | S | . | . | H | α-helix | trans | -62.4 | -45 | 176.9 | 178.3 | 177.3 | 52.8 | -154 | -15.9 | 112 | R3 Q4 A10 L11 N250 D253 | R3-R7 WeakPolarHBondContact O-CB 3.45Å; R3-R7 PolarHBondContact O-N 2.87Å; Q4-R7 PolarHBondContact O-N 3.27Å; R7-A10 PolarHBondContact O-N 3.38Å; R7-L11 HydrophobicContact CG-CD1 4.24Å; R7-L11 WeakPolarHBondContact O-CG 3.48Å; R7-L11 PolarHBondContact O-N 2.98Å; R7-N250 PolarHBondContact NE-OD1 3.24Å; R7-N250 PolarHBondContact NH1-OD1 3.03Å; R7-N250 VanDerWaalsContact NH1-OD1 3.16Å; R7-N250 PolarHBondContact NH2-OD1 2.83Å; R7-N250 VanDerWaalsContact NH2-OD1 3.09Å; R7-D253 IonicContact CZ-OD2 3.18Å; R7-D253 IonicContact NH1-OD2 2.71Å; R7-D253 PolarHBondContact NH1-OD2 3.01Å; R7-D253 IonicContact NH2-OD2 2.86Å; R7-D253 PolarHBondContact NH2-OD2 2.83Å |
| 8 | T | 89.9 | Confident | 90.9 | Very high | 65 Ų | 65 | 97.7 Ų | 97.7 | 40% | 0.399 | 50% | 0.496 | S | S | . | . | H | α-helix | trans | -63.9 | -46.1 | 178.6 | -58.1 | 0 | 0 | 0 | 0 | 111.3 | Q4 N5 A10 L11 I12 | Q4-T8 PolarHBondContact O-N 3.44Å; Q4-T8 PolarHBondContact O-OG1 3.09Å; Q4-T8 VanDerWaalsContact O-OG1 3.1Å; N5-T8 PolarHBondContact O-N 3.21Å; T8-A10 VanDerWaalsContact C-N 3.34Å; T8-A10 PolarHBondContact O-N 2.88Å; T8-L11 PolarHBondContact O-N 3.28Å; T8-I12 HydrophobicContact CG2-CD1 4.08Å; T8-I12 WeakPolarHBondContact O-CG1 3.43Å; T8-I12 PolarHBondContact O-N 3.08Å |
| 9 | L | 94.2 | Very high | 91.3 | Very high | 100 Ų | 100 | 98.1 Ų | 98.1 | 52% | 0.524 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -63.3 | -41.2 | 177 | -168.8 | 116.9 | 0 | 0 | 0 | 111.5 | N5 V6 I12 V13 | N5-L9 VanDerWaalsContact O-CB 3.27Å; N5-L9 WeakPolarHBondContact O-CB 3.24Å; N5-L9 PolarHBondContact O-N 3.28Å; V6-L9 PolarHBondContact O-N 3.28Å; L9-I12 PolarHBondContact O-N 3.2Å; L9-V13 WeakPolarHBondContact O-CG2 3.5Å; L9-V13 PolarHBondContact O-N 3.45Å |
| 10 | A | 94.8 | Very high | 91.7 | Very high | 47 Ų | 47 | 99.4 Ų | 99.4 | 39% | 0.388 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -61.1 | -43.8 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | V6 R7 T8 I12 V13 C14 | V6-A10 VanDerWaalsContact O-CB 3.23Å; V6-A10 WeakPolarHBondContact O-CB 3.46Å; V6-A10 PolarHBondContact O-N 3.21Å; R7-A10 PolarHBondContact O-N 3.38Å; T8-A10 VanDerWaalsContact C-N 3.34Å; T8-A10 PolarHBondContact O-N 2.88Å; A10-I12 PolarHBondContact O-N 3.11Å; A10-V13 PolarHBondContact O-N 3.29Å; A10-C14 VanDerWaalsContact O-CB 3.31Å; A10-C14 WeakPolarHBondContact O-CB 3.42Å; A10-C14 PolarHBondContact O-N 3.31Å; A10-C14 PolarHBondContact O-SG 3.11Å |
| 11 | L | 93.4 | Very high | 92 | Very high | 99 Ų | 99 | 99 Ų | 99 | 52% | 0.518 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61 | -44 | 175.1 | -74.7 | 169.9 | 0 | 0 | 0 | 111.8 | R7 T8 C14 T15 | R7-L11 HydrophobicContact CG-CD1 4.24Å; R7-L11 WeakPolarHBondContact O-CG 3.48Å; R7-L11 PolarHBondContact O-N 2.98Å; T8-L11 PolarHBondContact O-N 3.28Å; L11-C14 PolarHBondContact O-N 3.21Å; L11-T15 WeakPolarHBondContact O-CB 3.36Å; L11-T15 PolarHBondContact O-N 2.89Å; L11-T15 PolarHBondContact O-OG1 3.34Å; L11-T15 VanDerWaalsContact O-OG1 3.05Å |
| 12 | I | 95.9 | Very high | 93.3 | Very high | 88 Ų | 88 | 91 Ų | 91 | 45% | 0.451 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -59.7 | -51.5 | 177.2 | -68.7 | 166 | 0 | 0 | 0 | 110.5 | T8 L9 A10 C14 T15 F16 | T8-I12 HydrophobicContact CG2-CD1 4.08Å; T8-I12 WeakPolarHBondContact O-CG1 3.43Å; T8-I12 PolarHBondContact O-N 3.08Å; L9-I12 PolarHBondContact O-N 3.2Å; A10-I12 PolarHBondContact O-N 3.11Å; I12-C14 PolarHBondContact O-N 3.49Å; I12-T15 PolarHBondContact O-N 3.26Å; I12-F16 HydrophobicContact CG2-CD2 3.64Å; I12-F16 HydrophobicContact CG2-CE2 3.64Å; I12-F16 VanDerWaalsContact O-CD2 3.28Å; I12-F16 WeakPolarHBondContact O-CD2 3.46Å; I12-F16 PolarHBondContact O-N 3.43Å |
| 13 | V | 97.9 | Very high | 94.1 | Very high | 80 Ų | 80 | 88.1 Ų | 88.1 | 49% | 0.485 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -59.6 | -47.6 | 178.9 | 172.8 | 0 | 0 | 0 | 0 | 110.5 | L9 A10 T15 F16 T17 | L9-V13 WeakPolarHBondContact O-CG2 3.5Å; L9-V13 PolarHBondContact O-N 3.45Å; A10-V13 PolarHBondContact O-N 3.29Å; V13-T15 PolarHBondContact O-N 2.98Å; V13-F16 PolarHBondContact O-N 3.11Å; V13-T17 HydrophobicContact CG1-CG2 4.38Å; V13-T17 WeakPolarHBondContact O-CG2 3.45Å; V13-T17 PolarHBondContact O-N 2.88Å; V13-T17 PolarHBondContact O-OG1 3.1Å; V13-T17 VanDerWaalsContact O-OG1 3.1Å |
| 14 | C | 97.5 | Very high | 94.8 | Very high | 77 Ų | 77 | 82.1 Ų | 82.1 | 52% | 0.52 | 46% | 0.463 | S | S | . | . | H | α-helix | trans | -56.9 | -47.8 | 177.1 | -74.1 | 0 | 0 | 0 | 0 | 111.9 | A10 L11 I12 T17 Y18 | A10-C14 VanDerWaalsContact O-CB 3.31Å; A10-C14 WeakPolarHBondContact O-CB 3.42Å; A10-C14 PolarHBondContact O-N 3.31Å; A10-C14 PolarHBondContact O-SG 3.11Å; L11-C14 PolarHBondContact O-N 3.21Å; I12-C14 PolarHBondContact O-N 3.49Å; C14-T17 WeakPolarHBondContact CA-OG1 3.31Å; C14-T17 PolarHBondContact O-N 2.97Å; C14-T17 PolarHBondContact O-OG1 2.93Å; C14-Y18 VanDerWaalsContact O-CB 3.32Å; C14-Y18 WeakPolarHBondContact O-CB 3.37Å; C14-Y18 PolarHBondContact O-N 3.48Å |
| 15 | T | 96.5 | Very high | 95.8 | Very high | 83 Ų | 83 | 84.2 Ų | 84.2 | 51% | 0.509 | 48% | 0.478 | S | S | . | . | H | α-helix | trans | -63.3 | -43.2 | 179 | -59.6 | 0 | 0 | 0 | 0 | 112 | L11 I12 V13 Y18 L19 | L11-T15 WeakPolarHBondContact O-CB 3.36Å; L11-T15 PolarHBondContact O-N 2.89Å; L11-T15 PolarHBondContact O-OG1 3.34Å; L11-T15 VanDerWaalsContact O-OG1 3.05Å; I12-T15 PolarHBondContact O-N 3.26Å; V13-T15 PolarHBondContact O-N 2.98Å; T15-Y18 PolarHBondContact O-N 2.98Å; T15-L19 HydrophobicContact CG2-CD1 4.44Å; T15-L19 WeakPolarHBondContact O-CG 3.48Å; T15-L19 PolarHBondContact O-N 2.94Å |
| 16 | F | 98.1 | Very high | 96.2 | Very high | 132 Ų | 132 | 86.6 Ų | 86.6 | 58% | 0.579 | 48% | 0.484 | S | S | * | . | H | α-helix | trans | -62.6 | -44.5 | 175.5 | -85.6 | -68.3 | 0 | 0 | 0 | 112.1 | I12 V13 Y18 L19 L20 | I12-F16 HydrophobicContact CG2-CD2 3.64Å; I12-F16 HydrophobicContact CG2-CE2 3.64Å; I12-F16 VanDerWaalsContact O-CD2 3.28Å; I12-F16 WeakPolarHBondContact O-CD2 3.46Å; I12-F16 PolarHBondContact O-N 3.43Å; V13-F16 PolarHBondContact O-N 3.11Å; F16-Y18 VanDerWaalsContact C-N 3.3Å; F16-Y18 PolarHBondContact O-N 3.17Å; F16-L19 PolarHBondContact O-N 3.48Å; F16-L20 WeakPolarHBondContact O-CG 3.45Å; F16-L20 PolarHBondContact O-N 3.27Å |
| 17 | T | 98.1 | Very high | 96.5 | Very high | 72 Ų | 72 | 87.9 Ų | 87.9 | 44% | 0.442 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -63.5 | -37.1 | 175.6 | 55.2 | 0 | 0 | 0 | 0 | 112.1 | V13 C14 L20 V21 | V13-T17 HydrophobicContact CG1-CG2 4.38Å; V13-T17 WeakPolarHBondContact O-CG2 3.45Å; V13-T17 PolarHBondContact O-N 2.88Å; V13-T17 PolarHBondContact O-OG1 3.1Å; V13-T17 VanDerWaalsContact O-OG1 3.1Å; C14-T17 WeakPolarHBondContact CA-OG1 3.31Å; C14-T17 PolarHBondContact O-N 2.97Å; C14-T17 PolarHBondContact O-OG1 2.93Å; T17-L20 PolarHBondContact O-N 3.44Å; T17-V21 WeakPolarHBondContact O-CG2 3.32Å; T17-V21 PolarHBondContact O-N 3.4Å |
| 18 | Y | 97.8 | Very high | 97 | Very high | 182 Ų | 182 | 89.9 Ų | 89.9 | 71% | 0.714 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -64.4 | -40.1 | 176.1 | -171.3 | -94.2 | 0 | 0 | 0 | 111.8 | C14 T15 F16 G22 | C14-Y18 VanDerWaalsContact O-CB 3.32Å; C14-Y18 WeakPolarHBondContact O-CB 3.37Å; C14-Y18 PolarHBondContact O-N 3.48Å; T15-Y18 PolarHBondContact O-N 2.98Å; F16-Y18 VanDerWaalsContact C-N 3.3Å; F16-Y18 PolarHBondContact O-N 3.17Å; Y18-G22 PolarHBondContact O-N 3.47Å |
| 19 | L | 98.3 | Very high | 97.4 | Very high | 105 Ų | 105 | 91.9 Ų | 91.9 | 55% | 0.55 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -64.6 | -42.5 | 173.7 | -71.8 | 170.7 | 0 | 0 | 0 | 112.2 | T15 F16 G22 A23 | T15-L19 HydrophobicContact CG2-CD1 4.44Å; T15-L19 WeakPolarHBondContact O-CG 3.48Å; T15-L19 PolarHBondContact O-N 2.94Å; F16-L19 PolarHBondContact O-N 3.48Å; L19-G22 PolarHBondContact O-N 3.46Å; L19-A23 WeakPolarHBondContact O-CB 3.37Å; L19-A23 PolarHBondContact O-N 2.95Å |
| 20 | L | 98.4 | Very high | 97.5 | Very high | 123 Ų | 123 | 92.6 Ų | 92.6 | 64% | 0.644 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -64.6 | -44.3 | 178 | -70.8 | 171.6 | 0 | 0 | 0 | 112 | F16 T17 A23 A24 | F16-L20 WeakPolarHBondContact O-CG 3.45Å; F16-L20 PolarHBondContact O-N 3.27Å; T17-L20 PolarHBondContact O-N 3.44Å; L20-A23 PolarHBondContact O-N 3.42Å; L20-A24 PolarHBondContact O-N 3.13Å |
| 21 | V | 98.4 | Very high | 97.7 | Very high | 93 Ų | 93 | 92.7 Ų | 92.7 | 56% | 0.564 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -62.7 | -45 | 174.7 | 172.4 | 0 | 0 | 0 | 0 | 110.3 | T17 A23 A24 V25 | T17-V21 WeakPolarHBondContact O-CG2 3.32Å; T17-V21 PolarHBondContact O-N 3.4Å; V21-A23 PolarHBondContact O-N 3.04Å; V21-A24 PolarHBondContact O-N 3.06Å; V21-V25 HydrophobicContact CG1-CG2 4.45Å; V21-V25 WeakPolarHBondContact O-CG2 3.29Å; V21-V25 PolarHBondContact O-N 2.94Å |
| 22 | G | 98 | Very high | 97.9 | Very high | 21 Ų | 21 | 94.8 Ų | 94.8 | 22% | 0.216 | 53% | 0.528 | C | S | . | . | H | α-helix | trans | -57.8 | -46.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y18 L19 A24 V25 F26 | Y18-G22 PolarHBondContact O-N 3.47Å; L19-G22 PolarHBondContact O-N 3.46Å; G22-A24 PolarHBondContact O-N 3.3Å; G22-V25 PolarHBondContact O-N 3.44Å; G22-F26 WeakPolarHBondContact O-CD2 3.42Å; G22-F26 PolarHBondContact O-N 3.46Å |
| 23 | A | 98.3 | Very high | 98 | Very high | 59 Ų | 59 | 93.7 Ų | 93.7 | 49% | 0.488 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -60.1 | -46 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | L19 L20 V21 V25 F26 D27 | L19-A23 WeakPolarHBondContact O-CB 3.37Å; L19-A23 PolarHBondContact O-N 2.95Å; L20-A23 PolarHBondContact O-N 3.42Å; V21-A23 PolarHBondContact O-N 3.04Å; A23-V25 VanDerWaalsContact C-N 3.33Å; A23-V25 PolarHBondContact O-N 3.36Å; A23-F26 PolarHBondContact O-N 3.01Å; A23-D27 VanDerWaalsContact O-CB 3.29Å; A23-D27 WeakPolarHBondContact O-CB 3.32Å; A23-D27 PolarHBondContact O-N 2.88Å |
| 24 | A | 98.4 | Very high | 97.9 | Very high | 61 Ų | 61 | 96.1 Ų | 96.1 | 50% | 0.504 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -63.1 | -38.7 | 178 | 0 | 0 | 0 | 0 | 0 | 112.6 | L20 V21 G22 A28 | L20-A24 PolarHBondContact O-N 3.13Å; V21-A24 PolarHBondContact O-N 3.06Å; G22-A24 PolarHBondContact O-N 3.3Å; A24-A28 WeakPolarHBondContact O-CB 3.45Å; A24-A28 PolarHBondContact O-N 3.32Å; A24-A28 VanDerWaalsContact O-N 3.11Å |
| 25 | V | 98.5 | Very high | 97.9 | Very high | 75 Ų | 75 | 97.1 Ų | 97.1 | 46% | 0.455 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -70.4 | -43.3 | 177.4 | 173.7 | 0 | 0 | 0 | 0 | 111.2 | V21 G22 A23 A28 L29 | V21-V25 HydrophobicContact CG1-CG2 4.45Å; V21-V25 WeakPolarHBondContact O-CG2 3.29Å; V21-V25 PolarHBondContact O-N 2.94Å; G22-V25 PolarHBondContact O-N 3.44Å; A23-V25 VanDerWaalsContact C-N 3.33Å; A23-V25 PolarHBondContact O-N 3.36Å; V25-A28 PolarHBondContact O-N 3.07Å; V25-L29 HydrophobicContact CG1-CD1 3.69Å; V25-L29 HydrophobicContact CG1-CG 4.32Å; V25-L29 WeakPolarHBondContact O-CB 3.46Å; V25-L29 VanDerWaalsContact O-CG 3.23Å; V25-L29 WeakPolarHBondContact O-CG 3.32Å; V25-L29 PolarHBondContact O-N 3.22Å |
| 26 | F | 98.2 | Very high | 98 | Very high | 140 Ų | 140 | 97.6 Ų | 97.6 | 61% | 0.614 | 53% | 0.531 | S | S | * | . | H | α-helix | trans | -66.3 | -40.2 | 177.7 | -74.1 | -57.1 | 0 | 0 | 0 | 112.6 | G22 A23 L29 E30 | G22-F26 WeakPolarHBondContact O-CD2 3.42Å; G22-F26 PolarHBondContact O-N 3.46Å; A23-F26 PolarHBondContact O-N 3.01Å; F26-L29 PolarHBondContact O-N 3.34Å; F26-E30 WeakPolarHBondContact O-CB 3.44Å; F26-E30 PolarHBondContact O-N 3.03Å |
| 27 | D | 98.3 | Very high | 97.9 | Very high | 101 Ų | 101 | 97.2 Ų | 97.2 | 54% | 0.54 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -57.1 | -50.7 | 172.7 | -177.6 | 6.4 | 0 | 0 | 0 | 110.5 | A23 L29 S31 | A23-D27 VanDerWaalsContact O-CB 3.29Å; A23-D27 WeakPolarHBondContact O-CB 3.32Å; A23-D27 PolarHBondContact O-N 2.88Å; D27-L29 VanDerWaalsContact C-N 3.26Å; D27-L29 PolarHBondContact O-N 3.31Å; D27-S31 WeakPolarHBondContact O-CB 3.46Å; D27-S31 PolarHBondContact O-N 3.27Å; D27-S31 VanDerWaalsContact O-N 3.09Å; D27-S31 PolarHBondContact O-OG 3.47Å; D27-S31 WeakPolarHBondContact OD1-CB 3.26Å; D27-S31 PolarHBondContact OD1-OG 3.42Å |
| 28 | A | 98.3 | Very high | 97.8 | Very high | 85 Ų | 85 | 101.1 Ų | 101.1 | 70% | 0.702 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -62.8 | -27.9 | 179 | 0 | 0 | 0 | 0 | 0 | 114.5 | A24 V25 | A24-A28 WeakPolarHBondContact O-CB 3.45Å; A24-A28 PolarHBondContact O-N 3.32Å; A24-A28 VanDerWaalsContact O-N 3.11Å; V25-A28 PolarHBondContact O-N 3.07Å |
| 29 | L | 97.9 | Very high | 97.8 | Very high | 107 Ų | 107 | 97.4 Ų | 97.4 | 56% | 0.56 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -94.3 | -34.6 | -176.8 | -68.2 | 176.7 | 0 | 0 | 0 | 113.6 | V25 F26 D27 P33 | V25-L29 HydrophobicContact CG1-CD1 3.69Å; V25-L29 HydrophobicContact CG1-CG 4.32Å; V25-L29 WeakPolarHBondContact O-CB 3.46Å; V25-L29 VanDerWaalsContact O-CG 3.23Å; V25-L29 WeakPolarHBondContact O-CG 3.32Å; V25-L29 PolarHBondContact O-N 3.22Å; F26-L29 PolarHBondContact O-N 3.34Å; D27-L29 VanDerWaalsContact C-N 3.26Å; D27-L29 PolarHBondContact O-N 3.31Å; L29-P33 WeakPolarHBondContact O-CG 3.42Å |
| 30 | E | 97.8 | Very high | 97.8 | Very high | 115 Ų | 115 | 100.6 Ų | 100.6 | 54% | 0.537 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -111.7 | -21.7 | -168 | -61.4 | -65.9 | 162.6 | 0 | 0 | 113.7 | F26 P33 E34 | F26-E30 WeakPolarHBondContact O-CB 3.44Å; F26-E30 PolarHBondContact O-N 3.03Å; E30-P33 WeakPolarHBondContact O-CD 3.37Å; E30-E34 VanDerWaalsContact O-CB 3.26Å; E30-E34 WeakPolarHBondContact O-CB 3.24Å; E30-E34 PolarHBondContact O-N 3.19Å |
| 31 | S | 97.7 | Very high | 97.7 | Very high | 49 Ų | 49 | 99.6 Ų | 99.6 | 34% | 0.343 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -71 | -39 | -171.7 | -66.5 | 0 | 0 | 0 | 0 | 114.5 | D27 L35 | D27-S31 WeakPolarHBondContact O-CB 3.46Å; D27-S31 PolarHBondContact O-N 3.27Å; D27-S31 VanDerWaalsContact O-N 3.09Å; D27-S31 PolarHBondContact O-OG 3.47Å; D27-S31 WeakPolarHBondContact OD1-CB 3.26Å; D27-S31 PolarHBondContact OD1-OG 3.42Å; S31-L35 PolarHBondContact O-N 2.92Å |
| 32 | E | 97.6 | Very high | 97.6 | Very high | 142 Ų | 142 | 98.8 Ų | 98.8 | 66% | 0.664 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -69.6 | -48.7 | 174.2 | -178.8 | 180 | -176.4 | 0 | 0 | 111.8 | E34 L35 I36 | E32-E34 VanDerWaalsContact C-N 3.34Å; E32-E34 PolarHBondContact O-N 3.48Å; E32-L35 PolarHBondContact O-N 3.03Å; E32-I36 HydrophobicContact CG-CD1 3.85Å; E32-I36 HydrophobicContact CG-CG1 4.49Å; E32-I36 WeakPolarHBondContact O-CG1 3.39Å; E32-I36 PolarHBondContact O-N 2.93Å |
| 33 | P | 97.4 | Very high | 97.5 | Very high | 65 Ų | 65 | 102.7 Ų | 102.7 | 42% | 0.422 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -55.6 | -42.2 | 173.3 | -28.6 | 36.6 | 0 | 0 | 0 | 114.5 | L29 E30 I36 E37 | L29-P33 WeakPolarHBondContact O-CG 3.42Å; E30-P33 WeakPolarHBondContact O-CD 3.37Å; P33-I36 PolarHBondContact O-N 3.31Å; P33-E37 WeakPolarHBondContact O-CB 3.22Å; P33-E37 PolarHBondContact O-N 3.35Å |
| 34 | E | 97.1 | Very high | 97.4 | Very high | 132 Ų | 132 | 106.8 Ų | 106.8 | 62% | 0.617 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -60.6 | -46.1 | 177 | -176.6 | -172.3 | -177.4 | 0 | 0 | 111.2 | E30 E32 I36 E37 R38 | E30-E34 VanDerWaalsContact O-CB 3.26Å; E30-E34 WeakPolarHBondContact O-CB 3.24Å; E30-E34 PolarHBondContact O-N 3.19Å; E32-E34 VanDerWaalsContact C-N 3.34Å; E32-E34 PolarHBondContact O-N 3.48Å; E34-I36 VanDerWaalsContact C-N 3.34Å; E34-I36 PolarHBondContact O-N 3.17Å; E34-E37 PolarHBondContact O-N 2.84Å; E34-R38 VanDerWaalsContact O-CB 3.25Å; E34-R38 WeakPolarHBondContact O-CB 3.3Å; E34-R38 PolarHBondContact O-N 3.46Å |
| 35 | L | 97.3 | Very high | 97.3 | Very high | 97 Ų | 97 | 106.4 Ų | 106.4 | 51% | 0.508 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -62.5 | -42.7 | 179.2 | -174.1 | 68.3 | 0 | 0 | 0 | 111.4 | S31 E32 R38 Q39 | S31-L35 PolarHBondContact O-N 2.92Å; E32-L35 PolarHBondContact O-N 3.03Å; L35-R38 PolarHBondContact O-N 2.85Å; L35-Q39 VanDerWaalsContact O-CG 3.31Å; L35-Q39 WeakPolarHBondContact O-CG 3.29Å; L35-Q39 PolarHBondContact O-N 3.04Å |
| 36 | I | 97.4 | Very high | 97.2 | Very high | 94 Ų | 94 | 108.5 Ų | 108.5 | 48% | 0.482 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -64.4 | -46.2 | 177.7 | -67.1 | 167.8 | 0 | 0 | 0 | 110.6 | E32 P33 E34 Q39 R40 | E32-I36 HydrophobicContact CG-CD1 3.85Å; E32-I36 HydrophobicContact CG-CG1 4.49Å; E32-I36 WeakPolarHBondContact O-CG1 3.39Å; E32-I36 PolarHBondContact O-N 2.93Å; P33-I36 PolarHBondContact O-N 3.31Å; E34-I36 VanDerWaalsContact C-N 3.34Å; E34-I36 PolarHBondContact O-N 3.17Å; I36-Q39 PolarHBondContact O-N 3.49Å; I36-R40 WeakPolarHBondContact O-CB 3.38Å; I36-R40 PolarHBondContact O-N 2.81Å |
| 37 | E | 96.6 | Very high | 97.1 | Very high | 123 Ų | 123 | 107.3 Ų | 107.3 | 58% | 0.575 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -64.4 | -42.5 | 179.1 | -175.4 | 169.7 | -154.6 | 0 | 0 | 111.4 | P33 E34 R40 L41 | P33-E37 WeakPolarHBondContact O-CB 3.22Å; P33-E37 PolarHBondContact O-N 3.35Å; E34-E37 PolarHBondContact O-N 2.84Å; E37-R40 WeakPolarHBondContact O-CB 3.43Å; E37-R40 PolarHBondContact O-N 3.36Å; E37-L41 HydrophobicContact CG-CD1 3.98Å; E37-L41 HydrophobicContact CG-CG 4.31Å; E37-L41 WeakPolarHBondContact O-CG 3.48Å; E37-L41 PolarHBondContact O-N 2.92Å |
| 38 | R | 96.7 | Very high | 97 | Very high | 154 Ų | 154 | 105.9 Ų | 105.9 | 58% | 0.581 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -58 | -51 | 176 | 178.5 | 177.7 | 171.4 | 171.5 | -1.7 | 111.7 | E34 L35 R40 L41 E42 | E34-R38 VanDerWaalsContact O-CB 3.25Å; E34-R38 WeakPolarHBondContact O-CB 3.3Å; E34-R38 PolarHBondContact O-N 3.46Å; L35-R38 PolarHBondContact O-N 2.85Å; R38-R40 VanDerWaalsContact C-N 3.29Å; R38-R40 PolarHBondContact O-N 3.37Å; R38-L41 PolarHBondContact O-N 3.2Å; R38-E42 HydrophobicContact CG-CG 4.44Å; R38-E42 WeakPolarHBondContact CG-OE1 3.45Å; R38-E42 IonicContact CZ-OE1 3.24Å; R38-E42 IonicContact NE-OE1 2.85Å; R38-E42 PolarHBondContact NE-OE1 3.09Å; R38-E42 IonicContact NH2-OE1 3.46Å; R38-E42 PolarHBondContact NH2-OE1 3.34Å; R38-E42 WeakPolarHBondContact O-CG 3.48Å; R38-E42 PolarHBondContact O-N 2.91Å |
| 39 | Q | 97.4 | Very high | 96.9 | Very high | 105 Ų | 105 | 104.5 Ų | 104.5 | 49% | 0.491 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -59.1 | -42 | 177.8 | -72.8 | 175.7 | -0.5 | 0 | 0 | 111.5 | L35 I36 L41 E42 L43 | L35-Q39 VanDerWaalsContact O-CG 3.31Å; L35-Q39 WeakPolarHBondContact O-CG 3.29Å; L35-Q39 PolarHBondContact O-N 3.04Å; I36-Q39 PolarHBondContact O-N 3.49Å; Q39-L41 PolarHBondContact O-N 3.44Å; Q39-E42 PolarHBondContact O-N 3.4Å; Q39-L43 WeakPolarHBondContact O-CG 3.41Å; Q39-L43 PolarHBondContact O-N 3.29Å |
| 40 | R | 97.8 | Very high | 96.8 | Very high | 172 Ų | 172 | 102.7 Ų | 102.7 | 65% | 0.649 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -62.5 | -42.1 | 177.1 | -174.8 | -176.9 | -176.8 | -174.3 | 2.9 | 112.4 | I36 E37 R38 R44 | I36-R40 WeakPolarHBondContact O-CB 3.38Å; I36-R40 PolarHBondContact O-N 2.81Å; E37-R40 WeakPolarHBondContact O-CB 3.43Å; E37-R40 PolarHBondContact O-N 3.36Å; R38-R40 VanDerWaalsContact C-N 3.29Å; R38-R40 PolarHBondContact O-N 3.37Å; R40-R44 WeakPolarHBondContact O-CB 3.48Å; R40-R44 PolarHBondContact O-N 3.39Å; R40-R44 VanDerWaalsContact O-N 3.09Å |
| 41 | L | 96.9 | Very high | 96.8 | Very high | 101 Ų | 101 | 105.5 Ų | 105.5 | 53% | 0.529 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -70.4 | -39.9 | 179 | -71.6 | 174.2 | 0 | 0 | 0 | 111.9 | E37 R38 Q39 R44 Q45 | E37-L41 HydrophobicContact CG-CD1 3.98Å; E37-L41 HydrophobicContact CG-CG 4.31Å; E37-L41 WeakPolarHBondContact O-CG 3.48Å; E37-L41 PolarHBondContact O-N 2.92Å; R38-L41 PolarHBondContact O-N 3.2Å; Q39-L41 PolarHBondContact O-N 3.44Å; L41-R44 PolarHBondContact O-N 3.34Å; L41-Q45 VanDerWaalsContact O-CB 3.26Å; L41-Q45 WeakPolarHBondContact O-CB 3.37Å; L41-Q45 PolarHBondContact O-N 3.01Å |
| 42 | E | 95.8 | Very high | 96.7 | Very high | 76 Ų | 76 | 110.4 Ų | 110.4 | 36% | 0.355 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.4 | -43.6 | 175.9 | -73.9 | 174.8 | -179.8 | 0 | 0 | 111.5 | R38 Q39 Q45 Q46 | R38-E42 HydrophobicContact CG-CG 4.44Å; R38-E42 WeakPolarHBondContact CG-OE1 3.45Å; R38-E42 IonicContact CZ-OE1 3.24Å; R38-E42 IonicContact NE-OE1 2.85Å; R38-E42 PolarHBondContact NE-OE1 3.09Å; R38-E42 IonicContact NH2-OE1 3.46Å; R38-E42 PolarHBondContact NH2-OE1 3.34Å; R38-E42 WeakPolarHBondContact O-CG 3.48Å; R38-E42 PolarHBondContact O-N 2.91Å; Q39-E42 PolarHBondContact O-N 3.4Å; E42-Q45 WeakPolarHBondContact O-CB 3.35Å; E42-Q45 PolarHBondContact O-N 3.4Å; E42-Q46 WeakPolarHBondContact O-CG 3.39Å; E42-Q46 PolarHBondContact O-N 3.34Å |
| 43 | L | 96.8 | Very high | 96.7 | Very high | 104 Ų | 104 | 110.8 Ų | 110.8 | 55% | 0.545 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -61.4 | -48.5 | 174 | -72.8 | 171.4 | 0 | 0 | 0 | 111.5 | Q39 Q45 Q46 E47 | Q39-L43 WeakPolarHBondContact O-CG 3.41Å; Q39-L43 PolarHBondContact O-N 3.29Å; L43-Q45 VanDerWaalsContact C-N 3.28Å; L43-Q45 PolarHBondContact O-N 3.27Å; L43-Q46 PolarHBondContact O-N 3.34Å; L43-Q46 VanDerWaalsContact O-N 3.13Å; L43-E47 WeakPolarHBondContact O-CG 3.24Å; L43-E47 PolarHBondContact O-N 3.41Å |
| 44 | R | 96.6 | Very high | 96.7 | Very high | 144 Ų | 144 | 110.5 Ų | 110.5 | 54% | 0.543 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -65.2 | -33.9 | -179.8 | -163 | 165.9 | -172.4 | 169.9 | 1.5 | 112.3 | R40 L41 L48 | R40-R44 WeakPolarHBondContact O-CB 3.48Å; R40-R44 PolarHBondContact O-N 3.39Å; R40-R44 VanDerWaalsContact O-N 3.09Å; L41-R44 PolarHBondContact O-N 3.34Å; R44-L48 HydrophobicContact CG-CD1 4.31Å; R44-L48 WeakPolarHBondContact O-CB 3.46Å; R44-L48 WeakPolarHBondContact O-CG 3.19Å; R44-L48 PolarHBondContact O-N 2.83Å |
| 45 | Q | 95.3 | Very high | 96.6 | Very high | 54 Ų | 54 | 108 Ų | 108 | 25% | 0.252 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -61.4 | -47.3 | 172.3 | 179.8 | -168.6 | 2.5 | 0 | 0 | 110.8 | L41 E42 L43 L48 R49 Y59 | L41-Q45 VanDerWaalsContact O-CB 3.26Å; L41-Q45 WeakPolarHBondContact O-CB 3.37Å; L41-Q45 PolarHBondContact O-N 3.01Å; E42-Q45 WeakPolarHBondContact O-CB 3.35Å; E42-Q45 PolarHBondContact O-N 3.4Å; L43-Q45 VanDerWaalsContact C-N 3.28Å; L43-Q45 PolarHBondContact O-N 3.27Å; Q45-L48 PolarHBondContact O-N 3.34Å; Q45-R49 WeakPolarHBondContact O-CB 3.37Å; Q45-R49 VanDerWaalsContact O-CG 3.24Å; Q45-R49 WeakPolarHBondContact O-CG 3.27Å; Q45-R49 PolarHBondContact O-N 3.33Å; Q45-Y59 HydrophobicContact CG-CE1 4.25Å; Q45-Y59 HydrophobicContact CG-CE2 3.84Å; Q45-Y59 VanDerWaalsContact NE2-CZ 3.28Å; Q45-Y59 PolarHBondContact NE2-OH 2.84Å |
| 46 | Q | 95.4 | Very high | 96.4 | Very high | 119 Ų | 119 | 107.9 Ų | 107.9 | 56% | 0.556 | 51% | 0.505 | S | S | * | . | H | α-helix | trans | -63.1 | -44.9 | 178.1 | -69.3 | 174.2 | 13.7 | 0 | 0 | 111.9 | E42 L43 L48 R49 A50 | E42-Q46 WeakPolarHBondContact O-CG 3.39Å; E42-Q46 PolarHBondContact O-N 3.34Å; L43-Q46 PolarHBondContact O-N 3.34Å; L43-Q46 VanDerWaalsContact O-N 3.13Å; Q46-L48 PolarHBondContact O-N 3.05Å; Q46-R49 PolarHBondContact O-N 3.25Å; Q46-A50 PolarHBondContact O-N 3.39Å |
| 47 | E | 96.8 | Very high | 96.3 | Very high | 115 Ų | 115 | 105.4 Ų | 105.4 | 54% | 0.537 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -58.1 | -46.1 | 176.1 | -73.1 | 177.5 | -177.7 | 0 | 0 | 112.3 | L43 A50 R51 | L43-E47 WeakPolarHBondContact O-CG 3.24Å; L43-E47 PolarHBondContact O-N 3.41Å; E47-A50 PolarHBondContact O-N 3.14Å; E47-R51 VanDerWaalsContact O-CB 3.24Å; E47-R51 WeakPolarHBondContact O-CB 3.42Å; E47-R51 PolarHBondContact O-N 3.46Å |
| 48 | L | 96.6 | Very high | 96.2 | Very high | 70 Ų | 70 | 100.8 Ų | 100.8 | 37% | 0.366 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -67 | -40.8 | 178.7 | -70.7 | 170.6 | 0 | 0 | 0 | 111.2 | R44 Q45 Q46 A50 R51 Y52 | R44-L48 HydrophobicContact CG-CD1 4.31Å; R44-L48 WeakPolarHBondContact O-CB 3.46Å; R44-L48 WeakPolarHBondContact O-CG 3.19Å; R44-L48 PolarHBondContact O-N 2.83Å; Q45-L48 PolarHBondContact O-N 3.34Å; Q46-L48 PolarHBondContact O-N 3.05Å; L48-A50 PolarHBondContact O-N 3.23Å; L48-R51 PolarHBondContact O-N 3.28Å; L48-Y52 HydrophobicContact CD2-CD2 4.38Å; L48-Y52 HydrophobicContact CD2-CE2 3.8Å; L48-Y52 WeakPolarHBondContact O-CD2 3.21Å; L48-Y52 PolarHBondContact O-N 3.45Å |
| 49 | R | 96.1 | Very high | 96.2 | Very high | 56 Ų | 56 | 95.9 Ų | 95.9 | 21% | 0.211 | 47% | 0.471 | C | S | . | . | H | α-helix | trans | -61.4 | -43.7 | 176.5 | -75.3 | 172.7 | 60.1 | 178.3 | 2.7 | 112.1 | Q45 Q46 N53 L54 Y59 | Q45-R49 WeakPolarHBondContact O-CB 3.37Å; Q45-R49 VanDerWaalsContact O-CG 3.24Å; Q45-R49 WeakPolarHBondContact O-CG 3.27Å; Q45-R49 PolarHBondContact O-N 3.33Å; Q46-R49 PolarHBondContact O-N 3.25Å; R49-N53 WeakPolarHBondContact O-CA 3.5Å; R49-N53 PolarHBondContact O-N 3.3Å; R49-N53 VanDerWaalsContact O-N 3.08Å; R49-L54 HydrophobicContact CB-CB 4.37Å; R49-L54 HydrophobicContact CG-CB 4.29Å; R49-L54 PolarHBondContact O-N 3.36Å; R49-Y59 HydrophobicContact CG-CD2 3.77Å; R49-Y59 HydrophobicContact CG-CE2 4.42Å; R49-Y59 HydrophobicContact CG-CG 4.2Å |
| 50 | A | 96.1 | Very high | 96.1 | Very high | 70 Ų | 70 | 95.1 Ų | 95.1 | 58% | 0.579 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -67 | -45 | 176 | 0 | 0 | 0 | 0 | 0 | 111.7 | Q46 E47 L48 Y52 N53 | Q46-A50 PolarHBondContact O-N 3.39Å; E47-A50 PolarHBondContact O-N 3.14Å; L48-A50 PolarHBondContact O-N 3.23Å; A50-Y52 VanDerWaalsContact C-N 3.29Å; A50-Y52 PolarHBondContact O-N 3.04Å; A50-N53 PolarHBondContact O-N 3.5Å; A50-N53 PolarHBondContact O-OD1 2.85Å |
| 51 | R | 97.3 | Very high | 96 | Very high | 173 Ų | 173 | 92.7 Ų | 92.7 | 65% | 0.653 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -60.2 | -37.2 | -179.2 | -175.9 | 179.2 | -63.7 | -173.7 | 1.1 | 113.2 | E47 L48 | E47-R51 VanDerWaalsContact O-CB 3.24Å; E47-R51 WeakPolarHBondContact O-CB 3.42Å; E47-R51 PolarHBondContact O-N 3.46Å; L48-R51 PolarHBondContact O-N 3.28Å |
| 52 | Y | 96.5 | Very high | 95.9 | Very high | 152 Ų | 152 | 92.2 Ų | 92.2 | 60% | 0.596 | 46% | 0.461 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -104.2 | 12.1 | -177.9 | -62.7 | -71.2 | 0 | 0 | 0 | 113.5 | L48 A50 L54 | L48-Y52 HydrophobicContact CD2-CD2 4.38Å; L48-Y52 HydrophobicContact CD2-CE2 3.8Å; L48-Y52 WeakPolarHBondContact O-CD2 3.21Å; L48-Y52 PolarHBondContact O-N 3.45Å; A50-Y52 VanDerWaalsContact C-N 3.29Å; A50-Y52 PolarHBondContact O-N 3.04Å; Y52-L54 VanDerWaalsContact C-N 3.29Å; Y52-L54 PolarHBondContact O-N 2.88Å |
| 53 | N | 96.9 | Very high | 95.9 | Very high | 151 Ų | 151 | 92.8 Ų | 92.8 | 81% | 0.807 | 46% | 0.463 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 50.1 | 44.8 | -179.7 | -65.3 | -30 | 0 | 0 | 0 | 113.6 | R49 A50 | R49-N53 WeakPolarHBondContact O-CA 3.5Å; R49-N53 PolarHBondContact O-N 3.3Å; R49-N53 VanDerWaalsContact O-N 3.08Å; A50-N53 PolarHBondContact O-N 3.5Å; A50-N53 PolarHBondContact O-OD1 2.85Å |
| 54 | L | 96.4 | Very high | 95.8 | Very high | 58 Ų | 58 | 94 Ų | 94 | 30% | 0.304 | 46% | 0.461 | S | S | . | . | trans | -87 | 121.2 | -179.2 | -67.7 | 166.4 | 0 | 0 | 0 | 111.4 | R49 Y52 | R49-L54 HydrophobicContact CB-CB 4.37Å; R49-L54 HydrophobicContact CG-CB 4.29Å; R49-L54 PolarHBondContact O-N 3.36Å; Y52-L54 VanDerWaalsContact C-N 3.29Å; Y52-L54 PolarHBondContact O-N 2.88Å | ||
| 55 | S | 95.6 | Very high | 95.8 | Very high | 81 Ų | 81 | 90.7 Ų | 90.7 | 57% | 0.566 | 46% | 0.456 | S | S | * | . | trans | -66.2 | 162.3 | 167.1 | 72.2 | 0 | 0 | 0 | 0 | 111 | G57 G58 Y59 | S55-G57 PolarHBondContact O-N 3.16Å; S55-G58 PolarHBondContact O-N 3.39Å; S55-G58 PolarHBondContact OG-N 3.06Å; S55-Y59 PolarHBondContact O-N 3.45Å | ||
| 56 | Q | 93.6 | Very high | 95.7 | Very high | 93 Ų | 93 | 91.5 Ų | 91.5 | 44% | 0.435 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -55.9 | -49.9 | 177.6 | -178.8 | 66.4 | 28 | 0 | 0 | 111.8 | G58 Y59 E60 | Q56-G58 VanDerWaalsContact C-N 3.35Å; Q56-G58 PolarHBondContact O-N 3.03Å; Q56-Y59 PolarHBondContact O-N 3.24Å; Q56-E60 WeakPolarHBondContact CG-OE1 3.39Å; Q56-E60 PolarHBondContact NE2-OE1 3.37Å; Q56-E60 WeakPolarHBondContact O-CG 3.36Å; Q56-E60 PolarHBondContact O-N 2.89Å; Q56-E60 VanDerWaalsContact O-N 3.09Å |
| 57 | G | 94.7 | Very high | 95.6 | Very high | 43 Ų | 43 | 91 Ų | 91 | 44% | 0.443 | 47% | 0.465 | S | S | . | . | H | α-helix | trans | -64.9 | -36.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 113.3 | S55 E60 E61 | S55-G57 PolarHBondContact O-N 3.16Å; G57-E60 PolarHBondContact O-N 2.85Å; G57-E61 PolarHBondContact O-N 3.24Å |
| 58 | G | 95.3 | Very high | 95.4 | Very high | 26 Ų | 26 | 94.4 Ų | 94.4 | 27% | 0.268 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -65.9 | -37.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | S55 Q56 L62 | S55-G58 PolarHBondContact O-N 3.39Å; S55-G58 PolarHBondContact OG-N 3.06Å; Q56-G58 VanDerWaalsContact C-N 3.35Å; Q56-G58 PolarHBondContact O-N 3.03Å; G58-L62 WeakPolarHBondContact O-CB 3.5Å; G58-L62 PolarHBondContact O-N 3.17Å; G58-L62 VanDerWaalsContact O-N 3.12Å |
| 59 | Y | 95.8 | Very high | 95.2 | Very high | 51 Ų | 51 | 95.1 Ų | 95.1 | 20% | 0.2 | 48% | 0.477 | C | S | . | . | H | α-helix | trans | -64.9 | -46.1 | 173.6 | 178.2 | -93.1 | 0 | 0 | 0 | 111.8 | Q45 R49 S55 Q56 E61 L62 E63 | Q45-Y59 HydrophobicContact CG-CE1 4.25Å; Q45-Y59 HydrophobicContact CG-CE2 3.84Å; Q45-Y59 VanDerWaalsContact NE2-CZ 3.28Å; Q45-Y59 PolarHBondContact NE2-OH 2.84Å; R49-Y59 HydrophobicContact CG-CD2 3.77Å; R49-Y59 HydrophobicContact CG-CE2 4.42Å; R49-Y59 HydrophobicContact CG-CG 4.2Å; S55-Y59 PolarHBondContact O-N 3.45Å; Q56-Y59 PolarHBondContact O-N 3.24Å; Y59-E61 VanDerWaalsContact C-N 3.31Å; Y59-E61 PolarHBondContact O-N 3.4Å; Y59-L62 PolarHBondContact O-N 3.38Å; Y59-E63 HydrophobicContact CE1-CB 4.36Å; Y59-E63 WeakPolarHBondContact O-CB 3.36Å; Y59-E63 PolarHBondContact O-N 3.36Å |
| 60 | E | 95.4 | Very high | 94.9 | Very high | 88 Ų | 88 | 99.9 Ų | 99.9 | 41% | 0.411 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -62.5 | -36.9 | 179.5 | -72.2 | 170.6 | -164.8 | 0 | 0 | 112.7 | Q56 G57 R64 | Q56-E60 WeakPolarHBondContact CG-OE1 3.39Å; Q56-E60 PolarHBondContact NE2-OE1 3.37Å; Q56-E60 WeakPolarHBondContact O-CG 3.36Å; Q56-E60 PolarHBondContact O-N 2.89Å; Q56-E60 VanDerWaalsContact O-N 3.09Å; G57-E60 PolarHBondContact O-N 2.85Å; E60-R64 WeakPolarHBondContact O-CB 3.46Å; E60-R64 PolarHBondContact O-N 3.11Å |
| 61 | E | 95.4 | Very high | 94.4 | Very high | 122 Ų | 122 | 99.1 Ų | 99.1 | 57% | 0.57 | 49% | 0.488 | S | S | * | . | H | α-helix | trans | -66.4 | -45.4 | 174.2 | -173.5 | 171.8 | -167.5 | 0 | 0 | 111.7 | G57 Y59 E63 R64 V65 | G57-E61 PolarHBondContact O-N 3.24Å; Y59-E61 VanDerWaalsContact C-N 3.31Å; Y59-E61 PolarHBondContact O-N 3.4Å; E61-E63 PolarHBondContact O-N 3.05Å; E61-R64 WeakPolarHBondContact O-CB 3.26Å; E61-R64 PolarHBondContact O-N 3.08Å; E61-V65 WeakPolarHBondContact O-CG2 3.39Å; E61-V65 PolarHBondContact O-N 3.43Å; E61-V65 VanDerWaalsContact O-N 3.11Å |
| 62 | L | 95.6 | Very high | 94 | Very high | 91 Ų | 91 | 97 Ų | 97 | 48% | 0.476 | 49% | 0.486 | S | S | . | . | H | α-helix | trans | -62.4 | -43.7 | 177 | -172.2 | 65.9 | 0 | 0 | 0 | 111.4 | G58 Y59 R64 V65 V66 | G58-L62 WeakPolarHBondContact O-CB 3.5Å; G58-L62 PolarHBondContact O-N 3.17Å; G58-L62 VanDerWaalsContact O-N 3.12Å; Y59-L62 PolarHBondContact O-N 3.38Å; L62-R64 VanDerWaalsContact C-N 3.34Å; L62-R64 PolarHBondContact O-N 2.86Å; L62-V65 PolarHBondContact O-N 2.89Å; L62-V66 VanDerWaalsContact O-CG2 3.31Å; L62-V66 WeakPolarHBondContact O-CG2 3.41Å; L62-V66 PolarHBondContact O-N 3.03Å |
| 63 | E | 95.3 | Very high | 93.4 | Very high | 88 Ų | 88 | 97.3 Ų | 97.3 | 41% | 0.411 | 49% | 0.49 | S | S | . | . | H | α-helix | trans | -57.9 | -46.1 | 175.9 | -178.1 | 173.6 | -154.6 | 0 | 0 | 111.1 | Y59 E61 V65 V66 L67 | Y59-E63 HydrophobicContact CE1-CB 4.36Å; Y59-E63 WeakPolarHBondContact O-CB 3.36Å; Y59-E63 PolarHBondContact O-N 3.36Å; E61-E63 PolarHBondContact O-N 3.05Å; E63-V65 VanDerWaalsContact C-N 3.31Å; E63-V65 PolarHBondContact O-N 3.16Å; E63-V66 PolarHBondContact O-N 3.42Å; E63-L67 HydrophobicContact CG-CD1 3.96Å; E63-L67 HydrophobicContact CG-CG 4.36Å; E63-L67 WeakPolarHBondContact O-CB 3.18Å; E63-L67 WeakPolarHBondContact O-CG 3.31Å; E63-L67 PolarHBondContact O-N 3.05Å |
| 64 | R | 95.1 | Very high | 92.7 | Very high | 130 Ų | 130 | 90.9 Ų | 90.9 | 49% | 0.491 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -58.3 | -42.2 | 176.4 | -169.4 | -171.3 | -58 | 129.3 | 3.3 | 112.2 | E60 E61 L62 R68 | E60-R64 WeakPolarHBondContact O-CB 3.46Å; E60-R64 PolarHBondContact O-N 3.11Å; E61-R64 WeakPolarHBondContact O-CB 3.26Å; E61-R64 PolarHBondContact O-N 3.08Å; L62-R64 VanDerWaalsContact C-N 3.34Å; L62-R64 PolarHBondContact O-N 2.86Å; R64-R68 WeakPolarHBondContact O-CB 3.25Å; R64-R68 WeakPolarHBondContact O-CG 3.4Å; R64-R68 PolarHBondContact O-N 3.32Å; R64-R68 VanDerWaalsContact O-N 3.11Å |
| 65 | V | 95.8 | Very high | 92.4 | Very high | 73 Ų | 73 | 88.7 Ų | 88.7 | 44% | 0.442 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -66.7 | -45.6 | 177.4 | 174.4 | 0 | 0 | 0 | 0 | 110.8 | E61 L62 E63 L67 R68 L69 | E61-V65 WeakPolarHBondContact O-CG2 3.39Å; E61-V65 PolarHBondContact O-N 3.43Å; E61-V65 VanDerWaalsContact O-N 3.11Å; L62-V65 PolarHBondContact O-N 2.89Å; E63-V65 VanDerWaalsContact C-N 3.31Å; E63-V65 PolarHBondContact O-N 3.16Å; V65-L67 PolarHBondContact O-N 2.95Å; V65-R68 PolarHBondContact O-N 2.88Å; V65-L69 HydrophobicContact CG1-CD1 3.75Å; V65-L69 HydrophobicContact CG1-CG 4.33Å; V65-L69 WeakPolarHBondContact O-CB 3.35Å; V65-L69 WeakPolarHBondContact O-CG 3.46Å; V65-L69 PolarHBondContact O-N 3.22Å |
| 66 | V | 95.1 | Very high | 92.1 | Very high | 72 Ų | 72 | 88.9 Ų | 88.9 | 44% | 0.436 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -61.3 | -43.9 | 179.2 | 170.8 | 0 | 0 | 0 | 0 | 111.5 | L62 E63 L69 K70 | L62-V66 VanDerWaalsContact O-CG2 3.31Å; L62-V66 WeakPolarHBondContact O-CG2 3.41Å; L62-V66 PolarHBondContact O-N 3.03Å; E63-V66 PolarHBondContact O-N 3.42Å; V66-L69 PolarHBondContact O-N 2.84Å; V66-K70 PolarHBondContact O-N 3.45Å; V66-K70 VanDerWaalsContact O-N 3.17Å |
| 67 | L | 92.6 | Very high | 91.9 | Very high | 107 Ų | 107 | 85 Ų | 85 | 56% | 0.56 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -64 | -43.2 | 177.5 | -70.8 | 173.4 | 0 | 0 | 0 | 111.7 | E63 V65 L69 K70 | E63-L67 HydrophobicContact CG-CD1 3.96Å; E63-L67 HydrophobicContact CG-CG 4.36Å; E63-L67 WeakPolarHBondContact O-CB 3.18Å; E63-L67 WeakPolarHBondContact O-CG 3.31Å; E63-L67 PolarHBondContact O-N 3.05Å; V65-L67 PolarHBondContact O-N 2.95Å; L67-L69 VanDerWaalsContact C-N 3.31Å; L67-L69 PolarHBondContact O-N 3.24Å; L67-K70 WeakPolarHBondContact O-CB 3.3Å; L67-K70 PolarHBondContact O-N 3.21Å |
| 68 | R | 91.9 | Very high | 91.9 | Very high | 187 Ų | 187 | 88.5 Ų | 88.5 | 71% | 0.706 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -66.4 | -31.2 | 176 | -75.5 | -177.5 | 177.3 | -173.7 | 0.2 | 113.1 | R64 V65 P71 H72 | R64-R68 WeakPolarHBondContact O-CB 3.25Å; R64-R68 WeakPolarHBondContact O-CG 3.4Å; R64-R68 PolarHBondContact O-N 3.32Å; R64-R68 VanDerWaalsContact O-N 3.11Å; V65-R68 PolarHBondContact O-N 2.88Å; R68-P71 WeakPolarHBondContact O-CD 3.46Å; R68-H72 PolarHBondContact O-CD2 3.46Å |
| 69 | L | 92.6 | Very high | 91.8 | Very high | 85 Ų | 85 | 95 Ų | 95 | 45% | 0.445 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -77.5 | -19.9 | 177.9 | -75.7 | 172.8 | 0 | 0 | 0 | 113.6 | V65 V66 L67 H72 K73 | V65-L69 HydrophobicContact CG1-CD1 3.75Å; V65-L69 HydrophobicContact CG1-CG 4.33Å; V65-L69 WeakPolarHBondContact O-CB 3.35Å; V65-L69 WeakPolarHBondContact O-CG 3.46Å; V65-L69 PolarHBondContact O-N 3.22Å; V66-L69 PolarHBondContact O-N 2.84Å; L67-L69 VanDerWaalsContact C-N 3.31Å; L67-L69 PolarHBondContact O-N 3.24Å; L69-H72 CarbonylContact O-C 3.6Å; L69-H72 WeakPolarHBondContact O-CA 3.39Å; L69-H72 WeakPolarHBondContact O-CB 3.28Å; L69-H72 PolarHBondContact O-N 3.35Å; L69-K73 PolarHBondContact O-N 2.93Å |
| 70 | K | 90.1 | Very high | 91.7 | Very high | 156 Ų | 156 | 100.9 Ų | 100.9 | 68% | 0.678 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -46.9 | -52.8 | -177.3 | -170.1 | 178.8 | -179.9 | -178 | 0 | 114.1 | V66 L67 H72 K73 | V66-K70 PolarHBondContact O-N 3.45Å; V66-K70 VanDerWaalsContact O-N 3.17Å; L67-K70 WeakPolarHBondContact O-CB 3.3Å; L67-K70 PolarHBondContact O-N 3.21Å; K70-H72 VanDerWaalsContact C-N 3.26Å; K70-H72 PolarHBondContact O-N 2.84Å; K70-K73 PolarHBondContact O-N 2.99Å |
| 71 | P | 86.6 | Confident | 91.6 | Very high | 54 Ų | 54 | 97.7 Ų | 97.7 | 35% | 0.351 | 46% | 0.461 | S | S | . | . | H | α-helix | trans | -67.9 | -23.6 | 178.6 | 27 | -36.2 | 0 | 0 | 0 | 113.9 | R68 | R68-P71 WeakPolarHBondContact O-CD 3.46Å |
| 72 | H | 87.6 | Confident | 91.5 | Very high | 130 Ų | 130 | 92 Ų | 92 | 60% | 0.602 | 44% | 0.435 | S | S | * | . | H | α-helix | trans | -84.2 | -18.9 | 179.7 | -61.1 | -66.3 | 0 | 0 | 0 | 113.1 | R68 L69 K70 A74 G75 | R68-H72 PolarHBondContact O-CD2 3.46Å; L69-H72 CarbonylContact O-C 3.6Å; L69-H72 WeakPolarHBondContact O-CA 3.39Å; L69-H72 WeakPolarHBondContact O-CB 3.28Å; L69-H72 PolarHBondContact O-N 3.35Å; K70-H72 VanDerWaalsContact C-N 3.26Å; K70-H72 PolarHBondContact O-N 2.84Å; H72-A74 PolarHBondContact O-N 2.95Å; H72-G75 PolarHBondContact O-N 3.44Å |
| 73 | K | 85.1 | Confident | 91.6 | Very high | 157 Ų | 157 | 89.8 Ų | 89.8 | 68% | 0.683 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -62.6 | -31 | 177.4 | -75 | -175 | 178.1 | -176.6 | 0 | 113 | L69 K70 G75 | L69-K73 PolarHBondContact O-N 2.93Å; K70-K73 PolarHBondContact O-N 2.99Å; K73-G75 PolarHBondContact O-N 3.03Å |
| 74 | A | 82.4 | Confident | 91.7 | Very high | 17 Ų | 17 | 90 Ų | 90 | 14% | 0.14 | 43% | 0.427 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.7 | -0.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | H72 Q209 | H72-A74 PolarHBondContact O-N 2.95Å; A74-Q209 WeakPolarHBondContact CA-O 3.42Å; A74-Q209 HydrophobicContact CB-CB 4Å; A74-Q209 VanDerWaalsContact CB-O 3.22Å; A74-Q209 WeakPolarHBondContact CB-O 3.4Å |
| 75 | G | 88.6 | Confident | 91.8 | Very high | 12 Ų | 12 | 83.8 Ų | 83.8 | 12% | 0.124 | 40% | 0.403 | C | S | . | . | trans | 98.9 | -157.3 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | H72 K73 Q77 | H72-G75 PolarHBondContact O-N 3.44Å; K73-G75 PolarHBondContact O-N 3.03Å; G75-Q77 PolarHBondContact O-N 2.93Å | ||
| 76 | V | 89.3 | Confident | 91.8 | Very high | 84 Ų | 84 | 81.7 Ų | 81.7 | 51% | 0.509 | 39% | 0.388 | S | S | . | . | trans | -82.6 | 105.8 | -174.5 | -172.6 | 0 | 0 | 0 | 0 | 110.8 | R79 Q215 | V76-R79 HydrophobicContact CB-CG 4.44Å; V76-R79 HydrophobicContact CG1-CG 3.59Å; V76-Q215 PolarHBondContact O-NE2 3.18Å | ||
| 77 | Q | 90.7 | Very high | 92 | Very high | 13 Ų | 13 | 79.3 Ų | 79.3 | 6% | 0.061 | 38% | 0.376 | C | S | . | . | trans | -84.9 | -21.5 | -176.2 | -57.7 | -61.9 | -17.8 | 0 | 0 | 114.9 | G75 G82 A99 | G75-Q77 PolarHBondContact O-N 2.93Å; Q77-G82 CarbonylContact O-C 3.26Å; Q77-G82 VanDerWaalsContact O-C 3.26Å; Q77-G82 WeakPolarHBondContact O-CA 3.37Å; Q77-A99 HydrophobicContact CB-CB 4.25Å | ||
| 78 | W | 93.8 | Very high | 92.2 | Very high | 116 Ų | 116 | 74.5 Ų | 74.5 | 44% | 0.439 | 35% | 0.351 | S | S | . | . | S | Bend | trans | -109 | 28.5 | -171.2 | -67.1 | 107 | 0 | 0 | 0 | 114.2 | F86 A99 P101 | W78-F86 HydrophobicContact CH2-CB 4.35Å; W78-F86 AromaticContact CH2-CD1 3.65Å; W78-F86 HydrophobicContact CH2-CD1 3.65Å; W78-F86 AromaticContact CH2-CD2 3.82Å; W78-F86 HydrophobicContact CH2-CD2 3.82Å; W78-F86 AromaticContact CH2-CE1 3.84Å; W78-F86 HydrophobicContact CH2-CE1 3.84Å; W78-F86 HydrophobicContact CH2-CE2 4.01Å; W78-F86 AromaticContact CH2-CG 3.64Å; W78-F86 HydrophobicContact CH2-CG 3.64Å; W78-F86 HydrophobicContact CH2-CZ 4.02Å; W78-F86 HydrophobicContact CZ3-CB 4.25Å; W78-F86 AromaticContact CZ3-CD1 3.67Å; W78-F86 HydrophobicContact CZ3-CD1 3.67Å; W78-F86 HydrophobicContact CZ3-CD2 4.5Å; W78-F86 HydrophobicContact CZ3-CE1 4.16Å; W78-F86 AromaticContact CZ3-CG 3.87Å; W78-F86 HydrophobicContact CZ3-CG 3.87Å; W78-A99 HydrophobicContact CZ2-CB 4.34Å; W78-P101 HydrophobicContact CH2-CG 4.37Å |
| 79 | R | 93.3 | Very high | 92.5 | Very high | 163 Ų | 163 | 65.8 Ų | 65.8 | 62% | 0.615 | 32% | 0.318 | S | S | * | . | S | Bend | trans | -88.4 | 170.8 | 162.8 | -69.3 | -71.1 | -176.2 | 158.4 | 2.1 | 109.5 | V76 A81 G82 S83 | V76-R79 HydrophobicContact CB-CG 4.44Å; V76-R79 HydrophobicContact CG1-CG 3.59Å; R79-A81 VanDerWaalsContact C-N 3.33Å; R79-A81 PolarHBondContact O-N 3.29Å; R79-A81 VanDerWaalsContact O-N 3.14Å; R79-G82 PolarHBondContact O-N 3.14Å; R79-S83 PolarHBondContact O-N 3.12Å; R79-S83 PolarHBondContact O-OG 3.36Å |
| 80 | F | 94.1 | Very high | 92.7 | Very high | 174 Ų | 174 | 62.7 Ų | 62.7 | 76% | 0.763 | 30% | 0.303 | S | S | * | . | H | α-helix | trans | -47.3 | -49.4 | -172.6 | -177 | -98.9 | 0 | 0 | 0 | 114.3 | G82 S83 F84 | F80-G82 PolarHBondContact O-N 3.45Å; F80-S83 PolarHBondContact O-N 2.84Å; F80-F84 VanDerWaalsContact O-CB 3.29Å; F80-F84 WeakPolarHBondContact O-CB 3.38Å; F80-F84 PolarHBondContact O-N 3.44Å |
| 81 | A | 93.1 | Very high | 93.1 | Very high | 21 Ų | 21 | 56.9 Ų | 56.9 | 17% | 0.174 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -60.3 | -44 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113 | R79 F84 Y85 L214 V221 | R79-A81 VanDerWaalsContact C-N 3.33Å; R79-A81 PolarHBondContact O-N 3.29Å; R79-A81 VanDerWaalsContact O-N 3.14Å; A81-F84 PolarHBondContact O-N 3.39Å; A81-Y85 WeakPolarHBondContact O-CB 3.32Å; A81-Y85 PolarHBondContact O-N 2.93Å; A81-L214 HydrophobicContact CB-CD2 4.36Å; A81-V221 HydrophobicContact CB-CG1 4.43Å |
| 82 | G | 94.3 | Very high | 93.6 | Very high | 3 Ų | 3 | 54.6 Ų | 54.6 | 3% | 0.031 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -74.5 | -36.7 | 179 | 0 | 0 | 0 | 0 | 0 | 113.3 | Q77 R79 F80 F84 Y85 F86 | Q77-G82 CarbonylContact O-C 3.26Å; Q77-G82 VanDerWaalsContact O-C 3.26Å; Q77-G82 WeakPolarHBondContact O-CA 3.37Å; R79-G82 PolarHBondContact O-N 3.14Å; F80-G82 PolarHBondContact O-N 3.45Å; G82-F84 VanDerWaalsContact C-N 3.31Å; G82-F84 PolarHBondContact O-N 2.86Å; G82-Y85 PolarHBondContact O-N 3.13Å; G82-F86 WeakPolarHBondContact O-CB 3.44Å; G82-F86 PolarHBondContact O-N 2.94Å |
| 83 | S | 97.1 | Very high | 94.1 | Very high | 44 Ų | 44 | 51.5 Ų | 51.5 | 31% | 0.308 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -63.7 | -36.8 | 171.1 | -60 | 0 | 0 | 0 | 0 | 112 | R79 F80 A87 | R79-S83 PolarHBondContact O-N 3.12Å; R79-S83 PolarHBondContact O-OG 3.36Å; F80-S83 PolarHBondContact O-N 2.84Å; S83-A87 WeakPolarHBondContact O-CB 3.46Å; S83-A87 PolarHBondContact O-N 3.16Å |
| 84 | F | 96.8 | Very high | 94.7 | Very high | 91 Ų | 91 | 44.1 Ų | 44.1 | 40% | 0.399 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -69.8 | -41.1 | 174.5 | -171.2 | -95.6 | 0 | 0 | 0 | 111.6 | F80 A81 G82 A87 I88 F225 | F80-F84 VanDerWaalsContact O-CB 3.29Å; F80-F84 WeakPolarHBondContact O-CB 3.38Å; F80-F84 PolarHBondContact O-N 3.44Å; A81-F84 PolarHBondContact O-N 3.39Å; G82-F84 VanDerWaalsContact C-N 3.31Å; G82-F84 PolarHBondContact O-N 2.86Å; F84-A87 WeakPolarHBondContact O-CB 3.35Å; F84-A87 PolarHBondContact O-N 3.2Å; F84-I88 HydrophobicContact CD1-CD1 3.74Å; F84-I88 HydrophobicContact CD1-CG1 4.32Å; F84-I88 HydrophobicContact CE1-CD1 3.52Å; F84-I88 HydrophobicContact CE1-CG1 4.14Å; F84-I88 HydrophobicContact CZ-CD1 4.41Å; F84-I88 WeakPolarHBondContact O-CG1 3.41Å; F84-I88 PolarHBondContact O-N 3.19Å; F84-F225 AromaticContact CD1-CD2 3.56Å; F84-F225 HydrophobicContact CD1-CD2 3.56Å; F84-F225 AromaticContact CD1-CE2 3.4Å; F84-F225 HydrophobicContact CD1-CE2 3.4Å; F84-F225 VanDerWaalsContact CD1-CE2 3.4Å; F84-F225 HydrophobicContact CD1-CG 4.32Å; F84-F225 HydrophobicContact CD1-CZ 4.05Å; F84-F225 AromaticContact CE1-CD2 3.65Å; F84-F225 HydrophobicContact CE1-CD2 3.65Å; F84-F225 HydrophobicContact CE1-CE2 4Å; F84-F225 HydrophobicContact CE1-CG 4.26Å; F84-F225 HydrophobicContact CG-CE2 4.4Å |
| 85 | Y | 96.6 | Very high | 95.3 | Very high | 1 Ų | 1 | 45.7 Ų | 45.7 | 0% | 0.004 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -59.9 | -46.3 | 173.1 | -173.6 | -138.9 | 0 | 0 | 0 | 111.6 | A81 G82 A87 I88 T89 Y96 H98 V206 F225 I228 | A81-Y85 WeakPolarHBondContact O-CB 3.32Å; A81-Y85 PolarHBondContact O-N 2.93Å; G82-Y85 PolarHBondContact O-N 3.13Å; Y85-A87 VanDerWaalsContact C-N 3.35Å; Y85-A87 PolarHBondContact O-N 3.09Å; Y85-I88 WeakPolarHBondContact O-CB 3.46Å; Y85-I88 PolarHBondContact O-N 2.92Å; Y85-T89 HydrophobicContact CD2-CG2 4.5Å; Y85-T89 HydrophobicContact CE2-CG2 4.36Å; Y85-T89 WeakPolarHBondContact O-CG2 3.48Å; Y85-T89 PolarHBondContact O-N 3.35Å; Y85-Y96 HydrophobicContact CE2-CE2 4.25Å; Y85-Y96 AromaticContact CZ-CE2 3.82Å; Y85-Y96 WeakPolarHBondContact OH-CE2 3.29Å; Y85-H98 AromaticContact CD1-CE1 3.73Å; Y85-H98 AromaticContact CD1-NE2 3.51Å; Y85-H98 AromaticContact CE1-CE1 3.35Å; Y85-H98 WeakPolarHBondContact CE1-CE1 3.46Å; Y85-H98 AromaticContact CE1-NE2 3.44Å; Y85-H98 WeakPolarHBondContact CE1-NE2 3.33Å; Y85-V206 HydrophobicContact CE1-CG1 4.01Å; Y85-V206 WeakPolarHBondContact OH-CG1 3.14Å; Y85-F225 HydrophobicContact CD2-CD1 4.03Å; Y85-F225 AromaticContact CD2-CE1 3.47Å; Y85-F225 HydrophobicContact CD2-CE1 3.47Å; Y85-F225 VanDerWaalsContact CD2-CE1 3.47Å; Y85-F225 HydrophobicContact CD2-CZ 4.47Å; Y85-F225 HydrophobicContact CE2-CE1 4.37Å; Y85-F225 AromaticContact CG-CE1 3.81Å; Y85-F225 HydrophobicContact CG-CE1 3.81Å; Y85-F225 HydrophobicContact CG-CZ 4.45Å; Y85-I228 HydrophobicContact CE2-CD1 3.89Å |
| 86 | F | 97.4 | Very high | 95.7 | Very high | 29 Ų | 29 | 45.5 Ų | 45.5 | 13% | 0.127 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -60 | -42.1 | 173.3 | 175.3 | -97.9 | 0 | 0 | 0 | 112.2 | W78 G82 I88 T89 V90 A99 P101 | W78-F86 HydrophobicContact CH2-CB 4.35Å; W78-F86 AromaticContact CH2-CD1 3.65Å; W78-F86 HydrophobicContact CH2-CD1 3.65Å; W78-F86 AromaticContact CH2-CD2 3.82Å; W78-F86 HydrophobicContact CH2-CD2 3.82Å; W78-F86 AromaticContact CH2-CE1 3.84Å; W78-F86 HydrophobicContact CH2-CE1 3.84Å; W78-F86 HydrophobicContact CH2-CE2 4.01Å; W78-F86 AromaticContact CH2-CG 3.64Å; W78-F86 HydrophobicContact CH2-CG 3.64Å; W78-F86 HydrophobicContact CH2-CZ 4.02Å; W78-F86 HydrophobicContact CZ3-CB 4.25Å; W78-F86 AromaticContact CZ3-CD1 3.67Å; W78-F86 HydrophobicContact CZ3-CD1 3.67Å; W78-F86 HydrophobicContact CZ3-CD2 4.5Å; W78-F86 HydrophobicContact CZ3-CE1 4.16Å; W78-F86 AromaticContact CZ3-CG 3.87Å; W78-F86 HydrophobicContact CZ3-CG 3.87Å; G82-F86 WeakPolarHBondContact O-CB 3.44Å; G82-F86 PolarHBondContact O-N 2.94Å; F86-I88 VanDerWaalsContact C-N 3.33Å; F86-I88 PolarHBondContact O-N 3.38Å; F86-T89 PolarHBondContact O-N 3.03Å; F86-T89 PolarHBondContact O-OG1 3.47Å; F86-V90 HydrophobicContact CD1-CG2 4.26Å; F86-V90 HydrophobicContact CD2-CG2 4.43Å; F86-V90 HydrophobicContact CE1-CG2 3.73Å; F86-V90 HydrophobicContact CE2-CG2 3.93Å; F86-V90 HydrophobicContact CZ-CG2 3.54Å; F86-V90 WeakPolarHBondContact O-CG2 3.5Å; F86-V90 PolarHBondContact O-N 3.05Å; F86-A99 WeakPolarHBondContact CD2-O 3.43Å; F86-A99 WeakPolarHBondContact CE2-O 3.34Å; F86-P101 HydrophobicContact CE1-CG 4.19Å; F86-P101 HydrophobicContact CE2-CG 4.34Å; F86-P101 HydrophobicContact CZ-CG 3.6Å |
| 87 | A | 98.1 | Very high | 95.9 | Very high | 21 Ų | 21 | 44.4 Ų | 44.4 | 17% | 0.174 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -60.8 | -42.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.9 | S83 F84 Y85 V90 I91 Y113 | S83-A87 WeakPolarHBondContact O-CB 3.46Å; S83-A87 PolarHBondContact O-N 3.16Å; F84-A87 WeakPolarHBondContact O-CB 3.35Å; F84-A87 PolarHBondContact O-N 3.2Å; Y85-A87 VanDerWaalsContact C-N 3.35Å; Y85-A87 PolarHBondContact O-N 3.09Å; A87-V90 PolarHBondContact O-N 3.18Å; A87-I91 WeakPolarHBondContact O-CG1 3.13Å; A87-I91 PolarHBondContact O-N 2.85Å; A87-I91 VanDerWaalsContact O-N 3.11Å; A87-Y113 HydrophobicContact CB-CE1 4.13Å |
| 88 | I | 97.1 | Very high | 95.9 | Very high | 6 Ų | 6 | 45.2 Ų | 45.2 | 3% | 0.031 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -57.7 | -51.9 | 172.9 | -68.3 | 166.3 | 0 | 0 | 0 | 109.9 | F84 Y85 F86 V90 I91 T92 F225 I228 | F84-I88 HydrophobicContact CD1-CD1 3.74Å; F84-I88 HydrophobicContact CD1-CG1 4.32Å; F84-I88 HydrophobicContact CE1-CD1 3.52Å; F84-I88 HydrophobicContact CE1-CG1 4.14Å; F84-I88 HydrophobicContact CZ-CD1 4.41Å; F84-I88 WeakPolarHBondContact O-CG1 3.41Å; F84-I88 PolarHBondContact O-N 3.19Å; Y85-I88 WeakPolarHBondContact O-CB 3.46Å; Y85-I88 PolarHBondContact O-N 2.92Å; F86-I88 VanDerWaalsContact C-N 3.33Å; F86-I88 PolarHBondContact O-N 3.38Å; I88-V90 PolarHBondContact O-N 3.45Å; I88-I91 PolarHBondContact O-N 3.14Å; I88-T92 HydrophobicContact CG2-CG2 4Å; I88-T92 VanDerWaalsContact O-CB 3.31Å; I88-T92 WeakPolarHBondContact O-CB 3.41Å; I88-T92 VanDerWaalsContact O-CG2 3.32Å; I88-T92 WeakPolarHBondContact O-CG2 3.22Å; I88-T92 PolarHBondContact O-N 3.04Å; I88-T92 PolarHBondContact O-OG1 3.41Å; I88-F225 HydrophobicContact CD1-CB 4.01Å; I88-F225 HydrophobicContact CD1-CD1 3.79Å; I88-F225 HydrophobicContact CD1-CD2 4.33Å; I88-F225 HydrophobicContact CD1-CE1 4.36Å; I88-F225 HydrophobicContact CD1-CG 3.78Å; I88-I228 HydrophobicContact CG2-CG2 4.04Å |
| 89 | T | 97.4 | Very high | 95.8 | Very high | 5 Ų | 5 | 40.2 Ų | 40.2 | 3% | 0.031 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -62.7 | -30.7 | -175.3 | 63.1 | 0 | 0 | 0 | 0 | 112.8 | Y85 F86 T93 I94 G95 Y96 | Y85-T89 HydrophobicContact CD2-CG2 4.5Å; Y85-T89 HydrophobicContact CE2-CG2 4.36Å; Y85-T89 WeakPolarHBondContact O-CG2 3.48Å; Y85-T89 PolarHBondContact O-N 3.35Å; F86-T89 PolarHBondContact O-N 3.03Å; F86-T89 PolarHBondContact O-OG1 3.47Å; T89-T93 PolarHBondContact O-N 3.43Å; T89-I94 PolarHBondContact O-N 2.76Å; T89-G95 PolarHBondContact O-N 3.07Å; T89-G95 VanDerWaalsContact O-N 3.08Å; T89-Y96 HydrophobicContact CG2-CD2 3.58Å; T89-Y96 HydrophobicContact CG2-CE2 3.85Å |
| 90 | V | 98.2 | Very high | 95.9 | Very high | 19 Ų | 19 | 35.4 Ų | 35.4 | 12% | 0.115 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -71.5 | -55.4 | 175.3 | 173.6 | 0 | 0 | 0 | 0 | 111.7 | F86 A87 I88 T92 T93 Y113 A114 | F86-V90 HydrophobicContact CD1-CG2 4.26Å; F86-V90 HydrophobicContact CD2-CG2 4.43Å; F86-V90 HydrophobicContact CE1-CG2 3.73Å; F86-V90 HydrophobicContact CE2-CG2 3.93Å; F86-V90 HydrophobicContact CZ-CG2 3.54Å; F86-V90 WeakPolarHBondContact O-CG2 3.5Å; F86-V90 PolarHBondContact O-N 3.05Å; A87-V90 PolarHBondContact O-N 3.18Å; I88-V90 PolarHBondContact O-N 3.45Å; V90-T92 VanDerWaalsContact C-N 3.29Å; V90-T92 PolarHBondContact O-N 3.29Å; V90-T93 PolarHBondContact O-N 2.92Å; V90-T93 VanDerWaalsContact O-N 3.17Å; V90-Y113 HydrophobicContact CB-CD1 4.37Å; V90-Y113 HydrophobicContact CB-CE1 4.41Å; V90-Y113 HydrophobicContact CG1-CD1 3.85Å; V90-Y113 HydrophobicContact CG1-CE1 4.3Å; V90-A114 HydrophobicContact CG1-CB 3.8Å |
| 91 | I | 97.8 | Very high | 96 | Very high | 34 Ų | 34 | 28.3 Ų | 28.3 | 17% | 0.174 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -71.9 | -24.4 | -174.2 | 67.9 | -174.5 | 0 | 0 | 0 | 113.2 | A87 I88 T93 Y113 T121 | A87-I91 WeakPolarHBondContact O-CG1 3.13Å; A87-I91 PolarHBondContact O-N 2.85Å; A87-I91 VanDerWaalsContact O-N 3.11Å; I88-I91 PolarHBondContact O-N 3.14Å; I91-T93 VanDerWaalsContact C-N 3.33Å; I91-Y113 HydrophobicContact CG2-CD1 4.13Å; I91-Y113 HydrophobicContact CG2-CE1 3.35Å; I91-T121 WeakPolarHBondContact O-CB 3.45Å; I91-T121 WeakPolarHBondContact O-CG2 3.29Å |
| 92 | T | 96.8 | Very high | 96.1 | Very high | 7 Ų | 7 | 32 Ų | 32 | 4% | 0.043 | 22% | 0.219 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -90.6 | 1.8 | 175.7 | 60.7 | 0 | 0 | 0 | 0 | 113.1 | I88 V90 I94 T121 F125 T199 L232 | I88-T92 HydrophobicContact CG2-CG2 4Å; I88-T92 VanDerWaalsContact O-CB 3.31Å; I88-T92 WeakPolarHBondContact O-CB 3.41Å; I88-T92 VanDerWaalsContact O-CG2 3.32Å; I88-T92 WeakPolarHBondContact O-CG2 3.22Å; I88-T92 PolarHBondContact O-N 3.04Å; I88-T92 PolarHBondContact O-OG1 3.41Å; V90-T92 VanDerWaalsContact C-N 3.29Å; V90-T92 PolarHBondContact O-N 3.29Å; T92-I94 PolarHBondContact O-N 3.29Å; T92-I94 VanDerWaalsContact O-N 3.09Å; T92-I94 VanDerWaalsContact OG1-CD1 3.27Å; T92-I94 WeakPolarHBondContact OG1-CD1 3.32Å; T92-I94 WeakPolarHBondContact OG1-CG1 3.37Å; T92-T121 HydrophobicContact CG2-CG2 4.25Å; T92-F125 HydrophobicContact CG2-CE2 4.17Å; T92-F125 HydrophobicContact CG2-CZ 4.38Å; T92-T199 WeakPolarHBondContact O-CG2 3.29Å; T92-L232 HydrophobicContact CG2-CD1 3.52Å |
| 93 | T | 97.5 | Very high | 96.2 | Very high | 64 Ų | 64 | 35.9 Ų | 35.9 | 39% | 0.393 | 24% | 0.242 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 55.4 | 22 | -178.5 | 66.9 | 0 | 0 | 0 | 0 | 115 | T89 V90 I91 I118 | T89-T93 PolarHBondContact O-N 3.43Å; V90-T93 PolarHBondContact O-N 2.92Å; V90-T93 VanDerWaalsContact O-N 3.17Å; I91-T93 VanDerWaalsContact C-N 3.33Å; T93-I118 HydrophobicContact CG2-CB 4.33Å; T93-I118 HydrophobicContact CG2-CD1 3.61Å; T93-I118 HydrophobicContact CG2-CG1 3.64Å; T93-I118 HydrophobicContact CG2-CG2 3.74Å |
| 94 | I | 97.6 | Very high | 96.3 | Very high | 3 Ų | 3 | 39.4 Ų | 39.4 | 2% | 0.015 | 26% | 0.258 | C | S | . | . | trans | -72.2 | -51.2 | 174.7 | -60.5 | 167.1 | 0 | 0 | 0 | 110 | T89 T92 Y96 T196 T199 G201 I228 L232 | T89-I94 PolarHBondContact O-N 2.76Å; T92-I94 PolarHBondContact O-N 3.29Å; T92-I94 VanDerWaalsContact O-N 3.09Å; T92-I94 VanDerWaalsContact OG1-CD1 3.27Å; T92-I94 WeakPolarHBondContact OG1-CD1 3.32Å; T92-I94 WeakPolarHBondContact OG1-CG1 3.37Å; I94-Y96 HydrophobicContact CG2-CD1 3.84Å; I94-Y96 HydrophobicContact CG2-CD2 4.16Å; I94-Y96 HydrophobicContact CG2-CE1 3.5Å; I94-Y96 HydrophobicContact CG2-CE2 3.84Å; I94-Y96 HydrophobicContact CG2-CG 4.15Å; I94-Y96 PolarHBondContact O-N 3.38Å; I94-T196 HydrophobicContact CD1-CG2 4.15Å; I94-T199 HydrophobicContact CG1-CG2 4.12Å; I94-G201 WeakPolarHBondContact O-CA 3.28Å; I94-I228 HydrophobicContact CD1-CG2 3.78Å; I94-L232 HydrophobicContact CD1-CD1 4.26Å | ||
| 95 | G | 96.4 | Very high | 96.3 | Very high | 49 Ų | 49 | 37.7 Ų | 37.7 | 51% | 0.505 | 27% | 0.266 | S | S | . | . | trans | 58.5 | 42.9 | 169.8 | 0 | 0 | 0 | 0 | 0 | 118 | T89 G97 | T89-G95 PolarHBondContact O-N 3.07Å; T89-G95 VanDerWaalsContact O-N 3.08Å; G95-G97 PolarHBondContact O-N 3.09Å | ||
| 96 | Y | 95.5 | Very high | 96.4 | Very high | 9 Ų | 9 | 38.7 Ų | 38.7 | 4% | 0.035 | 28% | 0.276 | C | S | . | . | trans | -47.6 | -23.1 | -178.9 | -62.4 | -58.8 | 0 | 0 | 0 | 117.7 | Y85 T89 I94 H98 Y192 T196 G201 G203 V206 | Y85-Y96 HydrophobicContact CE2-CE2 4.25Å; Y85-Y96 AromaticContact CZ-CE2 3.82Å; Y85-Y96 WeakPolarHBondContact OH-CE2 3.29Å; T89-Y96 HydrophobicContact CG2-CD2 3.58Å; T89-Y96 HydrophobicContact CG2-CE2 3.85Å; I94-Y96 HydrophobicContact CG2-CD1 3.84Å; I94-Y96 HydrophobicContact CG2-CD2 4.16Å; I94-Y96 HydrophobicContact CG2-CE1 3.5Å; I94-Y96 HydrophobicContact CG2-CE2 3.84Å; I94-Y96 HydrophobicContact CG2-CG 4.15Å; I94-Y96 PolarHBondContact O-N 3.38Å; Y96-H98 WeakPolarHBondContact CB-ND1 3.37Å; Y96-H98 AromaticContact CD2-CE1 3.98Å; Y96-H98 AromaticContact CD2-ND1 3.91Å; Y96-H98 PolarHBondContact O-N 2.58Å; Y96-Y192 HydrophobicContact CE1-CE2 4.21Å; Y96-T196 WeakPolarHBondContact OH-CB 3.44Å; Y96-T196 WeakPolarHBondContact OH-CG2 3.18Å; Y96-T196 PolarHBondContact OH-OG1 2.97Å; Y96-G201 VanDerWaalsContact CA-O 3.3Å; Y96-G201 WeakPolarHBondContact CA-O 3.44Å; Y96-G203 VanDerWaalsContact O-CA 3.28Å; Y96-G203 WeakPolarHBondContact O-CA 3.48Å; Y96-V206 HydrophobicContact CD1-CG2 4.2Å; Y96-V206 HydrophobicContact CD2-CG1 4.15Å; Y96-V206 HydrophobicContact CG-CG1 4.4Å; Y96-V206 HydrophobicContact CG-CG2 4.04Å | ||
| 97 | G | 93.6 | Very high | 96.4 | Very high | 60 Ų | 60 | 41.5 Ų | 41.5 | 62% | 0.619 | 29% | 0.288 | S | S | * | . | trans | 72.2 | -1.2 | -179.7 | 0 | 0 | 0 | 0 | 0 | 116.5 | G95 A99 | G95-G97 PolarHBondContact O-N 3.09Å; G97-A99 PolarHBondContact O-N 2.7Å | ||
| 98 | H | 91.4 | Very high | 96.5 | Very high | 30 Ų | 30 | 44 Ų | 44 | 14% | 0.139 | 30% | 0.301 | C | S | . | . | S | Bend | trans | -60.6 | -30.4 | 174.5 | 68.2 | -84.7 | 0 | 0 | 0 | 113 | Y85 Y96 V206 Q209 | Y85-H98 AromaticContact CD1-CE1 3.73Å; Y85-H98 AromaticContact CD1-NE2 3.51Å; Y85-H98 AromaticContact CE1-CE1 3.35Å; Y85-H98 WeakPolarHBondContact CE1-CE1 3.46Å; Y85-H98 AromaticContact CE1-NE2 3.44Å; Y85-H98 WeakPolarHBondContact CE1-NE2 3.33Å; Y96-H98 WeakPolarHBondContact CB-ND1 3.37Å; Y96-H98 AromaticContact CD2-CE1 3.98Å; Y96-H98 AromaticContact CD2-ND1 3.91Å; Y96-H98 PolarHBondContact O-N 2.58Å; H98-V206 HydrophobicContact CB-CG1 4.34Å; H98-V206 HydrophobicContact CB-CG2 4.2Å; H98-Q209 PolarHBondContact CD2-NE2 2.8Å |
| 99 | A | 92.3 | Very high | 96.5 | Very high | 12 Ų | 12 | 50.3 Ų | 50.3 | 10% | 0.099 | 33% | 0.329 | C | S | . | . | S | Bend | trans | -133.1 | 130.3 | 170.6 | 0 | 0 | 0 | 0 | 0 | 109.3 | Q77 W78 F86 G97 | Q77-A99 HydrophobicContact CB-CB 4.25Å; W78-A99 HydrophobicContact CZ2-CB 4.34Å; F86-A99 WeakPolarHBondContact CD2-O 3.43Å; F86-A99 WeakPolarHBondContact CE2-O 3.34Å; G97-A99 PolarHBondContact O-N 2.7Å |
| 100 | A | 95.1 | Very high | 96.6 | Very high | 61 Ų | 61 | 51.3 Ų | 51.3 | 50% | 0.504 | 34% | 0.336 | S | S | . | . | trans | -137.3 | 148.2 | 178.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | S102 | A100-S102 PolarHBondContact O-N 3.48Å; A100-S102 VanDerWaalsContact O-N 3.1Å | ||
| 101 | P | 96.4 | Very high | 96.6 | Very high | 25 Ų | 25 | 56.5 Ų | 56.5 | 16% | 0.162 | 36% | 0.36 | C | S | . | . | trans | -61.7 | 114.4 | 179.3 | -20.6 | 32.2 | 0 | 0 | 0 | 111 | W78 F86 K107 C110 | W78-P101 HydrophobicContact CH2-CG 4.37Å; F86-P101 HydrophobicContact CE1-CG 4.19Å; F86-P101 HydrophobicContact CE2-CG 4.34Å; F86-P101 HydrophobicContact CZ-CG 3.6Å; P101-K107 HydrophobicContact CB-CG 4.14Å; P101-K107 WeakPolarHBondContact O-CE 3.37Å; P101-K107 WeakPolarHBondContact O-CG 3.18Å; P101-C110 HydrophobicContact CG-CB 4.1Å | ||
| 102 | S | 94.5 | Very high | 96.6 | Very high | 98 Ų | 98 | 61.4 Ų | 61.4 | 69% | 0.685 | 38% | 0.38 | S | S | * | . | trans | -80.3 | -27.1 | 179.1 | 56.3 | 0 | 0 | 0 | 0 | 112.6 | A100 | A100-S102 PolarHBondContact O-N 3.48Å; A100-S102 VanDerWaalsContact O-N 3.1Å | ||
| 103 | T | 97.2 | Very high | 96.7 | Very high | 86 Ų | 86 | 64.9 Ų | 64.9 | 53% | 0.528 | 39% | 0.393 | S | S | . | . | S | Bend | trans | -88.7 | 146.2 | -178.5 | 63.2 | 0 | 0 | 0 | 0 | 111.8 | G105 G106 K107 | T103-G105 VanDerWaalsContact C-N 3.31Å; T103-G105 PolarHBondContact O-N 3.25Å; T103-G106 PolarHBondContact O-N 2.93Å; T103-G106 VanDerWaalsContact O-N 3.11Å; T103-G106 PolarHBondContact OG1-N 3.24Å; T103-K107 WeakPolarHBondContact O-CG 3.38Å; T103-K107 PolarHBondContact O-N 2.8Å |
| 104 | D | 98.1 | Very high | 96.7 | Very high | 118 Ų | 118 | 62.9 Ų | 62.9 | 63% | 0.631 | 38% | 0.383 | S | S | * | . | H | α-helix | trans | -63.7 | -38.5 | 179.5 | -62.9 | -26.2 | 0 | 0 | 0 | 112 | G106 K107 V108 | D104-G106 VanDerWaalsContact C-N 3.34Å; D104-G106 PolarHBondContact O-N 3.32Å; D104-K107 PolarHBondContact O-N 2.61Å; D104-K107 IonicContact OD1-NZ 3.62Å; D104-K107 PolarHBondContact OD1-NZ 2.93Å; D104-V108 WeakPolarHBondContact O-CG2 3.34Å; D104-V108 PolarHBondContact O-N 3.06Å |
| 105 | G | 98.3 | Very high | 96.7 | Very high | 55 Ų | 55 | 68.4 Ų | 68.4 | 57% | 0.567 | 41% | 0.412 | S | S | * | . | H | α-helix | trans | -60.4 | -40.5 | 172.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | T103 V108 F109 | T103-G105 VanDerWaalsContact C-N 3.31Å; T103-G105 PolarHBondContact O-N 3.25Å; G105-V108 PolarHBondContact O-N 3.5Å; G105-F109 WeakPolarHBondContact O-CB 3.11Å; G105-F109 PolarHBondContact O-N 2.96Å |
| 106 | G | 97.8 | Very high | 96.7 | Very high | 21 Ų | 21 | 72.4 Ų | 72.4 | 22% | 0.216 | 42% | 0.421 | C | S | . | . | H | α-helix | trans | -65.8 | -38.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | T103 D104 C110 | T103-G106 PolarHBondContact O-N 2.93Å; T103-G106 VanDerWaalsContact O-N 3.11Å; T103-G106 PolarHBondContact OG1-N 3.24Å; D104-G106 VanDerWaalsContact C-N 3.34Å; D104-G106 PolarHBondContact O-N 3.32Å; G106-C110 VanDerWaalsContact O-CB 3.29Å; G106-C110 WeakPolarHBondContact O-CB 3.31Å; G106-C110 PolarHBondContact O-N 3.17Å |
| 107 | K | 98.3 | Very high | 96.8 | Very high | 89 Ų | 89 | 72.4 Ų | 72.4 | 39% | 0.387 | 42% | 0.424 | S | S | . | . | H | α-helix | trans | -64.6 | -47.7 | 175.1 | -66.6 | 171.4 | -166.8 | 157.7 | 0 | 111.4 | P101 T103 D104 F109 C110 M111 | P101-K107 HydrophobicContact CB-CG 4.14Å; P101-K107 WeakPolarHBondContact O-CE 3.37Å; P101-K107 WeakPolarHBondContact O-CG 3.18Å; T103-K107 WeakPolarHBondContact O-CG 3.38Å; T103-K107 PolarHBondContact O-N 2.8Å; D104-K107 PolarHBondContact O-N 2.61Å; D104-K107 IonicContact OD1-NZ 3.62Å; D104-K107 PolarHBondContact OD1-NZ 2.93Å; K107-F109 PolarHBondContact O-N 3.23Å; K107-C110 WeakPolarHBondContact O-CB 3Å; K107-C110 PolarHBondContact O-N 3.49Å; K107-M111 HydrophobicContact CB-CE 4.26Å; K107-M111 WeakPolarHBondContact O-CG 3.48Å; K107-M111 PolarHBondContact O-N 3.12Å |
| 108 | V | 98.4 | Very high | 97 | Very high | 74 Ų | 74 | 71.9 Ų | 71.9 | 45% | 0.448 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -59.5 | -47.4 | 177.6 | 172.6 | 0 | 0 | 0 | 0 | 110.6 | D104 G105 C110 M111 F112 | D104-V108 WeakPolarHBondContact O-CG2 3.34Å; D104-V108 PolarHBondContact O-N 3.06Å; G105-V108 PolarHBondContact O-N 3.5Å; V108-C110 VanDerWaalsContact C-N 3.33Å; V108-C110 PolarHBondContact O-N 3.11Å; V108-M111 PolarHBondContact O-N 3.38Å; V108-F112 HydrophobicContact CG1-CD2 4.03Å; V108-F112 HydrophobicContact CG1-CE2 3.78Å; V108-F112 VanDerWaalsContact O-CD2 3.29Å; V108-F112 WeakPolarHBondContact O-CD2 3.28Å; V108-F112 PolarHBondContact O-N 3.11Å |
| 109 | F | 98.3 | Very high | 97.2 | Very high | 138 Ų | 138 | 73.7 Ų | 73.7 | 61% | 0.605 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -58.6 | -44.4 | 175.2 | 175.7 | -101.4 | 0 | 0 | 0 | 112 | G105 K107 M111 F112 Y113 | G105-F109 WeakPolarHBondContact O-CB 3.11Å; G105-F109 PolarHBondContact O-N 2.96Å; K107-F109 PolarHBondContact O-N 3.23Å; F109-M111 VanDerWaalsContact C-N 3.29Å; F109-M111 PolarHBondContact O-N 3.11Å; F109-F112 PolarHBondContact O-N 3.49Å; F109-Y113 HydrophobicContact CE1-CD2 4.43Å; F109-Y113 HydrophobicContact CE1-CG 4.3Å; F109-Y113 HydrophobicContact CZ-CD2 4.13Å; F109-Y113 HydrophobicContact CZ-CG 4.4Å; F109-Y113 VanDerWaalsContact O-CB 3.24Å; F109-Y113 WeakPolarHBondContact O-CB 3.27Å; F109-Y113 PolarHBondContact O-N 3.02Å |
| 110 | C | 98.3 | Very high | 97.4 | Very high | 26 Ų | 26 | 79.1 Ų | 79.1 | 18% | 0.176 | 45% | 0.448 | C | S | . | . | H | α-helix | trans | -58.8 | -38.5 | 178 | -171.6 | 0 | 0 | 0 | 0 | 112.5 | P101 G106 K107 V108 Y113 A114 | P101-C110 HydrophobicContact CG-CB 4.1Å; G106-C110 VanDerWaalsContact O-CB 3.29Å; G106-C110 WeakPolarHBondContact O-CB 3.31Å; G106-C110 PolarHBondContact O-N 3.17Å; K107-C110 WeakPolarHBondContact O-CB 3Å; K107-C110 PolarHBondContact O-N 3.49Å; V108-C110 VanDerWaalsContact C-N 3.33Å; V108-C110 PolarHBondContact O-N 3.11Å; C110-Y113 PolarHBondContact O-N 3.2Å; C110-A114 VanDerWaalsContact O-CB 3.3Å; C110-A114 WeakPolarHBondContact O-CB 3.4Å; C110-A114 PolarHBondContact O-N 2.96Å |
| 111 | M | 98.3 | Very high | 97.4 | Very high | 128 Ų | 128 | 76.8 Ų | 76.8 | 63% | 0.631 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -62 | -49.4 | 176.7 | -65 | 175.1 | -146.6 | 0 | 0 | 111.7 | K107 V108 F109 L115 | K107-M111 HydrophobicContact CB-CE 4.26Å; K107-M111 WeakPolarHBondContact O-CG 3.48Å; K107-M111 PolarHBondContact O-N 3.12Å; V108-M111 PolarHBondContact O-N 3.38Å; F109-M111 VanDerWaalsContact C-N 3.29Å; F109-M111 PolarHBondContact O-N 3.11Å; M111-L115 WeakPolarHBondContact O-CB 3.14Å; M111-L115 PolarHBondContact O-N 3.38Å |
| 112 | F | 98.3 | Very high | 97.2 | Very high | 136 Ų | 136 | 80.4 Ų | 80.4 | 60% | 0.596 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -67.5 | -38.1 | 177.9 | -73.1 | -70.5 | 0 | 0 | 0 | 112.5 | V108 F109 L115 L116 | V108-F112 HydrophobicContact CG1-CD2 4.03Å; V108-F112 HydrophobicContact CG1-CE2 3.78Å; V108-F112 VanDerWaalsContact O-CD2 3.29Å; V108-F112 WeakPolarHBondContact O-CD2 3.28Å; V108-F112 PolarHBondContact O-N 3.11Å; F109-F112 PolarHBondContact O-N 3.49Å; F112-L115 PolarHBondContact O-N 3.13Å; F112-L116 PolarHBondContact O-N 3.48Å |
| 113 | Y | 98.2 | Very high | 97.2 | Very high | 81 Ų | 81 | 80 Ų | 80 | 32% | 0.318 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -63.2 | -44.7 | 177.7 | -175.4 | -109 | 0 | 0 | 0 | 111.6 | A87 V90 I91 F109 C110 G117 | A87-Y113 HydrophobicContact CB-CE1 4.13Å; V90-Y113 HydrophobicContact CB-CD1 4.37Å; V90-Y113 HydrophobicContact CB-CE1 4.41Å; V90-Y113 HydrophobicContact CG1-CD1 3.85Å; V90-Y113 HydrophobicContact CG1-CE1 4.3Å; I91-Y113 HydrophobicContact CG2-CD1 4.13Å; I91-Y113 HydrophobicContact CG2-CE1 3.35Å; F109-Y113 HydrophobicContact CE1-CD2 4.43Å; F109-Y113 HydrophobicContact CE1-CG 4.3Å; F109-Y113 HydrophobicContact CZ-CD2 4.13Å; F109-Y113 HydrophobicContact CZ-CG 4.4Å; F109-Y113 VanDerWaalsContact O-CB 3.24Å; F109-Y113 WeakPolarHBondContact O-CB 3.27Å; F109-Y113 PolarHBondContact O-N 3.02Å; C110-Y113 PolarHBondContact O-N 3.2Å; Y113-G117 WeakPolarHBondContact O-CA 3.49Å; Y113-G117 PolarHBondContact O-N 3.18Å |
| 114 | A | 97.9 | Very high | 97 | Very high | 21 Ų | 21 | 79.8 Ų | 79.8 | 17% | 0.174 | 43% | 0.432 | C | S | . | . | H | α-helix | trans | -64.7 | -41.9 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | V90 C110 L116 G117 I118 | V90-A114 HydrophobicContact CG1-CB 3.8Å; C110-A114 VanDerWaalsContact O-CB 3.3Å; C110-A114 WeakPolarHBondContact O-CB 3.4Å; C110-A114 PolarHBondContact O-N 2.96Å; A114-L116 VanDerWaalsContact C-N 3.3Å; A114-L116 PolarHBondContact O-N 2.91Å; A114-G117 PolarHBondContact O-N 3.1Å; A114-I118 HydrophobicContact CB-CD1 3.97Å; A114-I118 WeakPolarHBondContact O-CB 3.37Å; A114-I118 WeakPolarHBondContact O-CD1 3.47Å; A114-I118 VanDerWaalsContact O-CG1 3.27Å; A114-I118 WeakPolarHBondContact O-CG1 3.3Å; A114-I118 PolarHBondContact O-N 2.85Å |
| 115 | L | 97.5 | Very high | 96.8 | Very high | 120 Ų | 120 | 75 Ų | 75 | 63% | 0.628 | 41% | 0.405 | S | S | * | . | H | α-helix | trans | -56.2 | -41.6 | -178.9 | 179.9 | 64.5 | 0 | 0 | 0 | 112.8 | M111 F112 P119 | M111-L115 WeakPolarHBondContact O-CB 3.14Å; M111-L115 PolarHBondContact O-N 3.38Å; F112-L115 PolarHBondContact O-N 3.13Å; L115-P119 WeakPolarHBondContact O-CD 3.37Å; L115-P119 WeakPolarHBondContact O-CG 3.35Å |
| 116 | L | 96.6 | Very high | 96.3 | Very high | 132 Ų | 132 | 75.3 Ų | 75.3 | 69% | 0.691 | 39% | 0.392 | S | S | * | . | H | α-helix | trans | -91.5 | -35.2 | 178.8 | -62.5 | 178.4 | 0 | 0 | 0 | 112.8 | F112 A114 L120 | F112-L116 PolarHBondContact O-N 3.48Å; A114-L116 VanDerWaalsContact C-N 3.3Å; A114-L116 PolarHBondContact O-N 2.91Å; L116-L120 WeakPolarHBondContact O-CB 3.31Å; L116-L120 PolarHBondContact O-N 2.91Å |
| 117 | G | 97.6 | Very high | 96.1 | Very high | 9 Ų | 9 | 77.1 Ų | 77.1 | 9% | 0.093 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -69.6 | -43.9 | -175.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | Y113 A114 L120 T121 | Y113-G117 WeakPolarHBondContact O-CA 3.49Å; Y113-G117 PolarHBondContact O-N 3.18Å; A114-G117 PolarHBondContact O-N 3.1Å; G117-L120 PolarHBondContact O-N 3.4Å; G117-T121 WeakPolarHBondContact O-CB 3.38Å; G117-T121 PolarHBondContact O-N 2.98Å; G117-T121 PolarHBondContact O-OG1 3.27Å |
| 118 | I | 97.4 | Very high | 95.9 | Very high | 49 Ų | 49 | 76.7 Ų | 76.7 | 25% | 0.251 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -62.2 | -50.6 | -176.9 | -63 | 165.7 | 0 | 0 | 0 | 111.5 | T93 A114 L120 T121 L122 | T93-I118 HydrophobicContact CG2-CB 4.33Å; T93-I118 HydrophobicContact CG2-CD1 3.61Å; T93-I118 HydrophobicContact CG2-CG1 3.64Å; T93-I118 HydrophobicContact CG2-CG2 3.74Å; A114-I118 HydrophobicContact CB-CD1 3.97Å; A114-I118 WeakPolarHBondContact O-CB 3.37Å; A114-I118 WeakPolarHBondContact O-CD1 3.47Å; A114-I118 VanDerWaalsContact O-CG1 3.27Å; A114-I118 WeakPolarHBondContact O-CG1 3.3Å; A114-I118 PolarHBondContact O-N 2.85Å; I118-L120 VanDerWaalsContact C-N 3.33Å; I118-L120 PolarHBondContact O-N 3.47Å; I118-T121 PolarHBondContact O-N 3.5Å; I118-L122 HydrophobicContact CG2-CD1 3.99Å; I118-L122 HydrophobicContact CG2-CG 4.35Å; I118-L122 WeakPolarHBondContact O-CG 3.42Å; I118-L122 PolarHBondContact O-N 3.5Å |
| 119 | P | 97 | Very high | 95.5 | Very high | 69 Ų | 69 | 73.1 Ų | 73.1 | 45% | 0.448 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -59.5 | -41.8 | 176.5 | -24.4 | 34.8 | 0 | 0 | 0 | 113 | L115 L122 V123 | L115-P119 WeakPolarHBondContact O-CD 3.37Å; L115-P119 WeakPolarHBondContact O-CG 3.35Å; P119-L122 PolarHBondContact O-N 3.3Å; P119-V123 WeakPolarHBondContact O-CG2 3.38Å; P119-V123 PolarHBondContact O-N 3.4Å |
| 120 | L | 95.9 | Very high | 95.2 | Very high | 126 Ų | 126 | 70.4 Ų | 70.4 | 66% | 0.66 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -60.4 | -47.3 | 177.8 | 178 | 64.8 | 0 | 0 | 0 | 111.2 | L116 G117 I118 V123 M124 | L116-L120 WeakPolarHBondContact O-CB 3.31Å; L116-L120 PolarHBondContact O-N 2.91Å; G117-L120 PolarHBondContact O-N 3.4Å; I118-L120 VanDerWaalsContact C-N 3.33Å; I118-L120 PolarHBondContact O-N 3.47Å; L120-V123 PolarHBondContact O-N 3.21Å; L120-M124 WeakPolarHBondContact O-CB 3.49Å; L120-M124 PolarHBondContact O-N 2.87Å |
| 121 | T | 94.8 | Very high | 95.1 | Very high | 11 Ų | 11 | 78.1 Ų | 78.1 | 7% | 0.067 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -66.8 | -39.8 | -179.9 | -68.1 | 0 | 0 | 0 | 0 | 112.1 | I91 T92 G117 I118 M124 F125 | I91-T121 WeakPolarHBondContact O-CB 3.45Å; I91-T121 WeakPolarHBondContact O-CG2 3.29Å; T92-T121 HydrophobicContact CG2-CG2 4.25Å; G117-T121 WeakPolarHBondContact O-CB 3.38Å; G117-T121 PolarHBondContact O-N 2.98Å; G117-T121 PolarHBondContact O-OG1 3.27Å; I118-T121 PolarHBondContact O-N 3.5Å; T121-M124 HydrophobicContact CG2-CE 4.48Å; T121-M124 WeakPolarHBondContact O-CB 3.39Å; T121-M124 PolarHBondContact O-N 3.42Å; T121-F125 HydrophobicContact CG2-CD2 3.59Å; T121-F125 HydrophobicContact CG2-CE2 3.29Å; T121-F125 HydrophobicContact CG2-CZ 4.19Å; T121-F125 WeakPolarHBondContact O-CD2 3.42Å; T121-F125 PolarHBondContact O-N 2.94Å |
| 122 | L | 92.8 | Very high | 94.8 | Very high | 101 Ų | 101 | 75 Ų | 75 | 53% | 0.529 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -60.8 | -47.8 | 174.5 | -73.7 | 173.8 | 0 | 0 | 0 | 111.6 | I118 P119 M124 F125 Q126 | I118-L122 HydrophobicContact CG2-CD1 3.99Å; I118-L122 HydrophobicContact CG2-CG 4.35Å; I118-L122 WeakPolarHBondContact O-CG 3.42Å; I118-L122 PolarHBondContact O-N 3.5Å; P119-L122 PolarHBondContact O-N 3.3Å; L122-M124 VanDerWaalsContact C-N 3.32Å; L122-M124 PolarHBondContact O-N 3.05Å; L122-F125 PolarHBondContact O-N 2.9Å; L122-Q126 WeakPolarHBondContact O-CB 3.49Å; L122-Q126 VanDerWaalsContact O-CG 3.25Å; L122-Q126 WeakPolarHBondContact O-CG 3.31Å; L122-Q126 PolarHBondContact O-N 3.1Å |
| 123 | V | 93.6 | Very high | 94.6 | Very high | 91 Ų | 91 | 69.8 Ų | 69.8 | 55% | 0.552 | 36% | 0.359 | S | S | * | . | H | α-helix | trans | -62.6 | -40.7 | 177.2 | 172.3 | 0 | 0 | 0 | 0 | 111.3 | P119 L120 Q126 S127 | P119-V123 WeakPolarHBondContact O-CG2 3.38Å; P119-V123 PolarHBondContact O-N 3.4Å; L120-V123 PolarHBondContact O-N 3.21Å; V123-Q126 PolarHBondContact O-N 3.3Å; V123-S127 VanDerWaalsContact O-CB 3.32Å; V123-S127 WeakPolarHBondContact O-CB 3.39Å; V123-S127 PolarHBondContact O-N 2.85Å; V123-S127 PolarHBondContact O-OG 3.31Å |
| 124 | M | 94.2 | Very high | 94.3 | Very high | 80 Ų | 80 | 69.7 Ų | 69.7 | 39% | 0.394 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -59.6 | -51.3 | 176.5 | -176.5 | -163 | 73.1 | 0 | 0 | 111.4 | L120 T121 L122 Q126 S127 L128 | L120-M124 WeakPolarHBondContact O-CB 3.49Å; L120-M124 PolarHBondContact O-N 2.87Å; T121-M124 HydrophobicContact CG2-CE 4.48Å; T121-M124 WeakPolarHBondContact O-CB 3.39Å; T121-M124 PolarHBondContact O-N 3.42Å; L122-M124 VanDerWaalsContact C-N 3.32Å; L122-M124 PolarHBondContact O-N 3.05Å; M124-Q126 PolarHBondContact O-N 2.97Å; M124-S127 PolarHBondContact O-N 3.35Å; M124-L128 HydrophobicContact CE-CD1 4.48Å; M124-L128 HydrophobicContact CG-CD1 3.94Å; M124-L128 WeakPolarHBondContact O-CB 3.27Å; M124-L128 WeakPolarHBondContact O-CG 3.36Å; M124-L128 PolarHBondContact O-N 2.87Å; M124-L128 HydrophobicContact SD-CD1 4.5Å |
| 125 | F | 92.5 | Very high | 94.2 | Very high | 18 Ų | 18 | 73.3 Ų | 73.3 | 8% | 0.079 | 38% | 0.384 | C | S | . | . | H | α-helix | trans | -66.1 | -37.5 | 180 | -75 | -47.6 | 0 | 0 | 0 | 113 | T92 T121 L122 G129 L229 L232 T233 | T92-F125 HydrophobicContact CG2-CE2 4.17Å; T92-F125 HydrophobicContact CG2-CZ 4.38Å; T121-F125 HydrophobicContact CG2-CD2 3.59Å; T121-F125 HydrophobicContact CG2-CE2 3.29Å; T121-F125 HydrophobicContact CG2-CZ 4.19Å; T121-F125 WeakPolarHBondContact O-CD2 3.42Å; T121-F125 PolarHBondContact O-N 2.94Å; L122-F125 PolarHBondContact O-N 2.9Å; F125-G129 PolarHBondContact O-N 2.79Å; F125-L229 WeakPolarHBondContact CE1-O 3.36Å; F125-L229 HydrophobicContact CZ-CD2 4.33Å; F125-L232 HydrophobicContact CD1-CB 4.48Å; F125-L232 HydrophobicContact CE1-CB 3.86Å; F125-L232 HydrophobicContact CE2-CB 3.94Å; F125-L232 HydrophobicContact CE2-CD1 3.93Å; F125-L232 HydrophobicContact CZ-CB 3.55Å; F125-L232 HydrophobicContact CZ-CD1 3.78Å; F125-L232 HydrophobicContact CZ-CG 4.34Å; F125-T233 WeakPolarHBondContact CD1-OG1 3.41Å; F125-T233 WeakPolarHBondContact CE1-OG1 3.23Å |
| 126 | Q | 89.8 | Confident | 94 | Very high | 61 Ų | 61 | 69.5 Ų | 69.5 | 29% | 0.285 | 37% | 0.365 | S | S | . | . | H | α-helix | trans | -62.8 | -45.8 | 174.5 | -70.4 | -62.9 | -35.8 | 0 | 0 | 111.3 | L122 V123 M124 G129 E130 N240 | L122-Q126 WeakPolarHBondContact O-CB 3.49Å; L122-Q126 VanDerWaalsContact O-CG 3.25Å; L122-Q126 WeakPolarHBondContact O-CG 3.31Å; L122-Q126 PolarHBondContact O-N 3.1Å; V123-Q126 PolarHBondContact O-N 3.3Å; M124-Q126 PolarHBondContact O-N 2.97Å; Q126-G129 PolarHBondContact O-N 3.42Å; Q126-E130 PolarHBondContact O-N 3.3Å; Q126-N240 PolarHBondContact O-ND2 2.95Å; Q126-N240 VanDerWaalsContact OE1-CB 3.3Å; Q126-N240 PolarHBondContact OE1-ND2 3.4Å |
| 127 | S | 92.3 | Very high | 93.8 | Very high | 60 Ų | 60 | 66.7 Ų | 66.7 | 42% | 0.42 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -63.7 | -46.9 | 178.8 | -58 | 0 | 0 | 0 | 0 | 111.6 | V123 M124 E130 R131 | V123-S127 VanDerWaalsContact O-CB 3.32Å; V123-S127 WeakPolarHBondContact O-CB 3.39Å; V123-S127 PolarHBondContact O-N 2.85Å; V123-S127 PolarHBondContact O-OG 3.31Å; M124-S127 PolarHBondContact O-N 3.35Å; S127-E130 PolarHBondContact O-N 3.47Å; S127-R131 WeakPolarHBondContact O-CG 3.32Å; S127-R131 PolarHBondContact O-N 2.9Å |
| 128 | L | 94 | Very high | 93.6 | Very high | 79 Ų | 79 | 72 Ų | 72 | 41% | 0.414 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -64.2 | -42.7 | 176.7 | -73 | 173 | 0 | 0 | 0 | 111.6 | M124 E130 R131 I132 T233 | M124-L128 HydrophobicContact CE-CD1 4.48Å; M124-L128 HydrophobicContact CG-CD1 3.94Å; M124-L128 WeakPolarHBondContact O-CB 3.27Å; M124-L128 WeakPolarHBondContact O-CG 3.36Å; M124-L128 PolarHBondContact O-N 2.87Å; M124-L128 HydrophobicContact SD-CD1 4.5Å; L128-E130 PolarHBondContact O-N 3.43Å; L128-R131 WeakPolarHBondContact O-CB 3.34Å; L128-R131 PolarHBondContact O-N 3Å; L128-I132 WeakPolarHBondContact O-CG1 3.4Å; L128-I132 PolarHBondContact O-N 3.27Å; L128-T233 HydrophobicContact CB-CG2 3.64Å; L128-T233 HydrophobicContact CD1-CG2 4.44Å |
| 129 | G | 91.4 | Very high | 93.5 | Very high | 0 Ų | 0 | 74.2 Ų | 74.2 | 0% | 0 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -62.3 | -39.3 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | F125 Q126 I132 N133 | F125-G129 PolarHBondContact O-N 2.79Å; Q126-G129 PolarHBondContact O-N 3.42Å; G129-I132 PolarHBondContact O-N 2.95Å; G129-N133 WeakPolarHBondContact O-CB 3.47Å; G129-N133 VanDerWaalsContact O-CG 3.3Å; G129-N133 PolarHBondContact O-N 2.9Å; G129-N133 PolarHBondContact O-ND2 3.02Å |
| 130 | E | 91.5 | Very high | 93.2 | Very high | 81 Ų | 81 | 72.8 Ų | 72.8 | 38% | 0.379 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -62.9 | -41.8 | 173.9 | -171.3 | -176.1 | 168.7 | 0 | 0 | 111.8 | Q126 S127 L128 N133 T134 | Q126-E130 PolarHBondContact O-N 3.3Å; S127-E130 PolarHBondContact O-N 3.47Å; L128-E130 PolarHBondContact O-N 3.43Å; E130-N133 PolarHBondContact O-N 3.27Å; E130-T134 WeakPolarHBondContact O-CB 3.33Å; E130-T134 PolarHBondContact O-N 2.95Å; E130-T134 PolarHBondContact O-OG1 3.11Å |
| 131 | R | 94.8 | Very high | 93 | Very high | 187 Ų | 187 | 70.5 Ų | 70.5 | 71% | 0.706 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -64.2 | -42.9 | 176.1 | -63.2 | -62.7 | -179.5 | -170.5 | -0.9 | 111.7 | S127 L128 T134 L135 | S127-R131 WeakPolarHBondContact O-CG 3.32Å; S127-R131 PolarHBondContact O-N 2.9Å; L128-R131 WeakPolarHBondContact O-CB 3.34Å; L128-R131 PolarHBondContact O-N 3Å; R131-T134 PolarHBondContact O-N 3.47Å; R131-L135 WeakPolarHBondContact O-CB 3.35Å; R131-L135 PolarHBondContact O-N 3.39Å |
| 132 | I | 93.6 | Very high | 92.9 | Very high | 64 Ų | 64 | 77.7 Ų | 77.7 | 33% | 0.328 | 38% | 0.375 | S | S | . | . | H | α-helix | trans | -61.1 | -48 | 174.9 | -69.3 | 174.7 | 0 | 0 | 0 | 110.5 | L128 G129 T134 L135 V136 T233 | L128-I132 WeakPolarHBondContact O-CG1 3.4Å; L128-I132 PolarHBondContact O-N 3.27Å; G129-I132 PolarHBondContact O-N 2.95Å; I132-T134 VanDerWaalsContact C-N 3.29Å; I132-T134 PolarHBondContact O-N 3.36Å; I132-L135 WeakPolarHBondContact O-CB 3.23Å; I132-L135 PolarHBondContact O-N 3.49Å; I132-L135 VanDerWaalsContact O-N 3.16Å; I132-V136 HydrophobicContact CG2-CG2 4.26Å; I132-V136 WeakPolarHBondContact O-CG2 3.43Å; I132-V136 PolarHBondContact O-N 3.4Å; I132-T233 HydrophobicContact CD1-CG2 3.5Å |
| 133 | N | 93.3 | Very high | 92.9 | Very high | 25 Ų | 25 | 75.3 Ų | 75.3 | 13% | 0.134 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -60.5 | -39.2 | 178.3 | -75.4 | -27.2 | 0 | 0 | 0 | 112.1 | G129 E130 R137 M159 A237 | G129-N133 WeakPolarHBondContact O-CB 3.47Å; G129-N133 VanDerWaalsContact O-CG 3.3Å; G129-N133 PolarHBondContact O-N 2.9Å; G129-N133 PolarHBondContact O-ND2 3.02Å; E130-N133 PolarHBondContact O-N 3.27Å; N133-R137 WeakPolarHBondContact O-CB 3.49Å; N133-R137 PolarHBondContact O-N 3.43Å; N133-M159 HydrophobicContact CB-CE 4.3Å; N133-M159 WeakPolarHBondContact O-CE 3.25Å; N133-A237 PolarHBondContact ND2-O 3.06Å |
| 134 | T | 93 | Very high | 92.8 | Very high | 79 Ų | 79 | 72.4 Ų | 72.4 | 49% | 0.485 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -65.9 | -43.2 | 175.7 | -57 | 0 | 0 | 0 | 0 | 111.4 | E130 R131 I132 R137 Y138 | E130-T134 WeakPolarHBondContact O-CB 3.33Å; E130-T134 PolarHBondContact O-N 2.95Å; E130-T134 PolarHBondContact O-OG1 3.11Å; R131-T134 PolarHBondContact O-N 3.47Å; I132-T134 VanDerWaalsContact C-N 3.29Å; I132-T134 PolarHBondContact O-N 3.36Å; T134-R137 PolarHBondContact O-N 3.03Å; T134-Y138 WeakPolarHBondContact O-CB 3.08Å; T134-Y138 PolarHBondContact O-N 3.29Å |
| 135 | L | 94.3 | Very high | 92.6 | Very high | 98 Ų | 98 | 76 Ų | 76 | 51% | 0.513 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -62.3 | -47.6 | 176 | 177.6 | 62 | 0 | 0 | 0 | 111.4 | R131 I132 R137 Y138 L139 | R131-L135 WeakPolarHBondContact O-CB 3.35Å; R131-L135 PolarHBondContact O-N 3.39Å; I132-L135 WeakPolarHBondContact O-CB 3.23Å; I132-L135 PolarHBondContact O-N 3.49Å; I132-L135 VanDerWaalsContact O-N 3.16Å; L135-R137 VanDerWaalsContact C-N 3.31Å; L135-R137 PolarHBondContact O-N 2.97Å; L135-Y138 PolarHBondContact O-N 3.05Å; L135-L139 HydrophobicContact CD1-CD1 4.16Å; L135-L139 HydrophobicContact CD1-CG 4.15Å; L135-L139 HydrophobicContact CG-CD1 4.02Å; L135-L139 HydrophobicContact CG-CG 4.42Å; L135-L139 WeakPolarHBondContact O-CB 3.45Å; L135-L139 WeakPolarHBondContact O-CG 3.34Å; L135-L139 PolarHBondContact O-N 3.26Å |
| 136 | V | 93.5 | Very high | 92.5 | Very high | 40 Ų | 40 | 78.6 Ų | 78.6 | 24% | 0.242 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -59.2 | -43.2 | 176.7 | 169.5 | 0 | 0 | 0 | 0 | 110.8 | I132 Y138 L139 L140 M159 I162 | I132-V136 HydrophobicContact CG2-CG2 4.26Å; I132-V136 WeakPolarHBondContact O-CG2 3.43Å; I132-V136 PolarHBondContact O-N 3.4Å; V136-Y138 PolarHBondContact O-N 3.35Å; V136-L139 PolarHBondContact O-N 2.89Å; V136-L140 VanDerWaalsContact O-CB 3.32Å; V136-L140 WeakPolarHBondContact O-CB 3.38Å; V136-L140 PolarHBondContact O-N 3.25Å; V136-M159 HydrophobicContact CB-CE 4.23Å; V136-M159 HydrophobicContact CG1-CE 4.02Å; V136-M159 HydrophobicContact CG1-SD 4.32Å; V136-I162 HydrophobicContact CG1-CD1 4.25Å; V136-I162 HydrophobicContact CG1-CG2 3.78Å |
| 137 | R | 92.8 | Very high | 92.6 | Very high | 72 Ų | 72 | 82.4 Ų | 82.4 | 27% | 0.272 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -60.9 | -45.6 | 175.9 | -178.7 | 174.2 | -69.2 | -167.6 | -1.3 | 111.7 | N133 T134 L135 L140 H141 V154 M159 | N133-R137 WeakPolarHBondContact O-CB 3.49Å; N133-R137 PolarHBondContact O-N 3.43Å; T134-R137 PolarHBondContact O-N 3.03Å; L135-R137 VanDerWaalsContact C-N 3.31Å; L135-R137 PolarHBondContact O-N 2.97Å; R137-L140 PolarHBondContact O-N 2.89Å; R137-H141 WeakPolarHBondContact O-CB 3.48Å; R137-H141 PolarHBondContact O-N 3.18Å; R137-V154 HydrophobicContact CG-CB 4.02Å; R137-V154 HydrophobicContact CG-CG1 3.98Å; R137-V154 HydrophobicContact CG-CG2 4.31Å; R137-M159 HydrophobicContact CB-CE 4.08Å; R137-M159 HydrophobicContact CB-SD 3.88Å; R137-M159 HydrophobicContact CG-SD 4.44Å |
| 138 | Y | 93.5 | Very high | 92.4 | Very high | 122 Ų | 122 | 82.7 Ų | 82.7 | 48% | 0.478 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -62.2 | -46.8 | 177.2 | 170.9 | -101.6 | 0 | 0 | 0 | 111.9 | T134 L135 V136 H141 R142 | T134-Y138 WeakPolarHBondContact O-CB 3.08Å; T134-Y138 PolarHBondContact O-N 3.29Å; L135-Y138 PolarHBondContact O-N 3.05Å; V136-Y138 PolarHBondContact O-N 3.35Å; Y138-H141 PolarHBondContact O-N 3.01Å; Y138-R142 WeakPolarHBondContact O-CB 3.43Å; Y138-R142 PolarHBondContact O-N 3.48Å; Y138-R142 PolarHBondContact OH-NH1 3.23Å |
| 139 | L | 94.4 | Very high | 92.1 | Very high | 94 Ų | 94 | 83.6 Ų | 83.6 | 49% | 0.492 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -62.3 | -44.1 | 178 | -70.6 | 174.5 | 0 | 0 | 0 | 111.7 | L135 V136 R142 A143 | L135-L139 HydrophobicContact CD1-CD1 4.16Å; L135-L139 HydrophobicContact CD1-CG 4.15Å; L135-L139 HydrophobicContact CG-CD1 4.02Å; L135-L139 HydrophobicContact CG-CG 4.42Å; L135-L139 WeakPolarHBondContact O-CB 3.45Å; L135-L139 WeakPolarHBondContact O-CG 3.34Å; L135-L139 PolarHBondContact O-N 3.26Å; V136-L139 PolarHBondContact O-N 2.89Å; L139-R142 PolarHBondContact O-N 2.93Å; L139-A143 WeakPolarHBondContact O-CB 3.32Å; L139-A143 PolarHBondContact O-N 3.11Å |
| 140 | L | 92.4 | Very high | 91.5 | Very high | 39 Ų | 39 | 96 Ų | 96 | 20% | 0.204 | 48% | 0.479 | C | S | . | . | H | α-helix | trans | -65.3 | -41.5 | 177.9 | -171.8 | 68.8 | 0 | 0 | 0 | 111.6 | V136 R137 R142 A143 K144 V154 N158 I162 | V136-L140 VanDerWaalsContact O-CB 3.32Å; V136-L140 WeakPolarHBondContact O-CB 3.38Å; V136-L140 PolarHBondContact O-N 3.25Å; R137-L140 PolarHBondContact O-N 2.89Å; L140-R142 VanDerWaalsContact C-N 3.34Å; L140-R142 PolarHBondContact O-N 3.25Å; L140-A143 PolarHBondContact O-N 3.48Å; L140-K144 WeakPolarHBondContact O-CG 3.4Å; L140-K144 PolarHBondContact O-N 3.05Å; L140-V154 HydrophobicContact CB-CG2 4.2Å; L140-V154 HydrophobicContact CD2-CB 4.43Å; L140-V154 HydrophobicContact CD2-CG1 3.72Å; L140-V154 HydrophobicContact CD2-CG2 3.98Å; L140-V154 HydrophobicContact CG-CG2 4.2Å; L140-N158 HydrophobicContact CD2-CB 3.92Å; L140-I162 HydrophobicContact CD1-CD1 3.94Å; L140-I162 HydrophobicContact CD2-CD1 3.61Å; L140-I162 HydrophobicContact CG-CD1 4.24Å |
| 141 | H | 91.6 | Very high | 90.9 | Very high | 78 Ų | 78 | 102.1 Ų | 102.1 | 36% | 0.361 | 50% | 0.499 | S | S | . | . | H | α-helix | trans | -60.8 | -44.7 | 175.3 | -177.9 | 70.5 | 0 | 0 | 0 | 111.2 | R137 Y138 K144 K145 A152 V154 | R137-H141 WeakPolarHBondContact O-CB 3.48Å; R137-H141 PolarHBondContact O-N 3.18Å; Y138-H141 PolarHBondContact O-N 3.01Å; H141-K144 PolarHBondContact O-N 2.87Å; H141-K145 WeakPolarHBondContact O-CB 3.45Å; H141-K145 PolarHBondContact O-N 3.48Å; H141-A152 PolarHBondContact ND1-O 3.48Å; H141-V154 HydrophobicContact CB-CG2 3.98Å |
| 142 | R | 92.8 | Very high | 90.2 | Very high | 163 Ų | 163 | 94.3 Ų | 94.3 | 62% | 0.615 | 47% | 0.474 | S | S | * | . | H | α-helix | trans | -64.2 | -41.1 | 176.8 | -168.8 | 173.2 | 180 | 129.8 | -2.8 | 112.1 | Y138 L139 L140 K145 G146 | Y138-R142 WeakPolarHBondContact O-CB 3.43Å; Y138-R142 PolarHBondContact O-N 3.48Å; Y138-R142 PolarHBondContact OH-NH1 3.23Å; L139-R142 PolarHBondContact O-N 2.93Å; L140-R142 VanDerWaalsContact C-N 3.34Å; L140-R142 PolarHBondContact O-N 3.25Å; R142-K145 PolarHBondContact O-N 3.39Å; R142-G146 PolarHBondContact O-N 3.13Å |
| 143 | A | 92.1 | Very high | 89.8 | Confident | 50 Ų | 50 | 97.4 Ų | 97.4 | 41% | 0.413 | 49% | 0.491 | S | S | . | . | H | α-helix | trans | -63.3 | -47.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | L139 L140 K145 G146 L147 | L139-A143 WeakPolarHBondContact O-CB 3.32Å; L139-A143 PolarHBondContact O-N 3.11Å; L140-A143 PolarHBondContact O-N 3.48Å; A143-K145 VanDerWaalsContact C-N 3.31Å; A143-K145 PolarHBondContact O-N 2.66Å; A143-G146 PolarHBondContact O-N 3.47Å; A143-L147 WeakPolarHBondContact O-CB 3.38Å; A143-L147 WeakPolarHBondContact O-CD1 3.18Å; A143-L147 WeakPolarHBondContact O-CG 3.49Å; A143-L147 PolarHBondContact O-N 3.33Å |
| 144 | K | 91.9 | Very high | 89.6 | Confident | 30 Ų | 30 | 97.4 Ų | 97.4 | 13% | 0.13 | 49% | 0.492 | C | S | . | . | H | α-helix | trans | -59.9 | -40.7 | 175.9 | -73.9 | -167.3 | 177.5 | -172 | 0 | 112.5 | L140 H141 L147 G148 M149 A152 D153 N158 | L140-K144 WeakPolarHBondContact O-CG 3.4Å; L140-K144 PolarHBondContact O-N 3.05Å; H141-K144 PolarHBondContact O-N 2.87Å; K144-L147 PolarHBondContact O-N 3.46Å; K144-G148 PolarHBondContact O-N 3.41Å; K144-M149 HydrophobicContact CB-CB 4.42Å; K144-M149 HydrophobicContact CB-SD 4.02Å; K144-M149 HydrophobicContact CD-SD 4.08Å; K144-M149 HydrophobicContact CG-SD 3.68Å; K144-M149 WeakPolarHBondContact O-CB 3.44Å; K144-M149 PolarHBondContact O-N 3Å; K144-A152 HydrophobicContact CB-CB 4.47Å; K144-D153 PolarHBondContact NZ-O 3.19Å; K144-N158 PolarHBondContact NZ-ND2 2.97Å; K144-N158 VanDerWaalsContact NZ-ND2 3.18Å |
| 145 | K | 89.9 | Confident | 89.5 | Confident | 156 Ų | 156 | 96.7 Ų | 96.7 | 68% | 0.678 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -66.7 | -42.1 | 176.4 | -170 | 176.4 | -179 | 178.5 | 0 | 111.6 | H141 R142 A143 L147 G148 | H141-K145 WeakPolarHBondContact O-CB 3.45Å; H141-K145 PolarHBondContact O-N 3.48Å; R142-K145 PolarHBondContact O-N 3.39Å; A143-K145 VanDerWaalsContact C-N 3.31Å; A143-K145 PolarHBondContact O-N 2.66Å; K145-L147 VanDerWaalsContact C-N 3.33Å; K145-L147 PolarHBondContact O-N 2.9Å; K145-G148 PolarHBondContact O-N 3.42Å; K145-G148 VanDerWaalsContact O-N 3.17Å |
| 146 | G | 90.1 | Very high | 89.2 | Confident | 73 Ų | 73 | 94.9 Ų | 94.9 | 75% | 0.753 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -64.7 | -34.1 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | R142 A143 G148 | R142-G146 PolarHBondContact O-N 3.13Å; A143-G146 PolarHBondContact O-N 3.47Å; G146-G148 PolarHBondContact O-N 2.91Å |
| 147 | L | 91.8 | Very high | 89 | Confident | 141 Ų | 141 | 96.2 Ų | 96.2 | 74% | 0.738 | 50% | 0.495 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78 | 2.2 | 174.6 | -70.6 | 162.4 | 0 | 0 | 0 | 113.7 | A143 K144 K145 M149 | A143-L147 WeakPolarHBondContact O-CB 3.38Å; A143-L147 WeakPolarHBondContact O-CD1 3.18Å; A143-L147 WeakPolarHBondContact O-CG 3.49Å; A143-L147 PolarHBondContact O-N 3.33Å; K144-L147 PolarHBondContact O-N 3.46Å; K145-L147 VanDerWaalsContact C-N 3.33Å; K145-L147 PolarHBondContact O-N 2.9Å; L147-M149 VanDerWaalsContact C-N 3.33Å; L147-M149 HydrophobicContact CB-CG 4.35Å; L147-M149 PolarHBondContact O-N 3.37Å |
| 148 | G | 87.4 | Confident | 88.9 | Confident | 65 Ų | 65 | 95.2 Ų | 95.2 | 67% | 0.67 | 50% | 0.495 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 71.3 | 20.9 | 177.6 | 0 | 0 | 0 | 0 | 0 | 114.9 | K144 K145 G146 R150 | K144-G148 PolarHBondContact O-N 3.41Å; K145-G148 PolarHBondContact O-N 3.42Å; K145-G148 VanDerWaalsContact O-N 3.17Å; G146-G148 PolarHBondContact O-N 2.91Å; G148-R150 PolarHBondContact O-N 3.37Å |
| 149 | M | 88.2 | Confident | 88.9 | Confident | 98 Ų | 98 | 89.6 Ų | 89.6 | 48% | 0.483 | 47% | 0.473 | S | S | . | . | trans | -69.3 | 126.6 | -178.4 | -64.3 | -175.1 | 75.2 | 0 | 0 | 111.6 | K144 L147 R151 | K144-M149 HydrophobicContact CB-CB 4.42Å; K144-M149 HydrophobicContact CB-SD 4.02Å; K144-M149 HydrophobicContact CD-SD 4.08Å; K144-M149 HydrophobicContact CG-SD 3.68Å; K144-M149 WeakPolarHBondContact O-CB 3.44Å; K144-M149 PolarHBondContact O-N 3Å; L147-M149 VanDerWaalsContact C-N 3.33Å; L147-M149 HydrophobicContact CB-CG 4.35Å; L147-M149 PolarHBondContact O-N 3.37Å; M149-R151 PolarHBondContact O-N 2.64Å; M149-R151 VanDerWaalsContact O-N 3.13Å | ||
| 150 | R | 79 | Confident | 88.8 | Confident | 260 Ų | 260 | 87.8 Ų | 87.8 | 98% | 0.981 | 47% | 0.466 | S | S | * | . | S | Bend | trans | -63.2 | -18.9 | -178.5 | -143.6 | 172.4 | 173 | -170.5 | -2.1 | 114.3 | G148 | G148-R150 PolarHBondContact O-N 3.37Š|
| 151 | R | 79.7 | Confident | 88.9 | Confident | 211 Ų | 211 | 90.5 Ų | 90.5 | 80% | 0.796 | 48% | 0.48 | S | S | * | . | trans | -124.2 | 95.3 | 172.8 | -67.6 | -176.9 | -177.3 | 173.1 | 1.2 | 109.6 | M149 D153 | M149-R151 PolarHBondContact O-N 2.64Å; M149-R151 VanDerWaalsContact O-N 3.13Å; R151-D153 VanDerWaalsContact C-N 3.28Å; R151-D153 PolarHBondContact O-N 2.88Å | ||
| 152 | A | 79.9 | Confident | 89.1 | Confident | 22 Ų | 22 | 89.6 Ų | 89.6 | 18% | 0.182 | 48% | 0.477 | C | S | . | . | trans | -85 | 3.8 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | H141 K144 | H141-A152 PolarHBondContact ND1-O 3.48Å; K144-A152 HydrophobicContact CB-CB 4.47Å | ||
| 153 | D | 84.8 | Confident | 89.2 | Confident | 129 Ų | 129 | 82.4 Ų | 82.4 | 69% | 0.69 | 45% | 0.454 | S | S | * | . | trans | -67.9 | 137.4 | -179.3 | -60.2 | -44.3 | 0 | 0 | 0 | 111.9 | K144 R151 S155 | K144-D153 PolarHBondContact NZ-O 3.19Å; R151-D153 VanDerWaalsContact C-N 3.28Å; R151-D153 PolarHBondContact O-N 2.88Å; D153-S155 PolarHBondContact O-N 3.42Å | ||
| 154 | V | 89.1 | Confident | 89.4 | Confident | 25 Ų | 25 | 85.1 Ų | 85.1 | 15% | 0.152 | 46% | 0.457 | C | S | . | . | trans | -94.9 | 94.9 | 178.5 | 176.7 | 0 | 0 | 0 | 0 | 108.7 | R137 L140 H141 M159 | R137-V154 HydrophobicContact CG-CB 4.02Å; R137-V154 HydrophobicContact CG-CG1 3.98Å; R137-V154 HydrophobicContact CG-CG2 4.31Å; L140-V154 HydrophobicContact CB-CG2 4.2Å; L140-V154 HydrophobicContact CD2-CB 4.43Å; L140-V154 HydrophobicContact CD2-CG1 3.72Å; L140-V154 HydrophobicContact CD2-CG2 3.98Å; L140-V154 HydrophobicContact CG-CG2 4.2Å; H141-V154 HydrophobicContact CB-CG2 3.98Å; V154-M159 HydrophobicContact CG1-CG 3.78Å; V154-M159 HydrophobicContact CG1-SD 3.56Å; V154-M159 VanDerWaalsContact CG1-SD 3.56Å | ||
| 155 | S | 89.7 | Confident | 89.6 | Confident | 64 Ų | 64 | 89.3 Ų | 89.3 | 45% | 0.448 | 48% | 0.475 | S | S | . | . | trans | -61.6 | 151.6 | 172.7 | 178.9 | 0 | 0 | 0 | 0 | 112.1 | D153 A157 N158 M159 | D153-S155 PolarHBondContact O-N 3.42Å; S155-A157 PolarHBondContact O-N 3.37Å; S155-A157 PolarHBondContact OG-N 3.11Å; S155-N158 PolarHBondContact N-ND2 3.43Å; S155-N158 WeakPolarHBondContact O-CB 3.27Å; S155-N158 PolarHBondContact O-N 3.04Å; S155-N158 VanDerWaalsContact O-N 3.12Å; S155-M159 PolarHBondContact O-N 3.49Å | ||
| 156 | M | 87.9 | Confident | 89.9 | Confident | 61 Ų | 61 | 84.2 Ų | 84.2 | 30% | 0.3 | 46% | 0.459 | S | S | . | . | H | α-helix | trans | -55.3 | -37.1 | 171.5 | -71.1 | -63.2 | -63.4 | 0 | 0 | 112.2 | N158 M159 V160 L241 | M156-N158 VanDerWaalsContact C-N 3.3Å; M156-N158 PolarHBondContact O-N 3.05Å; M156-M159 WeakPolarHBondContact O-CB 3.36Å; M156-M159 PolarHBondContact O-N 3.48Å; M156-M159 VanDerWaalsContact O-N 3.15Å; M156-V160 WeakPolarHBondContact O-CG2 3.27Å; M156-V160 PolarHBondContact O-N 2.95Å; M156-L241 HydrophobicContact CE-CD1 3.7Å; M156-L241 HydrophobicContact CE-CG 4.41Å |
| 157 | A | 89.9 | Confident | 90.2 | Very high | 67 Ų | 67 | 81.4 Ų | 81.4 | 55% | 0.554 | 43% | 0.427 | S | S | * | . | H | α-helix | trans | -60.4 | -39.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | S155 M159 V160 L161 | S155-A157 PolarHBondContact O-N 3.37Å; S155-A157 PolarHBondContact OG-N 3.11Å; A157-M159 VanDerWaalsContact C-N 3.34Å; A157-M159 PolarHBondContact O-N 3.38Å; A157-V160 PolarHBondContact O-N 3.29Å; A157-L161 WeakPolarHBondContact O-CB 3.41Å; A157-L161 PolarHBondContact O-N 2.77Å |
| 158 | N | 91.6 | Very high | 90.5 | Very high | 51 Ų | 51 | 77.3 Ų | 77.3 | 27% | 0.273 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -65.9 | -39.6 | 177 | -58.8 | -32.5 | 0 | 0 | 0 | 111 | L140 K144 S155 M156 L161 I162 | L140-N158 HydrophobicContact CD2-CB 3.92Å; K144-N158 PolarHBondContact NZ-ND2 2.97Å; K144-N158 VanDerWaalsContact NZ-ND2 3.18Å; S155-N158 PolarHBondContact N-ND2 3.43Å; S155-N158 WeakPolarHBondContact O-CB 3.27Å; S155-N158 PolarHBondContact O-N 3.04Å; S155-N158 VanDerWaalsContact O-N 3.12Å; M156-N158 VanDerWaalsContact C-N 3.3Å; M156-N158 PolarHBondContact O-N 3.05Å; N158-L161 PolarHBondContact O-N 2.94Å; N158-I162 WeakPolarHBondContact O-CD1 3.47Å; N158-I162 VanDerWaalsContact O-CG1 3.25Å; N158-I162 WeakPolarHBondContact O-CG1 3.25Å; N158-I162 PolarHBondContact O-N 3.32Å |
| 159 | M | 92.6 | Very high | 91 | Very high | 4 Ų | 4 | 77.1 Ų | 77.1 | 2% | 0.02 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -65.5 | -43.3 | 177.7 | -64.9 | -62.5 | -60.1 | 0 | 0 | 111.5 | N133 V136 R137 V154 S155 M156 A157 I162 G163 L241 | N133-M159 HydrophobicContact CB-CE 4.3Å; N133-M159 WeakPolarHBondContact O-CE 3.25Å; V136-M159 HydrophobicContact CB-CE 4.23Å; V136-M159 HydrophobicContact CG1-CE 4.02Å; V136-M159 HydrophobicContact CG1-SD 4.32Å; R137-M159 HydrophobicContact CB-CE 4.08Å; R137-M159 HydrophobicContact CB-SD 3.88Å; R137-M159 HydrophobicContact CG-SD 4.44Å; V154-M159 HydrophobicContact CG1-CG 3.78Å; V154-M159 HydrophobicContact CG1-SD 3.56Å; V154-M159 VanDerWaalsContact CG1-SD 3.56Å; S155-M159 PolarHBondContact O-N 3.49Å; M156-M159 WeakPolarHBondContact O-CB 3.36Å; M156-M159 PolarHBondContact O-N 3.48Å; M156-M159 VanDerWaalsContact O-N 3.15Å; A157-M159 VanDerWaalsContact C-N 3.34Å; A157-M159 PolarHBondContact O-N 3.38Å; M159-I162 PolarHBondContact O-N 3.44Å; M159-G163 PolarHBondContact O-N 2.93Å; M159-L241 HydrophobicContact CB-CD1 4.22Å; M159-L241 HydrophobicContact CB-CD2 3.78Å |
| 160 | V | 93.3 | Very high | 91.5 | Very high | 56 Ų | 56 | 73.4 Ų | 73.4 | 34% | 0.339 | 38% | 0.377 | S | S | . | . | H | α-helix | trans | -63.8 | -43 | 177.1 | 173.7 | 0 | 0 | 0 | 0 | 110.6 | M156 A157 G163 F164 F238 L241 V242 | M156-V160 WeakPolarHBondContact O-CG2 3.27Å; M156-V160 PolarHBondContact O-N 2.95Å; A157-V160 PolarHBondContact O-N 3.29Å; V160-G163 PolarHBondContact O-N 3.31Å; V160-F164 WeakPolarHBondContact O-CB 3.32Å; V160-F164 PolarHBondContact O-N 3.43Å; V160-F238 HydrophobicContact CG1-CE2 4.29Å; V160-L241 HydrophobicContact CB-CD2 4.49Å; V160-L241 HydrophobicContact CG2-CD2 3.84Å; V160-L241 HydrophobicContact CG2-CG 4.39Å; V160-V242 HydrophobicContact CG2-CG2 4.22Å |
| 161 | L | 94.6 | Very high | 92.4 | Very high | 96 Ų | 96 | 61.6 Ų | 61.6 | 50% | 0.503 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -61.8 | -48 | 177.6 | -171.3 | 67.8 | 0 | 0 | 0 | 111.9 | A157 N158 F164 F165 | A157-L161 WeakPolarHBondContact O-CB 3.41Å; A157-L161 PolarHBondContact O-N 2.77Å; N158-L161 PolarHBondContact O-N 2.94Å; L161-F164 PolarHBondContact O-N 3.13Å; L161-F165 HydrophobicContact CD1-CD2 4.09Å; L161-F165 HydrophobicContact CD1-CE2 3.59Å; L161-F165 HydrophobicContact CD2-CE2 4.38Å; L161-F165 HydrophobicContact CG-CD2 3.95Å; L161-F165 HydrophobicContact CG-CE2 3.76Å; L161-F165 VanDerWaalsContact O-CD2 3.23Å; L161-F165 WeakPolarHBondContact O-CD2 3.26Å; L161-F165 PolarHBondContact O-N 3Å |
| 162 | I | 95.4 | Very high | 93.3 | Very high | 59 Ų | 59 | 53.9 Ų | 53.9 | 30% | 0.303 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -63.3 | -42.9 | 177.5 | -67 | 164.7 | 0 | 0 | 0 | 110.8 | V136 L140 N158 M159 F164 F165 S166 | V136-I162 HydrophobicContact CG1-CD1 4.25Å; V136-I162 HydrophobicContact CG1-CG2 3.78Å; L140-I162 HydrophobicContact CD1-CD1 3.94Å; L140-I162 HydrophobicContact CD2-CD1 3.61Å; L140-I162 HydrophobicContact CG-CD1 4.24Å; N158-I162 WeakPolarHBondContact O-CD1 3.47Å; N158-I162 VanDerWaalsContact O-CG1 3.25Å; N158-I162 WeakPolarHBondContact O-CG1 3.25Å; N158-I162 PolarHBondContact O-N 3.32Å; M159-I162 PolarHBondContact O-N 3.44Å; I162-F164 VanDerWaalsContact C-N 3.34Å; I162-F164 PolarHBondContact O-N 3.44Å; I162-F165 PolarHBondContact O-N 3.39Å; I162-S166 VanDerWaalsContact O-CB 3.3Å; I162-S166 WeakPolarHBondContact O-CB 3.43Å; I162-S166 PolarHBondContact O-N 2.88Å |
| 163 | G | 94.7 | Very high | 94.1 | Very high | 12 Ų | 12 | 58.1 Ų | 58.1 | 12% | 0.124 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -60.7 | -43 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | M159 V160 S166 C167 | M159-G163 PolarHBondContact O-N 2.93Å; V160-G163 PolarHBondContact O-N 3.31Å; G163-S166 WeakPolarHBondContact O-CB 3.32Å; G163-S166 PolarHBondContact O-N 2.89Å; G163-C167 PolarHBondContact O-N 2.72Å; G163-C167 PolarHBondContact O-SG 3.44Å |
| 164 | F | 95.4 | Very high | 94.8 | Very high | 108 Ų | 108 | 52 Ų | 52 | 47% | 0.474 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -62.3 | -48.8 | 176.8 | -176.7 | -107.5 | 0 | 0 | 0 | 112 | V160 L161 I162 S166 C167 I168 F238 | V160-F164 WeakPolarHBondContact O-CB 3.32Å; V160-F164 PolarHBondContact O-N 3.43Å; L161-F164 PolarHBondContact O-N 3.13Å; I162-F164 VanDerWaalsContact C-N 3.34Å; I162-F164 PolarHBondContact O-N 3.44Å; F164-S166 VanDerWaalsContact C-N 3.32Å; F164-S166 PolarHBondContact O-N 3.48Å; F164-C167 PolarHBondContact O-N 3.04Å; F164-I168 HydrophobicContact CD1-CD1 3.86Å; F164-I168 HydrophobicContact CE1-CD1 3.36Å; F164-I168 HydrophobicContact CE2-CD1 4.29Å; F164-I168 HydrophobicContact CZ-CD1 3.61Å; F164-I168 PolarHBondContact O-N 3.35Å; F164-I168 VanDerWaalsContact O-N 3.09Å; F164-F238 HydrophobicContact CB-CE2 4.27Å |
| 165 | F | 96.7 | Very high | 95.2 | Very high | 118 Ų | 118 | 50.8 Ų | 50.8 | 52% | 0.518 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -62.2 | -39.6 | 174.8 | -79.5 | -65.2 | 0 | 0 | 0 | 112.3 | L161 I162 C167 I168 S169 | L161-F165 HydrophobicContact CD1-CD2 4.09Å; L161-F165 HydrophobicContact CD1-CE2 3.59Å; L161-F165 HydrophobicContact CD2-CE2 4.38Å; L161-F165 HydrophobicContact CG-CD2 3.95Å; L161-F165 HydrophobicContact CG-CE2 3.76Å; L161-F165 VanDerWaalsContact O-CD2 3.23Å; L161-F165 WeakPolarHBondContact O-CD2 3.26Å; L161-F165 PolarHBondContact O-N 3Å; I162-F165 PolarHBondContact O-N 3.39Å; F165-C167 VanDerWaalsContact C-N 3.33Å; F165-C167 PolarHBondContact O-N 3.33Å; F165-I168 PolarHBondContact O-N 3.41Å; F165-S169 WeakPolarHBondContact O-CB 3.37Å; F165-S169 PolarHBondContact O-N 3.45Å; F165-S169 PolarHBondContact O-OG 3.23Å |
| 166 | S | 96.9 | Very high | 95.6 | Very high | 49 Ų | 49 | 50.2 Ų | 50.2 | 34% | 0.343 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -59.8 | -42.8 | 175.8 | -171.5 | 0 | 0 | 0 | 0 | 111.7 | I162 G163 F164 S169 T170 V234 | I162-S166 VanDerWaalsContact O-CB 3.3Å; I162-S166 WeakPolarHBondContact O-CB 3.43Å; I162-S166 PolarHBondContact O-N 2.88Å; G163-S166 WeakPolarHBondContact O-CB 3.32Å; G163-S166 PolarHBondContact O-N 2.89Å; F164-S166 VanDerWaalsContact C-N 3.32Å; F164-S166 PolarHBondContact O-N 3.48Å; S166-S169 PolarHBondContact O-N 3.48Å; S166-T170 PolarHBondContact O-N 2.81Å; S166-T170 PolarHBondContact O-OG1 3.32Å; S166-V234 WeakPolarHBondContact OG-CG1 3.42Å |
| 167 | C | 96.9 | Very high | 96 | Very high | 13 Ų | 13 | 48.2 Ų | 48.2 | 9% | 0.088 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -62.5 | -47.7 | 176.8 | -64.3 | 0 | 0 | 0 | 0 | 111.2 | G163 F164 F165 S169 T170 L171 I235 | G163-C167 PolarHBondContact O-N 2.72Å; G163-C167 PolarHBondContact O-SG 3.44Å; F164-C167 PolarHBondContact O-N 3.04Å; F165-C167 VanDerWaalsContact C-N 3.33Å; F165-C167 PolarHBondContact O-N 3.33Å; C167-S169 VanDerWaalsContact C-N 3.35Å; C167-S169 PolarHBondContact O-N 3Å; C167-T170 PolarHBondContact O-N 3.43Å; C167-L171 WeakPolarHBondContact O-CG 3.27Å; C167-L171 PolarHBondContact O-N 3.49Å; C167-I235 HydrophobicContact CB-CD1 3.87Å |
| 168 | I | 97.6 | Very high | 96.4 | Very high | 56 Ų | 56 | 45 Ų | 45 | 29% | 0.287 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -60.3 | -45.5 | 177.2 | -67.7 | 173.1 | 0 | 0 | 0 | 110.7 | F164 F165 T170 L171 C172 | F164-I168 HydrophobicContact CD1-CD1 3.86Å; F164-I168 HydrophobicContact CE1-CD1 3.36Å; F164-I168 HydrophobicContact CE2-CD1 4.29Å; F164-I168 HydrophobicContact CZ-CD1 3.61Å; F164-I168 PolarHBondContact O-N 3.35Å; F164-I168 VanDerWaalsContact O-N 3.09Å; F165-I168 PolarHBondContact O-N 3.41Å; I168-T170 VanDerWaalsContact C-N 3.35Å; I168-T170 PolarHBondContact O-N 3.06Å; I168-L171 PolarHBondContact O-N 3.42Å; I168-C172 PolarHBondContact O-N 2.88Å; I168-C172 PolarHBondContact O-SG 2.91Å |
| 169 | S | 97.7 | Very high | 96.7 | Very high | 61 Ų | 61 | 43.8 Ų | 43.8 | 43% | 0.427 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -59.7 | -43.9 | 177.8 | -63.5 | 0 | 0 | 0 | 0 | 111.9 | F165 S166 C167 L171 C172 I173 | F165-S169 WeakPolarHBondContact O-CB 3.37Å; F165-S169 PolarHBondContact O-N 3.45Å; F165-S169 PolarHBondContact O-OG 3.23Å; S166-S169 PolarHBondContact O-N 3.48Å; C167-S169 VanDerWaalsContact C-N 3.35Å; C167-S169 PolarHBondContact O-N 3Å; S169-L171 VanDerWaalsContact C-N 3.33Å; S169-L171 PolarHBondContact O-N 2.94Å; S169-C172 PolarHBondContact O-N 3.4Å; S169-I173 WeakPolarHBondContact O-CB 3.36Å; S169-I173 WeakPolarHBondContact O-CD1 3.37Å; S169-I173 VanDerWaalsContact O-CG1 3.22Å; S169-I173 WeakPolarHBondContact O-CG1 3.48Å; S169-I173 PolarHBondContact O-N 2.96Å |
| 170 | T | 97.8 | Very high | 96.8 | Very high | 20 Ų | 20 | 50.1 Ų | 50.1 | 12% | 0.123 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -60.5 | -41.7 | 175.7 | -61.5 | 0 | 0 | 0 | 0 | 112 | S166 C167 I168 G174 L197 Y227 | S166-T170 PolarHBondContact O-N 2.81Å; S166-T170 PolarHBondContact O-OG1 3.32Å; C167-T170 PolarHBondContact O-N 3.43Å; I168-T170 VanDerWaalsContact C-N 3.35Å; I168-T170 PolarHBondContact O-N 3.06Å; T170-G174 PolarHBondContact O-N 3.18Å; T170-L197 HydrophobicContact CG2-CD1 3.77Å; T170-Y227 HydrophobicContact CG2-CE2 4.17Å; T170-Y227 WeakPolarHBondContact O-CE2 3.29Å; T170-Y227 PolarHBondContact O-OH 3.48Å |
| 171 | L | 98.3 | Very high | 96.9 | Very high | 12 Ų | 12 | 52.6 Ų | 52.6 | 6% | 0.063 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -66 | -44.9 | 176.3 | -66.5 | 171.4 | 0 | 0 | 0 | 111.6 | C167 I168 S169 G174 A175 Y190 C193 F194 L197 | C167-L171 WeakPolarHBondContact O-CG 3.27Å; C167-L171 PolarHBondContact O-N 3.49Å; I168-L171 PolarHBondContact O-N 3.42Å; S169-L171 VanDerWaalsContact C-N 3.33Å; S169-L171 PolarHBondContact O-N 2.94Å; L171-G174 PolarHBondContact O-N 3.04Å; L171-A175 VanDerWaalsContact O-CB 3.28Å; L171-A175 WeakPolarHBondContact O-CB 3.41Å; L171-A175 PolarHBondContact O-N 2.95Å; L171-Y190 HydrophobicContact CB-CD2 4.19Å; L171-Y190 HydrophobicContact CB-CE1 4.44Å; L171-Y190 HydrophobicContact CB-CE2 3.55Å; L171-Y190 HydrophobicContact CD1-CE1 4.24Å; L171-Y190 WeakPolarHBondContact CD1-OH 3.34Å; L171-C193 HydrophobicContact CD2-CB 3.86Å; L171-F194 HydrophobicContact CD1-CD2 4.05Å; L171-F194 HydrophobicContact CD2-CB 4.19Å; L171-L197 HydrophobicContact CD2-CD1 4.04Å |
| 172 | C | 98.3 | Very high | 96.8 | Very high | 49 Ų | 49 | 48.2 Ų | 48.2 | 33% | 0.331 | 26% | 0.261 | S | S | . | . | H | α-helix | trans | -64.8 | -42.2 | 178.7 | -68.5 | 0 | 0 | 0 | 0 | 112.8 | I168 S169 A175 A176 | I168-C172 PolarHBondContact O-N 2.88Å; I168-C172 PolarHBondContact O-SG 2.91Å; S169-C172 PolarHBondContact O-N 3.4Å; C172-A175 PolarHBondContact O-N 3.35Å; C172-A176 WeakPolarHBondContact O-CB 3.31Å; C172-A176 PolarHBondContact O-N 3.49Å |
| 173 | I | 97.9 | Very high | 96.8 | Very high | 110 Ų | 110 | 52.6 Ų | 52.6 | 56% | 0.564 | 28% | 0.28 | S | S | * | . | H | α-helix | trans | -64 | -44.2 | 177.2 | -69.3 | 165.2 | 0 | 0 | 0 | 110.2 | S169 A176 A177 | S169-I173 WeakPolarHBondContact O-CB 3.36Å; S169-I173 WeakPolarHBondContact O-CD1 3.37Å; S169-I173 VanDerWaalsContact O-CG1 3.22Å; S169-I173 WeakPolarHBondContact O-CG1 3.48Å; S169-I173 PolarHBondContact O-N 2.96Å; I173-A176 PolarHBondContact O-N 3.48Å; I173-A177 PolarHBondContact O-N 3Å; I173-A177 VanDerWaalsContact O-N 3.1Å |
| 174 | G | 97.8 | Very high | 97 | Very high | 0 Ų | 0 | 53.6 Ų | 53.6 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -60.7 | -49.4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | T170 L171 A176 A177 F178 Y227 | T170-G174 PolarHBondContact O-N 3.18Å; L171-G174 PolarHBondContact O-N 3.04Å; G174-A176 VanDerWaalsContact C-N 3.31Å; G174-A176 PolarHBondContact O-N 3.1Å; G174-A177 PolarHBondContact O-N 3.28Å; G174-A177 VanDerWaalsContact O-N 3.14Å; G174-F178 WeakPolarHBondContact O-CD2 3.42Å; G174-F178 PolarHBondContact O-N 3.13Å; G174-Y227 WeakPolarHBondContact CA-OH 3.37Å |
| 175 | A | 98.1 | Very high | 97.1 | Very high | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -57.5 | -43 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | L171 C172 S179 F186 A189 Y190 | L171-A175 VanDerWaalsContact O-CB 3.28Å; L171-A175 WeakPolarHBondContact O-CB 3.41Å; L171-A175 PolarHBondContact O-N 2.95Å; C172-A175 PolarHBondContact O-N 3.35Å; A175-S179 WeakPolarHBondContact O-CB 3.32Å; A175-S179 PolarHBondContact O-N 3.13Å; A175-S179 PolarHBondContact O-OG 3.48Å; A175-F186 HydrophobicContact CB-CD2 3.98Å; A175-F186 HydrophobicContact CB-CE1 4.13Å; A175-F186 HydrophobicContact CB-CE2 3.56Å; A175-F186 HydrophobicContact CB-CG 4.44Å; A175-F186 HydrophobicContact CB-CZ 3.65Å; A175-A189 HydrophobicContact CB-CB 4.26Å; A175-A189 VanDerWaalsContact O-CB 3.31Å; A175-A189 WeakPolarHBondContact O-CB 3.16Å; A175-Y190 HydrophobicContact CB-CD2 3.98Å; A175-Y190 HydrophobicContact CB-CG 4.37Å |
| 176 | A | 98.1 | Very high | 97.2 | Very high | 52 Ų | 52 | 51.4 Ų | 51.4 | 43% | 0.43 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -61.8 | -45.7 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | C172 I173 G174 S179 H180 F186 | C172-A176 WeakPolarHBondContact O-CB 3.31Å; C172-A176 PolarHBondContact O-N 3.49Å; I173-A176 PolarHBondContact O-N 3.48Å; G174-A176 VanDerWaalsContact C-N 3.31Å; G174-A176 PolarHBondContact O-N 3.1Å; A176-S179 PolarHBondContact O-OG 3.42Å; A176-H180 PolarHBondContact O-N 2.62Å; A176-F186 HydrophobicContact CB-CE2 4.36Å |
| 177 | A | 97.3 | Very high | 97.3 | Very high | 19 Ų | 19 | 56.4 Ų | 56.4 | 16% | 0.157 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -67.8 | -51 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | I173 G174 S179 H180 Y181 F223 | I173-A177 PolarHBondContact O-N 3Å; I173-A177 VanDerWaalsContact O-N 3.1Å; G174-A177 PolarHBondContact O-N 3.28Å; G174-A177 VanDerWaalsContact O-N 3.14Å; A177-S179 PolarHBondContact O-N 2.88Å; A177-H180 WeakPolarHBondContact O-CB 3.29Å; A177-H180 PolarHBondContact O-N 3.39Å; A177-Y181 WeakPolarHBondContact O-CD2 3.33Å; A177-Y181 PolarHBondContact O-N 2.92Å; A177-F223 HydrophobicContact CB-CE1 3.65Å; A177-F223 HydrophobicContact CB-CE2 4.34Å; A177-F223 HydrophobicContact CB-CZ 3.35Å |
| 178 | F | 97.3 | Very high | 97.3 | Very high | 0 Ų | 0 | 58.6 Ų | 58.6 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -69.9 | -32.1 | -176.9 | -68.9 | -64.1 | 0 | 0 | 0 | 112.9 | G174 H180 Y181 E182 W184 A189 Y192 C193 A207 Y220 F223 Y227 | G174-F178 WeakPolarHBondContact O-CD2 3.42Å; G174-F178 PolarHBondContact O-N 3.13Å; F178-H180 VanDerWaalsContact C-N 3.27Å; F178-H180 PolarHBondContact O-N 3.48Å; F178-Y181 PolarHBondContact O-N 3.39Å; F178-E182 VanDerWaalsContact O-CB 3.31Å; F178-E182 WeakPolarHBondContact O-CB 3.48Å; F178-E182 PolarHBondContact O-N 3.33Å; F178-W184 HydrophobicContact CB-CE3 4.48Å; F178-W184 HydrophobicContact CB-CZ3 4.5Å; F178-A189 HydrophobicContact CB-CB 4.11Å; F178-Y192 HydrophobicContact CB-CD1 4.42Å; F178-Y192 HydrophobicContact CD1-CE1 4.01Å; F178-Y192 AromaticContact CD2-CD1 3.95Å; F178-Y192 HydrophobicContact CD2-CD1 3.95Å; F178-Y192 AromaticContact CD2-CE1 3.65Å; F178-Y192 HydrophobicContact CD2-CE1 3.65Å; F178-Y192 HydrophobicContact CE1-CE1 4.06Å; F178-Y192 HydrophobicContact CE2-CD1 4.41Å; F178-Y192 AromaticContact CE2-CE1 3.71Å; F178-Y192 HydrophobicContact CE2-CE1 3.71Å; F178-Y192 HydrophobicContact CG-CD1 4.1Å; F178-Y192 AromaticContact CG-CE1 3.82Å; F178-Y192 HydrophobicContact CG-CE1 3.82Å; F178-Y192 AromaticContact CZ-CE1 3.92Å; F178-Y192 HydrophobicContact CZ-CE1 3.92Å; F178-C193 VanDerWaalsContact CD2-SG 3.58Å; F178-A207 HydrophobicContact CD1-CB 4.01Å; F178-A207 HydrophobicContact CE1-CB 3.77Å; F178-Y220 HydrophobicContact CD1-CE2 4.08Å; F178-Y220 WeakPolarHBondContact CD1-OH 3.32Å; F178-Y220 AromaticContact CE1-CE2 3.93Å; F178-Y220 HydrophobicContact CE1-CE2 3.93Å; F178-F223 HydrophobicContact CE1-CE1 4.23Å; F178-F223 HydrophobicContact CE2-CE1 4.45Å; F178-F223 HydrophobicContact CZ-CE1 4.04Å; F178-Y227 AromaticContact CE2-CD1 3.53Å; F178-Y227 HydrophobicContact CE2-CD1 3.53Å; F178-Y227 AromaticContact CE2-CE1 3.69Å; F178-Y227 HydrophobicContact CE2-CE1 3.69Å; F178-Y227 HydrophobicContact CE2-CG 4.05Å; F178-Y227 AromaticContact CZ-CD1 3.91Å; F178-Y227 HydrophobicContact CZ-CD1 3.91Å; F178-Y227 HydrophobicContact CZ-CE1 4.49Å; F178-Y227 HydrophobicContact CZ-CG 4.32Å |
| 179 | S | 97.6 | Very high | 97.3 | Very high | 26 Ų | 26 | 55.9 Ų | 55.9 | 18% | 0.182 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -61.7 | -38 | 172 | 60.7 | 0 | 0 | 0 | 0 | 111.8 | A175 A176 A177 H183 W184 | A175-S179 WeakPolarHBondContact O-CB 3.32Å; A175-S179 PolarHBondContact O-N 3.13Å; A175-S179 PolarHBondContact O-OG 3.48Å; A176-S179 PolarHBondContact O-OG 3.42Å; A177-S179 PolarHBondContact O-N 2.88Å; S179-H183 WeakPolarHBondContact O-CA 3.47Å; S179-H183 PolarHBondContact O-N 2.71Å; S179-W184 WeakPolarHBondContact CA-O 3.39Å; S179-W184 VanDerWaalsContact CB-O 3.28Å; S179-W184 WeakPolarHBondContact CB-O 3.39Å; S179-W184 PolarHBondContact O-N 3.09Å |
| 180 | H | 95.4 | Very high | 97.4 | Very high | 136 Ų | 136 | 56.2 Ų | 56.2 | 63% | 0.63 | 28% | 0.28 | S | S | * | . | H | α-helix | trans | -71 | -48.8 | 176.2 | -179.6 | -86.5 | 0 | 0 | 0 | 112.5 | A176 A177 F178 | A176-H180 PolarHBondContact O-N 2.62Å; A177-H180 WeakPolarHBondContact O-CB 3.29Å; A177-H180 PolarHBondContact O-N 3.39Å; F178-H180 VanDerWaalsContact C-N 3.27Å; F178-H180 PolarHBondContact O-N 3.48Å |
| 181 | Y | 94.6 | Very high | 97.4 | Very high | 109 Ų | 109 | 58.6 Ų | 58.6 | 43% | 0.427 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -74.7 | -39.7 | -175.8 | -75.2 | -68 | 0 | 0 | 0 | 113.9 | A177 F178 Y220 | A177-Y181 WeakPolarHBondContact O-CD2 3.33Å; A177-Y181 PolarHBondContact O-N 2.92Å; F178-Y181 PolarHBondContact O-N 3.39Å; Y181-Y220 HydrophobicContact CD1-CD2 4.06Å; Y181-Y220 HydrophobicContact CD1-CE2 4.47Å; Y181-Y220 HydrophobicContact CD1-CG 4.16Å; Y181-Y220 AromaticContact CD2-CD2 3.8Å; Y181-Y220 HydrophobicContact CD2-CD2 3.8Å; Y181-Y220 AromaticContact CD2-CE2 3.82Å; Y181-Y220 HydrophobicContact CD2-CE2 3.82Å; Y181-Y220 HydrophobicContact CE1-CD2 4.45Å; Y181-Y220 HydrophobicContact CE2-CD2 4.22Å; Y181-Y220 AromaticContact CG-CD2 3.73Å; Y181-Y220 HydrophobicContact CG-CD2 3.73Å; Y181-Y220 AromaticContact CG-CE2 3.75Å; Y181-Y220 HydrophobicContact CG-CE2 3.75Å; Y181-Y220 HydrophobicContact CG-CG 4.23Å |
| 182 | E | 94.2 | Very high | 97.4 | Very high | 3 Ų | 3 | 58.2 Ų | 58.2 | 1% | 0.014 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -94.8 | -0.1 | -176.7 | -64.9 | -70.1 | 160.4 | 0 | 0 | 112.9 | F178 W184 A207 L208 K210 Y220 | F178-E182 VanDerWaalsContact O-CB 3.31Å; F178-E182 WeakPolarHBondContact O-CB 3.48Å; F178-E182 PolarHBondContact O-N 3.33Å; E182-W184 HydrophobicContact CB-CD2 3.43Å; E182-W184 VanDerWaalsContact CB-CD2 3.43Å; E182-W184 VanDerWaalsContact CB-CE2 3.49Å; E182-W184 HydrophobicContact CB-CE3 3.72Å; E182-W184 HydrophobicContact CB-CG 3.89Å; E182-W184 HydrophobicContact CB-CH2 4.1Å; E182-W184 HydrophobicContact CB-CZ2 3.84Å; E182-W184 HydrophobicContact CB-CZ3 4.05Å; E182-W184 HydrophobicContact CG-CD2 4.19Å; E182-W184 HydrophobicContact CG-CE3 4.08Å; E182-W184 HydrophobicContact CG-CH2 3.81Å; E182-W184 HydrophobicContact CG-CZ2 3.92Å; E182-W184 HydrophobicContact CG-CZ3 3.89Å; E182-W184 PolarHBondContact O-N 3.16Å; E182-A207 WeakPolarHBondContact OE1-CA 3.28Å; E182-L208 PolarHBondContact OE1-N 2.98Å; E182-K210 PolarHBondContact O-NZ 2.82Å; E182-Y220 VanDerWaalsContact CG-OH 3.27Å; E182-Y220 WeakPolarHBondContact CG-OH 3.33Å; E182-Y220 WeakPolarHBondContact OE1-CE1 3.34Å; E182-Y220 PolarHBondContact OE1-OH 2.86Å |
| 183 | H | 95.6 | Very high | 97.4 | Very high | 152 Ų | 152 | 55.9 Ų | 55.9 | 70% | 0.704 | 27% | 0.269 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.4 | 41.2 | -174.1 | -55.9 | -63.1 | 0 | 0 | 0 | 112.7 | S179 | S179-H183 WeakPolarHBondContact O-CA 3.47Å; S179-H183 PolarHBondContact O-N 2.71Å |
| 184 | W | 97.6 | Very high | 97.4 | Very high | 33 Ų | 33 | 55.3 Ų | 55.3 | 13% | 0.125 | 26% | 0.263 | C | S | . | . | trans | -95.1 | 160.7 | 173.7 | -65.6 | -27.9 | 0 | 0 | 0 | 110.7 | F178 S179 E182 Q188 A189 Y192 Y205 | F178-W184 HydrophobicContact CB-CE3 4.48Å; F178-W184 HydrophobicContact CB-CZ3 4.5Å; S179-W184 WeakPolarHBondContact CA-O 3.39Å; S179-W184 VanDerWaalsContact CB-O 3.28Å; S179-W184 WeakPolarHBondContact CB-O 3.39Å; S179-W184 PolarHBondContact O-N 3.09Å; E182-W184 HydrophobicContact CB-CD2 3.43Å; E182-W184 VanDerWaalsContact CB-CD2 3.43Å; E182-W184 VanDerWaalsContact CB-CE2 3.49Å; E182-W184 HydrophobicContact CB-CE3 3.72Å; E182-W184 HydrophobicContact CB-CG 3.89Å; E182-W184 HydrophobicContact CB-CH2 4.1Å; E182-W184 HydrophobicContact CB-CZ2 3.84Å; E182-W184 HydrophobicContact CB-CZ3 4.05Å; E182-W184 HydrophobicContact CG-CD2 4.19Å; E182-W184 HydrophobicContact CG-CE3 4.08Å; E182-W184 HydrophobicContact CG-CH2 3.81Å; E182-W184 HydrophobicContact CG-CZ2 3.92Å; E182-W184 HydrophobicContact CG-CZ3 3.89Å; E182-W184 PolarHBondContact O-N 3.16Å; W184-Q188 HydrophobicContact CB-CB 4.02Å; W184-A189 HydrophobicContact CE3-CB 4.41Å; W184-Y192 HydrophobicContact CH2-CG 4.43Å; W184-Y192 AromaticContact CZ3-CD1 3.86Å; W184-Y192 HydrophobicContact CZ3-CD1 3.86Å; W184-Y192 HydrophobicContact CZ3-CD2 4.33Å; W184-Y192 HydrophobicContact CZ3-CE1 4.41Å; W184-Y192 AromaticContact CZ3-CG 3.81Å; W184-Y192 HydrophobicContact CZ3-CG 3.81Å; W184-Y205 AromaticContact CD2-CD1 3.8Å; W184-Y205 HydrophobicContact CD2-CD1 3.8Å; W184-Y205 HydrophobicContact CD2-CE1 4.28Å; W184-Y205 AromaticContact CE2-CD1 3.56Å; W184-Y205 HydrophobicContact CE3-CD1 4.17Å; W184-Y205 HydrophobicContact CG-CD1 4.32Å; W184-Y205 HydrophobicContact CG-CE1 4.32Å; W184-Y205 HydrophobicContact CH2-CD1 4.12Å; W184-Y205 AromaticContact CZ2-CD1 3.75Å; W184-Y205 HydrophobicContact CZ2-CD1 3.75Å; W184-Y205 HydrophobicContact CZ3-CD1 4.31Å; W184-Y205 AromaticContact NE1-CD1 3.87Å | ||
| 185 | T | 98.2 | Very high | 97.5 | Very high | 78 Ų | 78 | 55.8 Ų | 55.8 | 48% | 0.479 | 27% | 0.266 | S | S | . | . | trans | -66.7 | 154.8 | 166.9 | 70.3 | 0 | 0 | 0 | 0 | 109.9 | F187 Q188 A189 | T185-F187 PolarHBondContact O-N 2.9Å; T185-Q188 PolarHBondContact O-N 3Å; T185-Q188 VanDerWaalsContact O-N 3.16Å; T185-Q188 VanDerWaalsContact OG1-CG 3.27Å; T185-Q188 WeakPolarHBondContact OG1-CG 3.49Å; T185-Q188 PolarHBondContact OG1-N 3Å; T185-Q188 PolarHBondContact OG1-OE1 3.32Å; T185-A189 PolarHBondContact O-N 3.5Å | ||
| 186 | F | 98.1 | Very high | 97.5 | Very high | 101 Ų | 101 | 55.8 Ų | 55.8 | 44% | 0.443 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -55.4 | -38.9 | 177.4 | -175.8 | -90 | 0 | 0 | 0 | 111.8 | A175 A176 A189 Y190 | A175-F186 HydrophobicContact CB-CD2 3.98Å; A175-F186 HydrophobicContact CB-CE1 4.13Å; A175-F186 HydrophobicContact CB-CE2 3.56Å; A175-F186 HydrophobicContact CB-CG 4.44Å; A175-F186 HydrophobicContact CB-CZ 3.65Å; A176-F186 HydrophobicContact CB-CE2 4.36Å; F186-A189 PolarHBondContact O-N 2.81Å; F186-Y190 HydrophobicContact CE1-CD2 4.04Å; F186-Y190 HydrophobicContact CZ-CD2 4.36Å; F186-Y190 VanDerWaalsContact O-CB 3.29Å; F186-Y190 WeakPolarHBondContact O-CB 3.36Å; F186-Y190 PolarHBondContact O-N 3.27Å |
| 187 | F | 98.3 | Very high | 97.5 | Very high | 155 Ų | 155 | 53.5 Ų | 53.5 | 68% | 0.68 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -63.8 | -46.6 | 177.5 | 178.8 | -101.6 | 0 | 0 | 0 | 112.5 | T185 A189 Y190 Y191 | T185-F187 PolarHBondContact O-N 2.9Å; F187-A189 VanDerWaalsContact C-N 3.32Å; F187-A189 PolarHBondContact O-N 2.98Å; F187-Y190 PolarHBondContact O-N 3.12Å; F187-Y191 WeakPolarHBondContact O-CB 3.47Å; F187-Y191 PolarHBondContact O-N 3.29Å |
| 188 | Q | 98 | Very high | 97.4 | Very high | 58 Ų | 58 | 54.9 Ų | 54.9 | 27% | 0.271 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -59.7 | -44 | 175.8 | -74 | 167.6 | -20.5 | 0 | 0 | 111.4 | W184 T185 Y191 Y192 Y205 | W184-Q188 HydrophobicContact CB-CB 4.02Å; T185-Q188 PolarHBondContact O-N 3Å; T185-Q188 VanDerWaalsContact O-N 3.16Å; T185-Q188 VanDerWaalsContact OG1-CG 3.27Å; T185-Q188 WeakPolarHBondContact OG1-CG 3.49Å; T185-Q188 PolarHBondContact OG1-N 3Å; T185-Q188 PolarHBondContact OG1-OE1 3.32Å; Q188-Y191 PolarHBondContact O-N 3.16Å; Q188-Y192 WeakPolarHBondContact O-CB 3.41Å; Q188-Y192 PolarHBondContact O-N 3.21Å; Q188-Y205 HydrophobicContact CB-CD1 4.5Å; Q188-Y205 HydrophobicContact CB-CE1 3.88Å; Q188-Y205 HydrophobicContact CG-CE1 3.97Å; Q188-Y205 WeakPolarHBondContact CG-OH 3.31Å; Q188-Y205 PolarHBondContact NE2-OH 3.29Å; Q188-Y205 VanDerWaalsContact NE2-OH 3.11Å |
| 189 | A | 98.3 | Very high | 97.4 | Very high | 0 Ų | 0 | 57.3 Ų | 57.3 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -66.2 | -37.7 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | A175 F178 W184 T185 F186 F187 Y192 C193 | A175-A189 HydrophobicContact CB-CB 4.26Å; A175-A189 VanDerWaalsContact O-CB 3.31Å; A175-A189 WeakPolarHBondContact O-CB 3.16Å; F178-A189 HydrophobicContact CB-CB 4.11Å; W184-A189 HydrophobicContact CE3-CB 4.41Å; T185-A189 PolarHBondContact O-N 3.5Å; F186-A189 PolarHBondContact O-N 2.81Å; F187-A189 VanDerWaalsContact C-N 3.32Å; F187-A189 PolarHBondContact O-N 2.98Å; A189-Y192 PolarHBondContact O-N 3.27Å; A189-C193 PolarHBondContact O-N 3.47Å; A189-C193 PolarHBondContact O-SG 3.45Å |
| 190 | Y | 98.4 | Very high | 97.5 | Very high | 68 Ų | 68 | 60 Ų | 60 | 27% | 0.267 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -65.7 | -46.1 | 175 | -167.9 | -81.1 | 0 | 0 | 0 | 111.7 | L171 A175 F186 F187 C193 F194 | L171-Y190 HydrophobicContact CB-CD2 4.19Å; L171-Y190 HydrophobicContact CB-CE1 4.44Å; L171-Y190 HydrophobicContact CB-CE2 3.55Å; L171-Y190 HydrophobicContact CD1-CE1 4.24Å; L171-Y190 WeakPolarHBondContact CD1-OH 3.34Å; A175-Y190 HydrophobicContact CB-CD2 3.98Å; A175-Y190 HydrophobicContact CB-CG 4.37Å; F186-Y190 HydrophobicContact CE1-CD2 4.04Å; F186-Y190 HydrophobicContact CZ-CD2 4.36Å; F186-Y190 VanDerWaalsContact O-CB 3.29Å; F186-Y190 WeakPolarHBondContact O-CB 3.36Å; F186-Y190 PolarHBondContact O-N 3.27Å; F187-Y190 PolarHBondContact O-N 3.12Å; Y190-C193 PolarHBondContact O-N 3.2Å; Y190-F194 WeakPolarHBondContact O-CB 3.29Å; Y190-F194 PolarHBondContact O-N 3.47Å |
| 191 | Y | 98.5 | Very high | 97.5 | Very high | 70 Ų | 70 | 53.6 Ų | 53.6 | 28% | 0.275 | 25% | 0.25 | S | S | . | . | H | α-helix | trans | -57.8 | -47.5 | 173.6 | 166.1 | -94.7 | 0 | 0 | 0 | 111.2 | F187 Q188 C193 F194 I195 F202 D204 Y205 | F187-Y191 WeakPolarHBondContact O-CB 3.47Å; F187-Y191 PolarHBondContact O-N 3.29Å; Q188-Y191 PolarHBondContact O-N 3.16Å; Y191-C193 PolarHBondContact O-N 3.37Å; Y191-F194 PolarHBondContact O-N 3.01Å; Y191-I195 HydrophobicContact CD1-CG1 4.48Å; Y191-I195 HydrophobicContact CD2-CG1 3.96Å; Y191-I195 HydrophobicContact CE1-CG1 4.13Å; Y191-I195 HydrophobicContact CE2-CD1 4.01Å; Y191-I195 HydrophobicContact CE2-CG1 3.57Å; Y191-I195 HydrophobicContact CG-CG1 4.41Å; Y191-I195 WeakPolarHBondContact O-CB 3.39Å; Y191-I195 WeakPolarHBondContact O-CG1 3.16Å; Y191-I195 PolarHBondContact O-N 3.44Å; Y191-F202 WeakPolarHBondContact OH-CD2 3.31Å; Y191-D204 WeakPolarHBondContact CE1-OD2 3.5Å; Y191-D204 PolarHBondContact OH-OD2 3.34Å; Y191-Y205 HydrophobicContact CD1-CD2 4.09Å; Y191-Y205 HydrophobicContact CD1-CE2 4.48Å; Y191-Y205 AromaticContact CE1-CD2 3.95Å; Y191-Y205 HydrophobicContact CE1-CD2 3.95Å; Y191-Y205 HydrophobicContact CE1-CE2 4.42Å |
| 192 | Y | 98.4 | Very high | 97.6 | Very high | 3 Ų | 3 | 54.6 Ų | 54.6 | 1% | 0.012 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -54.6 | -50.8 | 173.4 | 162.7 | -106.5 | 0 | 0 | 0 | 111.6 | Y96 F178 W184 Q188 A189 F194 I195 T196 Y205 A207 | Y96-Y192 HydrophobicContact CE1-CE2 4.21Å; F178-Y192 HydrophobicContact CB-CD1 4.42Å; F178-Y192 HydrophobicContact CD1-CE1 4.01Å; F178-Y192 AromaticContact CD2-CD1 3.95Å; F178-Y192 HydrophobicContact CD2-CD1 3.95Å; F178-Y192 AromaticContact CD2-CE1 3.65Å; F178-Y192 HydrophobicContact CD2-CE1 3.65Å; F178-Y192 HydrophobicContact CE1-CE1 4.06Å; F178-Y192 HydrophobicContact CE2-CD1 4.41Å; F178-Y192 AromaticContact CE2-CE1 3.71Å; F178-Y192 HydrophobicContact CE2-CE1 3.71Å; F178-Y192 HydrophobicContact CG-CD1 4.1Å; F178-Y192 AromaticContact CG-CE1 3.82Å; F178-Y192 HydrophobicContact CG-CE1 3.82Å; F178-Y192 AromaticContact CZ-CE1 3.92Å; F178-Y192 HydrophobicContact CZ-CE1 3.92Å; W184-Y192 HydrophobicContact CH2-CG 4.43Å; W184-Y192 AromaticContact CZ3-CD1 3.86Å; W184-Y192 HydrophobicContact CZ3-CD1 3.86Å; W184-Y192 HydrophobicContact CZ3-CD2 4.33Å; W184-Y192 HydrophobicContact CZ3-CE1 4.41Å; W184-Y192 AromaticContact CZ3-CG 3.81Å; W184-Y192 HydrophobicContact CZ3-CG 3.81Å; Q188-Y192 WeakPolarHBondContact O-CB 3.41Å; Q188-Y192 PolarHBondContact O-N 3.21Å; A189-Y192 PolarHBondContact O-N 3.27Å; Y192-F194 VanDerWaalsContact C-N 3.31Å; Y192-F194 PolarHBondContact O-N 2.77Å; Y192-I195 PolarHBondContact O-N 3.16Å; Y192-T196 VanDerWaalsContact CE2-OG1 3.26Å; Y192-T196 WeakPolarHBondContact CE2-OG1 3.29Å; Y192-T196 WeakPolarHBondContact O-CB 3.31Å; Y192-T196 PolarHBondContact O-N 3.4Å; Y192-T196 PolarHBondContact O-OG1 2.85Å; Y192-Y205 VanDerWaalsContact CD2-O 3.28Å; Y192-Y205 WeakPolarHBondContact CD2-O 3.49Å; Y192-A207 HydrophobicContact CE1-CB 4.22Å; Y192-A207 VanDerWaalsContact OH-CB 3.3Å; Y192-A207 WeakPolarHBondContact OH-CB 3.47Å |
| 193 | C | 98.4 | Very high | 97.7 | Very high | 0 Ų | 0 | 55.7 Ų | 55.7 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -60.1 | -41.9 | 179 | -66.7 | 0 | 0 | 0 | 0 | 111.8 | L171 F178 A189 Y190 Y191 T196 L197 Y227 | L171-C193 HydrophobicContact CD2-CB 3.86Å; F178-C193 VanDerWaalsContact CD2-SG 3.58Å; A189-C193 PolarHBondContact O-N 3.47Å; A189-C193 PolarHBondContact O-SG 3.45Å; Y190-C193 PolarHBondContact O-N 3.2Å; Y191-C193 PolarHBondContact O-N 3.37Å; C193-T196 PolarHBondContact O-N 2.9Å; C193-L197 WeakPolarHBondContact O-CB 3.49Å; C193-L197 VanDerWaalsContact O-CG 3.27Å; C193-L197 WeakPolarHBondContact O-CG 3.49Å; C193-L197 PolarHBondContact O-N 3.24Å; C193-Y227 WeakPolarHBondContact CB-OH 3.43Å; C193-Y227 PolarHBondContact SG-OH 3.49Å |
| 194 | F | 98.4 | Very high | 97.7 | Very high | 99 Ų | 99 | 52.6 Ų | 52.6 | 43% | 0.434 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -63.8 | -52 | 178.8 | -177.6 | -92.7 | 0 | 0 | 0 | 111.8 | L171 Y190 Y191 Y192 T196 L197 T198 | L171-F194 HydrophobicContact CD1-CD2 4.05Å; L171-F194 HydrophobicContact CD2-CB 4.19Å; Y190-F194 WeakPolarHBondContact O-CB 3.29Å; Y190-F194 PolarHBondContact O-N 3.47Å; Y191-F194 PolarHBondContact O-N 3.01Å; Y192-F194 VanDerWaalsContact C-N 3.31Å; Y192-F194 PolarHBondContact O-N 2.77Å; F194-T196 PolarHBondContact O-N 2.84Å; F194-L197 PolarHBondContact O-N 2.87Å; F194-T198 HydrophobicContact CD1-CG2 4.41Å; F194-T198 HydrophobicContact CD2-CG2 4.41Å; F194-T198 HydrophobicContact CE1-CG2 4.1Å; F194-T198 HydrophobicContact CE2-CG2 4.11Å; F194-T198 HydrophobicContact CZ-CG2 3.94Å; F194-T198 WeakPolarHBondContact O-CB 3.35Å; F194-T198 VanDerWaalsContact O-CG2 3.32Å; F194-T198 WeakPolarHBondContact O-CG2 3.47Å; F194-T198 PolarHBondContact O-N 3.22Å; F194-T198 PolarHBondContact O-OG1 3.16Å |
| 195 | I | 98.3 | Very high | 97.6 | Very high | 10 Ų | 10 | 54 Ų | 54 | 5% | 0.051 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -62.4 | -33.5 | 178.6 | -67 | -56.3 | 0 | 0 | 0 | 111.9 | Y191 Y192 T198 I200 G201 F202 | Y191-I195 HydrophobicContact CD1-CG1 4.48Å; Y191-I195 HydrophobicContact CD2-CG1 3.96Å; Y191-I195 HydrophobicContact CE1-CG1 4.13Å; Y191-I195 HydrophobicContact CE2-CD1 4.01Å; Y191-I195 HydrophobicContact CE2-CG1 3.57Å; Y191-I195 HydrophobicContact CG-CG1 4.41Å; Y191-I195 WeakPolarHBondContact O-CB 3.39Å; Y191-I195 WeakPolarHBondContact O-CG1 3.16Å; Y191-I195 PolarHBondContact O-N 3.44Å; Y192-I195 PolarHBondContact O-N 3.16Å; I195-T198 PolarHBondContact O-OG1 3.27Å; I195-I200 HydrophobicContact CD1-CB 4.37Å; I195-I200 HydrophobicContact CD1-CD1 3.92Å; I195-I200 HydrophobicContact CD1-CG2 4.34Å; I195-I200 HydrophobicContact CG2-CB 4.09Å; I195-I200 HydrophobicContact CG2-CG2 4.23Å; I195-I200 PolarHBondContact O-N 3.22Å; I195-G201 PolarHBondContact O-N 3.37Å; I195-F202 HydrophobicContact CD1-CD2 3.91Å; I195-F202 HydrophobicContact CD1-CE2 3.59Å; I195-F202 HydrophobicContact CG1-CD2 4.12Å; I195-F202 HydrophobicContact CG1-CE2 4.29Å; I195-F202 HydrophobicContact CG2-CB 4.43Å; I195-F202 HydrophobicContact CG2-CD2 3.79Å; I195-F202 HydrophobicContact CG2-CE2 4.48Å; I195-F202 HydrophobicContact CG2-CG 4.31Å |
| 196 | T | 98.2 | Very high | 97.6 | Very high | 0 Ų | 0 | 50.9 Ų | 50.9 | 0% | 0 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -67.6 | -55.2 | 175.4 | -61.5 | 0 | 0 | 0 | 0 | 111.8 | I94 Y96 Y192 C193 F194 T198 T199 I228 | I94-T196 HydrophobicContact CD1-CG2 4.15Å; Y96-T196 WeakPolarHBondContact OH-CB 3.44Å; Y96-T196 WeakPolarHBondContact OH-CG2 3.18Å; Y96-T196 PolarHBondContact OH-OG1 2.97Å; Y192-T196 VanDerWaalsContact CE2-OG1 3.26Å; Y192-T196 WeakPolarHBondContact CE2-OG1 3.29Å; Y192-T196 WeakPolarHBondContact O-CB 3.31Å; Y192-T196 PolarHBondContact O-N 3.4Å; Y192-T196 PolarHBondContact O-OG1 2.85Å; C193-T196 PolarHBondContact O-N 2.9Å; F194-T196 PolarHBondContact O-N 2.84Å; T196-T198 VanDerWaalsContact C-N 3.29Å; T196-T198 PolarHBondContact O-N 2.83Å; T196-T199 PolarHBondContact O-N 3.43Å; T196-I228 HydrophobicContact CG2-CG1 4.04Å |
| 197 | L | 97.6 | Very high | 97.4 | Very high | 3 Ų | 3 | 46 Ų | 46 | 2% | 0.016 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -77.3 | -16.4 | -172.3 | -61.7 | -174.8 | 0 | 0 | 0 | 113.3 | T170 L171 C193 F194 T199 Y227 L232 I235 | T170-L197 HydrophobicContact CG2-CD1 3.77Å; L171-L197 HydrophobicContact CD2-CD1 4.04Å; C193-L197 WeakPolarHBondContact O-CB 3.49Å; C193-L197 VanDerWaalsContact O-CG 3.27Å; C193-L197 WeakPolarHBondContact O-CG 3.49Å; C193-L197 PolarHBondContact O-N 3.24Å; F194-L197 PolarHBondContact O-N 2.87Å; L197-T199 VanDerWaalsContact C-N 3.27Å; L197-Y227 HydrophobicContact CD1-CE1 4.35Å; L197-Y227 HydrophobicContact CD2-CE1 4.34Å; L197-Y227 HydrophobicContact CG-CE1 4.48Å; L197-L232 HydrophobicContact CD2-CG 4.28Å; L197-L232 WeakPolarHBondContact O-CD2 3.28Å; L197-I235 HydrophobicContact CB-CG1 3.87Å; L197-I235 HydrophobicContact CD1-CG1 4.42Å |
| 198 | T | 96.8 | Very high | 97.2 | Very high | 48 Ų | 48 | 38.7 Ų | 38.7 | 29% | 0.294 | 19% | 0.191 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -86.7 | 3.3 | 168.4 | 54.5 | 0 | 0 | 0 | 0 | 113 | F194 I195 T196 I200 | F194-T198 HydrophobicContact CD1-CG2 4.41Å; F194-T198 HydrophobicContact CD2-CG2 4.41Å; F194-T198 HydrophobicContact CE1-CG2 4.1Å; F194-T198 HydrophobicContact CE2-CG2 4.11Å; F194-T198 HydrophobicContact CZ-CG2 3.94Å; F194-T198 WeakPolarHBondContact O-CB 3.35Å; F194-T198 VanDerWaalsContact O-CG2 3.32Å; F194-T198 WeakPolarHBondContact O-CG2 3.47Å; F194-T198 PolarHBondContact O-N 3.22Å; F194-T198 PolarHBondContact O-OG1 3.16Å; I195-T198 PolarHBondContact O-OG1 3.27Å; T196-T198 VanDerWaalsContact C-N 3.29Å; T196-T198 PolarHBondContact O-N 2.83Å; T198-I200 PolarHBondContact O-N 3.4Å; T198-I200 WeakPolarHBondContact OG1-CD1 3.38Å |
| 199 | T | 97.3 | Very high | 96.8 | Very high | 51 Ų | 51 | 37.5 Ų | 37.5 | 31% | 0.313 | 19% | 0.185 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 55.7 | 28.7 | -179.5 | 68.1 | 0 | 0 | 0 | 0 | 113.7 | T92 I94 T196 L197 L232 | T92-T199 WeakPolarHBondContact O-CG2 3.29Å; I94-T199 HydrophobicContact CG1-CG2 4.12Å; T196-T199 PolarHBondContact O-N 3.43Å; L197-T199 VanDerWaalsContact C-N 3.27Å; T199-L232 HydrophobicContact CG2-CD2 3.56Å |
| 200 | I | 98.1 | Very high | 96.4 | Very high | 82 Ų | 82 | 41.6 Ų | 41.6 | 42% | 0.421 | 20% | 0.203 | S | C | . | . | trans | -79.8 | -49.1 | 173.3 | -64.1 | 172.1 | 0 | 0 | 0 | 109.2 | I195 T198 F202 | I195-I200 HydrophobicContact CD1-CB 4.37Å; I195-I200 HydrophobicContact CD1-CD1 3.92Å; I195-I200 HydrophobicContact CD1-CG2 4.34Å; I195-I200 HydrophobicContact CG2-CB 4.09Å; I195-I200 HydrophobicContact CG2-CG2 4.23Å; I195-I200 PolarHBondContact O-N 3.22Å; T198-I200 PolarHBondContact O-N 3.4Å; T198-I200 WeakPolarHBondContact OG1-CD1 3.38Å; I200-F202 HydrophobicContact CG2-CD1 3.86Å; I200-F202 HydrophobicContact CG2-CD2 3.99Å; I200-F202 HydrophobicContact CG2-CE1 3.53Å; I200-F202 HydrophobicContact CG2-CE2 3.69Å; I200-F202 HydrophobicContact CG2-CG 4.08Å; I200-F202 HydrophobicContact CG2-CZ 3.45Å; I200-F202 VanDerWaalsContact CG2-CZ 3.45Å; I200-F202 PolarHBondContact O-N 3.46Å | ||
| 201 | G | 97 | Very high | 95.9 | Very high | 3 Ų | 3 | 44.5 Ų | 44.5 | 3% | 0.031 | 22% | 0.223 | C | C | . | . | trans | 52.8 | 55.4 | 171 | 0 | 0 | 0 | 0 | 0 | 115.7 | I94 Y96 I195 G203 | I94-G201 WeakPolarHBondContact O-CA 3.28Å; Y96-G201 VanDerWaalsContact CA-O 3.3Å; Y96-G201 WeakPolarHBondContact CA-O 3.44Å; I195-G201 PolarHBondContact O-N 3.37Å; G201-G203 PolarHBondContact O-N 3.21Å; G201-G203 VanDerWaalsContact O-N 3.16Å | ||
| 202 | F | 96.3 | Very high | 95.3 | Very high | 129 Ų | 129 | 46.6 Ų | 46.6 | 57% | 0.566 | 24% | 0.236 | S | C | * | . | trans | -55.7 | -33.5 | 179.1 | -66.6 | -54.6 | 0 | 0 | 0 | 114.3 | Y191 I195 I200 | Y191-F202 WeakPolarHBondContact OH-CD2 3.31Å; I195-F202 HydrophobicContact CD1-CD2 3.91Å; I195-F202 HydrophobicContact CD1-CE2 3.59Å; I195-F202 HydrophobicContact CG1-CD2 4.12Å; I195-F202 HydrophobicContact CG1-CE2 4.29Å; I195-F202 HydrophobicContact CG2-CB 4.43Å; I195-F202 HydrophobicContact CG2-CD2 3.79Å; I195-F202 HydrophobicContact CG2-CE2 4.48Å; I195-F202 HydrophobicContact CG2-CG 4.31Å; I200-F202 HydrophobicContact CG2-CD1 3.86Å; I200-F202 HydrophobicContact CG2-CD2 3.99Å; I200-F202 HydrophobicContact CG2-CE1 3.53Å; I200-F202 HydrophobicContact CG2-CE2 3.69Å; I200-F202 HydrophobicContact CG2-CG 4.08Å; I200-F202 HydrophobicContact CG2-CZ 3.45Å; I200-F202 VanDerWaalsContact CG2-CZ 3.45Å; I200-F202 PolarHBondContact O-N 3.46Å | ||
| 203 | G | 95.3 | Very high | 94.8 | Very high | 26 Ų | 26 | 46.6 Ų | 46.6 | 27% | 0.268 | 24% | 0.236 | S | C | . | . | S | Bend | trans | 84.1 | 8.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 115.2 | Y96 G201 | Y96-G203 VanDerWaalsContact O-CA 3.28Å; Y96-G203 WeakPolarHBondContact O-CA 3.48Å; G201-G203 PolarHBondContact O-N 3.21Å; G201-G203 VanDerWaalsContact O-N 3.16Å |
| 204 | D | 95.5 | Very high | 94.2 | Very high | 87 Ų | 87 | 47 Ų | 47 | 47% | 0.465 | 24% | 0.238 | S | C | . | . | S | Bend | trans | -65.5 | -39.5 | 168.1 | 56.3 | -18.4 | 0 | 0 | 0 | 111.9 | Y191 | Y191-D204 WeakPolarHBondContact CE1-OD2 3.5Å; Y191-D204 PolarHBondContact OH-OD2 3.34Å |
| 205 | Y | 97.1 | Very high | 93.7 | Very high | 62 Ų | 62 | 46.7 Ų | 46.7 | 24% | 0.243 | 24% | 0.238 | C | C | . | . | S | Bend | trans | -117.2 | 125.4 | 168 | -70.4 | -95.1 | 0 | 0 | 0 | 110.2 | W184 Q188 Y191 Y192 | W184-Y205 AromaticContact CD2-CD1 3.8Å; W184-Y205 HydrophobicContact CD2-CD1 3.8Å; W184-Y205 HydrophobicContact CD2-CE1 4.28Å; W184-Y205 AromaticContact CE2-CD1 3.56Å; W184-Y205 HydrophobicContact CE3-CD1 4.17Å; W184-Y205 HydrophobicContact CG-CD1 4.32Å; W184-Y205 HydrophobicContact CG-CE1 4.32Å; W184-Y205 HydrophobicContact CH2-CD1 4.12Å; W184-Y205 AromaticContact CZ2-CD1 3.75Å; W184-Y205 HydrophobicContact CZ2-CD1 3.75Å; W184-Y205 HydrophobicContact CZ3-CD1 4.31Å; W184-Y205 AromaticContact NE1-CD1 3.87Å; Q188-Y205 HydrophobicContact CB-CD1 4.5Å; Q188-Y205 HydrophobicContact CB-CE1 3.88Å; Q188-Y205 HydrophobicContact CG-CE1 3.97Å; Q188-Y205 WeakPolarHBondContact CG-OH 3.31Å; Q188-Y205 PolarHBondContact NE2-OH 3.29Å; Q188-Y205 VanDerWaalsContact NE2-OH 3.11Å; Y191-Y205 HydrophobicContact CD1-CD2 4.09Å; Y191-Y205 HydrophobicContact CD1-CE2 4.48Å; Y191-Y205 AromaticContact CE1-CD2 3.95Å; Y191-Y205 HydrophobicContact CE1-CD2 3.95Å; Y191-Y205 HydrophobicContact CE1-CE2 4.42Å; Y192-Y205 VanDerWaalsContact CD2-O 3.28Å; Y192-Y205 WeakPolarHBondContact CD2-O 3.49Å |
| 206 | V | 96.3 | Very high | 93.2 | Very high | 13 Ų | 13 | 50 Ų | 50 | 8% | 0.079 | 26% | 0.259 | C | S | . | . | trans | -140.5 | 121.5 | 178.9 | -174.1 | 0 | 0 | 0 | 0 | 109 | Y85 Y96 H98 Q209 | Y85-V206 HydrophobicContact CE1-CG1 4.01Å; Y85-V206 WeakPolarHBondContact OH-CG1 3.14Å; Y96-V206 HydrophobicContact CD1-CG2 4.2Å; Y96-V206 HydrophobicContact CD2-CG1 4.15Å; Y96-V206 HydrophobicContact CG-CG1 4.4Å; Y96-V206 HydrophobicContact CG-CG2 4.04Å; H98-V206 HydrophobicContact CB-CG1 4.34Å; H98-V206 HydrophobicContact CB-CG2 4.2Å; V206-Q209 HydrophobicContact CB-CG 3.82Å; V206-Q209 HydrophobicContact CG1-CG 3.71Å | ||
| 207 | A | 95.2 | Very high | 93 | Very high | 0 Ų | 0 | 53.8 Ų | 53.8 | 0% | 0 | 28% | 0.277 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.6 | 161.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | F178 E182 Y192 Q209 Y220 | F178-A207 HydrophobicContact CD1-CB 4.01Å; F178-A207 HydrophobicContact CE1-CB 3.77Å; E182-A207 WeakPolarHBondContact OE1-CA 3.28Å; Y192-A207 HydrophobicContact CE1-CB 4.22Å; Y192-A207 VanDerWaalsContact OH-CB 3.3Å; Y192-A207 WeakPolarHBondContact OH-CB 3.47Å; A207-Q209 PolarHBondContact O-N 3.39Å; A207-Y220 WeakPolarHBondContact CB-OH 3.33Å |
| 208 | L | 92.8 | Very high | 92.7 | Very high | 0 Ų | 0 | 58.1 Ų | 58.1 | 0% | 0 | 31% | 0.305 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 69.5 | 6.5 | 177.2 | -46 | 172 | 0 | 0 | 0 | 114.5 | E182 L214 Y220 V221 F225 | E182-L208 PolarHBondContact OE1-N 2.98Å; L208-L214 HydrophobicContact CB-CD1 4.16Å; L208-L214 HydrophobicContact CB-CG 4.05Å; L208-L214 WeakPolarHBondContact O-CD1 3.35Å; L208-Y220 HydrophobicContact CD2-CD1 3.53Å; L208-Y220 HydrophobicContact CD2-CD2 4.43Å; L208-Y220 HydrophobicContact CD2-CE1 3.48Å; L208-Y220 VanDerWaalsContact CD2-CE1 3.48Å; L208-Y220 HydrophobicContact CD2-CE2 4.35Å; L208-Y220 HydrophobicContact CD2-CG 4.01Å; L208-Y220 HydrophobicContact CG-CE1 4.49Å; L208-V221 HydrophobicContact CD1-CG1 4.45Å; L208-V221 HydrophobicContact CD1-CG2 4.32Å; L208-V221 HydrophobicContact CD2-CB 4.41Å; L208-V221 HydrophobicContact CD2-CG2 3.89Å; L208-F225 HydrophobicContact CD1-CE1 3.89Å |
| 209 | Q | 91.2 | Very high | 92.6 | Very high | 33 Ų | 33 | 64.1 Ų | 64.1 | 15% | 0.154 | 33% | 0.329 | C | S | . | . | trans | -92 | -14.7 | -177.5 | -62.5 | -57.8 | -63.1 | 0 | 0 | 114.1 | A74 H98 V206 A207 | A74-Q209 WeakPolarHBondContact CA-O 3.42Å; A74-Q209 HydrophobicContact CB-CB 4Å; A74-Q209 VanDerWaalsContact CB-O 3.22Å; A74-Q209 WeakPolarHBondContact CB-O 3.4Å; H98-Q209 PolarHBondContact CD2-NE2 2.8Å; V206-Q209 HydrophobicContact CB-CG 3.82Å; V206-Q209 HydrophobicContact CG1-CG 3.71Å; A207-Q209 PolarHBondContact O-N 3.39Å | ||
| 210 | K | 88.9 | Confident | 92.5 | Very high | 87 Ų | 87 | 62 Ų | 62 | 38% | 0.378 | 32% | 0.315 | S | S | . | . | S | Bend | trans | -89.9 | 151 | 177 | -67.2 | -176.4 | -179.6 | 179.6 | 0 | 111.6 | E182 Q212 A213 | E182-K210 PolarHBondContact O-NZ 2.82Å; K210-Q212 PolarHBondContact O-N 3.28Å; K210-A213 VanDerWaalsContact O-CB 3.31Å; K210-A213 WeakPolarHBondContact O-CB 3.41Å; K210-A213 PolarHBondContact O-N 2.79Å |
| 211 | D | 87.4 | Confident | 92.3 | Very high | 128 Ų | 128 | 58.5 Ų | 58.5 | 68% | 0.684 | 30% | 0.298 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 49.7 | 29.7 | 171.3 | -53.4 | -44 | 0 | 0 | 0 | 115.8 | A213 T216 | D211-A213 PolarHBondContact O-N 3.48Å; D211-T216 PolarHBondContact O-OG1 2.83Å |
| 212 | Q | 86.4 | Confident | 92.2 | Very high | 115 Ų | 115 | 60.9 Ų | 60.9 | 54% | 0.537 | 32% | 0.318 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 54.1 | 32.8 | -176.4 | -54.9 | 177 | -21.1 | 0 | 0 | 112.9 | K210 L214 Q215 T216 | K210-Q212 PolarHBondContact O-N 3.28Å; Q212-L214 PolarHBondContact O-N 2.97Å; Q212-Q215 PolarHBondContact O-N 3.1Å; Q212-T216 HydrophobicContact CB-CG2 4.35Å; Q212-T216 PolarHBondContact O-N 2.93Å; Q212-T216 VanDerWaalsContact O-N 3.14Å; Q212-T216 PolarHBondContact O-OG1 3.47Å; Q212-T216 VanDerWaalsContact O-OG1 3.12Å |
| 213 | A | 87.5 | Confident | 92.3 | Very high | 2 Ų | 2 | 58 Ų | 58 | 2% | 0.017 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -51.5 | -33.3 | -174.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | K210 D211 Q215 T216 Q217 Y220 | K210-A213 VanDerWaalsContact O-CB 3.31Å; K210-A213 WeakPolarHBondContact O-CB 3.41Å; K210-A213 PolarHBondContact O-N 2.79Å; D211-A213 PolarHBondContact O-N 3.48Å; A213-Q215 PolarHBondContact O-N 2.96Å; A213-Q215 VanDerWaalsContact O-N 3.13Å; A213-T216 WeakPolarHBondContact CA-OG1 3.5Å; A213-T216 PolarHBondContact O-N 3.32Å; A213-Q217 HydrophobicContact CB-CB 4.41Å; A213-Q217 PolarHBondContact O-N 2.84Å; A213-Y220 HydrophobicContact CB-CD1 4.21Å; A213-Y220 HydrophobicContact CB-CE1 4.45Å |
| 214 | L | 87.4 | Confident | 92.3 | Very high | 9 Ų | 9 | 56.7 Ų | 56.7 | 5% | 0.047 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -52 | -30.7 | 172.7 | -85.6 | 130.5 | 0 | 0 | 0 | 114.8 | A81 L208 Q212 | A81-L214 HydrophobicContact CB-CD2 4.36Å; L208-L214 HydrophobicContact CB-CD1 4.16Å; L208-L214 HydrophobicContact CB-CG 4.05Å; L208-L214 WeakPolarHBondContact O-CD1 3.35Å; Q212-L214 PolarHBondContact O-N 2.97Å |
| 215 | Q | 86.3 | Confident | 92.3 | Very high | 92 Ų | 92 | 53.6 Ų | 53.6 | 43% | 0.43 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -106.7 | -34.4 | -178.9 | -54.2 | -54.8 | -48.8 | 0 | 0 | 112.2 | V76 Q212 A213 | V76-Q215 PolarHBondContact O-NE2 3.18Å; Q212-Q215 PolarHBondContact O-N 3.1Å; A213-Q215 PolarHBondContact O-N 2.96Å; A213-Q215 VanDerWaalsContact O-N 3.13Å |
| 216 | T | 89.3 | Confident | 92.3 | Very high | 80 Ų | 80 | 54.9 Ų | 54.9 | 49% | 0.491 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -93.3 | -25.3 | -170.1 | 56.5 | 0 | 0 | 0 | 0 | 113.4 | D211 Q212 A213 P218 | D211-T216 PolarHBondContact O-OG1 2.83Å; Q212-T216 HydrophobicContact CB-CG2 4.35Å; Q212-T216 PolarHBondContact O-N 2.93Å; Q212-T216 VanDerWaalsContact O-N 3.14Å; Q212-T216 PolarHBondContact O-OG1 3.47Å; Q212-T216 VanDerWaalsContact O-OG1 3.12Å; A213-T216 WeakPolarHBondContact CA-OG1 3.5Å; A213-T216 PolarHBondContact O-N 3.32Å; T216-P218 WeakPolarHBondContact O-CD 3.5Å |
| 217 | Q | 92.8 | Very high | 92.4 | Very high | 80 Ų | 80 | 54.9 Ų | 54.9 | 37% | 0.374 | 29% | 0.287 | S | S | . | . | trans | -126.1 | 70.7 | -170.5 | -62.7 | -178.7 | 1.3 | 0 | 0 | 112.6 | A213 Q219 Y220 V221 | A213-Q217 HydrophobicContact CB-CB 4.41Å; A213-Q217 PolarHBondContact O-N 2.84Å; Q217-Q219 VanDerWaalsContact C-N 3.26Å; Q217-Q219 PolarHBondContact O-N 3.48Å; Q217-Y220 PolarHBondContact O-N 3.12Å; Q217-Y220 VanDerWaalsContact O-N 3.17Å; Q217-V221 WeakPolarHBondContact O-CG2 3.3Å; Q217-V221 PolarHBondContact O-N 2.99Å; Q217-V221 VanDerWaalsContact O-N 3.11Å | ||
| 218 | P | 92.4 | Very high | 92.5 | Very high | 93 Ų | 93 | 54.9 Ų | 54.9 | 60% | 0.604 | 29% | 0.287 | S | S | * | . | H | α-helix | trans | -62.3 | -29.9 | -175.5 | 24.7 | -34.6 | 0 | 0 | 0 | 113.8 | T216 V221 A222 | T216-P218 WeakPolarHBondContact O-CD 3.5Å; P218-V221 PolarHBondContact O-N 2.77Å; P218-A222 WeakPolarHBondContact O-CB 3.45Å; P218-A222 PolarHBondContact O-N 3.4Å |
| 219 | Q | 93.9 | Very high | 92.7 | Very high | 174 Ų | 174 | 57.9 Ų | 57.9 | 81% | 0.813 | 30% | 0.303 | S | S | * | . | H | α-helix | trans | -65.1 | -43.8 | 177.1 | -65.7 | 174.6 | -20.1 | 0 | 0 | 111.7 | Q217 A222 F223 | Q217-Q219 VanDerWaalsContact C-N 3.26Å; Q217-Q219 PolarHBondContact O-N 3.48Å; Q219-A222 PolarHBondContact O-N 3.44Å; Q219-F223 WeakPolarHBondContact O-CB 3.18Å; Q219-F223 PolarHBondContact O-N 3.18Å |
| 220 | Y | 94.9 | Very high | 92.9 | Very high | 6 Ų | 6 | 59.8 Ų | 59.8 | 2% | 0.024 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -70 | -37.6 | 178.3 | 175.1 | -139.2 | 0 | 0 | 0 | 111.8 | F178 Y181 E182 A207 L208 A213 Q217 F223 S224 | F178-Y220 HydrophobicContact CD1-CE2 4.08Å; F178-Y220 WeakPolarHBondContact CD1-OH 3.32Å; F178-Y220 AromaticContact CE1-CE2 3.93Å; F178-Y220 HydrophobicContact CE1-CE2 3.93Å; Y181-Y220 HydrophobicContact CD1-CD2 4.06Å; Y181-Y220 HydrophobicContact CD1-CE2 4.47Å; Y181-Y220 HydrophobicContact CD1-CG 4.16Å; Y181-Y220 AromaticContact CD2-CD2 3.8Å; Y181-Y220 HydrophobicContact CD2-CD2 3.8Å; Y181-Y220 AromaticContact CD2-CE2 3.82Å; Y181-Y220 HydrophobicContact CD2-CE2 3.82Å; Y181-Y220 HydrophobicContact CE1-CD2 4.45Å; Y181-Y220 HydrophobicContact CE2-CD2 4.22Å; Y181-Y220 AromaticContact CG-CD2 3.73Å; Y181-Y220 HydrophobicContact CG-CD2 3.73Å; Y181-Y220 AromaticContact CG-CE2 3.75Å; Y181-Y220 HydrophobicContact CG-CE2 3.75Å; Y181-Y220 HydrophobicContact CG-CG 4.23Å; E182-Y220 VanDerWaalsContact CG-OH 3.27Å; E182-Y220 WeakPolarHBondContact CG-OH 3.33Å; E182-Y220 WeakPolarHBondContact OE1-CE1 3.34Å; E182-Y220 PolarHBondContact OE1-OH 2.86Å; A207-Y220 WeakPolarHBondContact CB-OH 3.33Å; L208-Y220 HydrophobicContact CD2-CD1 3.53Å; L208-Y220 HydrophobicContact CD2-CD2 4.43Å; L208-Y220 HydrophobicContact CD2-CE1 3.48Å; L208-Y220 VanDerWaalsContact CD2-CE1 3.48Å; L208-Y220 HydrophobicContact CD2-CE2 4.35Å; L208-Y220 HydrophobicContact CD2-CG 4.01Å; L208-Y220 HydrophobicContact CG-CE1 4.49Å; A213-Y220 HydrophobicContact CB-CD1 4.21Å; A213-Y220 HydrophobicContact CB-CE1 4.45Å; Q217-Y220 PolarHBondContact O-N 3.12Å; Q217-Y220 VanDerWaalsContact O-N 3.17Å; Y220-F223 HydrophobicContact CD2-CD1 4.1Å; Y220-F223 HydrophobicContact CE2-CD1 4.26Å; Y220-F223 PolarHBondContact O-N 2.84Å; Y220-S224 WeakPolarHBondContact CE2-OG 3.39Å; Y220-S224 WeakPolarHBondContact O-CB 3.49Å; Y220-S224 PolarHBondContact O-N 3.13Å; Y220-S224 PolarHBondContact O-OG 2.69Å |
| 221 | V | 94.8 | Very high | 93.3 | Very high | 10 Ų | 10 | 55.7 Ų | 55.7 | 6% | 0.061 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -58.1 | -50.4 | 171.7 | 173.9 | 0 | 0 | 0 | 0 | 110.8 | A81 L208 Q217 P218 F223 S224 F225 | A81-V221 HydrophobicContact CB-CG1 4.43Å; L208-V221 HydrophobicContact CD1-CG1 4.45Å; L208-V221 HydrophobicContact CD1-CG2 4.32Å; L208-V221 HydrophobicContact CD2-CB 4.41Å; L208-V221 HydrophobicContact CD2-CG2 3.89Å; Q217-V221 WeakPolarHBondContact O-CG2 3.3Å; Q217-V221 PolarHBondContact O-N 2.99Å; Q217-V221 VanDerWaalsContact O-N 3.11Å; P218-V221 PolarHBondContact O-N 2.77Å; V221-F223 PolarHBondContact O-N 2.92Å; V221-S224 PolarHBondContact O-N 3.22Å; V221-F225 HydrophobicContact CG1-CD2 4.08Å; V221-F225 HydrophobicContact CG1-CE1 4.05Å; V221-F225 HydrophobicContact CG1-CE2 3.37Å; V221-F225 HydrophobicContact CG1-CZ 3.37Å; V221-F225 WeakPolarHBondContact O-CG 3.14Å; V221-F225 PolarHBondContact O-N 3.47Å |
| 222 | A | 95.3 | Very high | 93.7 | Very high | 53 Ų | 53 | 50.1 Ų | 50.1 | 44% | 0.438 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -61.6 | -45.3 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112 | P218 Q219 S224 F225 V226 | P218-A222 WeakPolarHBondContact O-CB 3.45Å; P218-A222 PolarHBondContact O-N 3.4Å; Q219-A222 PolarHBondContact O-N 3.44Å; A222-S224 VanDerWaalsContact C-N 3.32Å; A222-S224 PolarHBondContact O-N 2.93Å; A222-F225 PolarHBondContact O-N 3.21Å; A222-V226 WeakPolarHBondContact O-CG2 3.12Å; A222-V226 PolarHBondContact O-N 3.34Å |
| 223 | F | 96.6 | Very high | 94.2 | Very high | 67 Ų | 67 | 45.2 Ų | 45.2 | 29% | 0.294 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -54.8 | -47.8 | 173.9 | 166.5 | -97.3 | 0 | 0 | 0 | 111.6 | A177 F178 Q219 Y220 V221 F225 V226 Y227 | A177-F223 HydrophobicContact CB-CE1 3.65Å; A177-F223 HydrophobicContact CB-CE2 4.34Å; A177-F223 HydrophobicContact CB-CZ 3.35Å; F178-F223 HydrophobicContact CE1-CE1 4.23Å; F178-F223 HydrophobicContact CE2-CE1 4.45Å; F178-F223 HydrophobicContact CZ-CE1 4.04Å; Q219-F223 WeakPolarHBondContact O-CB 3.18Å; Q219-F223 PolarHBondContact O-N 3.18Å; Y220-F223 HydrophobicContact CD2-CD1 4.1Å; Y220-F223 HydrophobicContact CE2-CD1 4.26Å; Y220-F223 PolarHBondContact O-N 2.84Å; V221-F223 PolarHBondContact O-N 2.92Å; F223-F225 PolarHBondContact O-N 2.88Å; F223-V226 PolarHBondContact O-N 2.83Å; F223-Y227 VanDerWaalsContact O-CB 3.3Å; F223-Y227 WeakPolarHBondContact O-CB 3.47Å; F223-Y227 PolarHBondContact O-N 3.14Å |
| 224 | S | 96.5 | Very high | 94.6 | Very high | 0 Ų | 0 | 46.4 Ų | 46.4 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -62.5 | -42.4 | -178 | -61.8 | 0 | 0 | 0 | 0 | 112.1 | Y220 V221 A222 Y227 I228 | Y220-S224 WeakPolarHBondContact CE2-OG 3.39Å; Y220-S224 WeakPolarHBondContact O-CB 3.49Å; Y220-S224 PolarHBondContact O-N 3.13Å; Y220-S224 PolarHBondContact O-OG 2.69Å; V221-S224 PolarHBondContact O-N 3.22Å; A222-S224 VanDerWaalsContact C-N 3.32Å; A222-S224 PolarHBondContact O-N 2.93Å; S224-Y227 PolarHBondContact O-N 2.79Å; S224-I228 VanDerWaalsContact O-CG1 3.29Å; S224-I228 WeakPolarHBondContact O-CG1 3.5Å; S224-I228 PolarHBondContact O-N 3.42Å |
| 225 | F | 96.3 | Very high | 95 | Very high | 22 Ų | 22 | 47.3 Ų | 47.3 | 10% | 0.096 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -66.4 | -45 | 177.3 | -61.9 | -14.1 | 0 | 0 | 0 | 111.9 | F84 Y85 I88 L208 V221 A222 F223 Y227 I228 L229 | F84-F225 AromaticContact CD1-CD2 3.56Å; F84-F225 HydrophobicContact CD1-CD2 3.56Å; F84-F225 AromaticContact CD1-CE2 3.4Å; F84-F225 HydrophobicContact CD1-CE2 3.4Å; F84-F225 VanDerWaalsContact CD1-CE2 3.4Å; F84-F225 HydrophobicContact CD1-CG 4.32Å; F84-F225 HydrophobicContact CD1-CZ 4.05Å; F84-F225 AromaticContact CE1-CD2 3.65Å; F84-F225 HydrophobicContact CE1-CD2 3.65Å; F84-F225 HydrophobicContact CE1-CE2 4Å; F84-F225 HydrophobicContact CE1-CG 4.26Å; F84-F225 HydrophobicContact CG-CE2 4.4Å; Y85-F225 HydrophobicContact CD2-CD1 4.03Å; Y85-F225 AromaticContact CD2-CE1 3.47Å; Y85-F225 HydrophobicContact CD2-CE1 3.47Å; Y85-F225 VanDerWaalsContact CD2-CE1 3.47Å; Y85-F225 HydrophobicContact CD2-CZ 4.47Å; Y85-F225 HydrophobicContact CE2-CE1 4.37Å; Y85-F225 AromaticContact CG-CE1 3.81Å; Y85-F225 HydrophobicContact CG-CE1 3.81Å; Y85-F225 HydrophobicContact CG-CZ 4.45Å; I88-F225 HydrophobicContact CD1-CB 4.01Å; I88-F225 HydrophobicContact CD1-CD1 3.79Å; I88-F225 HydrophobicContact CD1-CD2 4.33Å; I88-F225 HydrophobicContact CD1-CE1 4.36Å; I88-F225 HydrophobicContact CD1-CG 3.78Å; L208-F225 HydrophobicContact CD1-CE1 3.89Å; V221-F225 HydrophobicContact CG1-CD2 4.08Å; V221-F225 HydrophobicContact CG1-CE1 4.05Å; V221-F225 HydrophobicContact CG1-CE2 3.37Å; V221-F225 HydrophobicContact CG1-CZ 3.37Å; V221-F225 WeakPolarHBondContact O-CG 3.14Å; V221-F225 PolarHBondContact O-N 3.47Å; A222-F225 PolarHBondContact O-N 3.21Å; F223-F225 PolarHBondContact O-N 2.88Å; F225-Y227 VanDerWaalsContact C-N 3.33Å; F225-Y227 PolarHBondContact O-N 2.99Å; F225-I228 PolarHBondContact O-N 2.97Å; F225-L229 WeakPolarHBondContact O-CG 3.49Å; F225-L229 PolarHBondContact O-N 3.19Å |
| 226 | V | 96.9 | Very high | 95.3 | Very high | 88 Ų | 88 | 43.3 Ų | 43.3 | 53% | 0.533 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -62.3 | -43.1 | 176.8 | 172.1 | 0 | 0 | 0 | 0 | 110.5 | A222 F223 L229 T230 | A222-V226 WeakPolarHBondContact O-CG2 3.12Å; A222-V226 PolarHBondContact O-N 3.34Å; F223-V226 PolarHBondContact O-N 2.83Å; V226-L229 PolarHBondContact O-N 3.1Å; V226-T230 HydrophobicContact CG1-CG2 4.06Å; V226-T230 WeakPolarHBondContact O-CB 3.41Å; V226-T230 VanDerWaalsContact O-CG2 3.29Å; V226-T230 WeakPolarHBondContact O-CG2 3.49Å; V226-T230 PolarHBondContact O-N 3.21Å; V226-T230 PolarHBondContact O-OG1 3.14Å |
| 227 | Y | 97.9 | Very high | 95.5 | Very high | 13 Ų | 13 | 39.7 Ų | 39.7 | 5% | 0.051 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -59.3 | -49.1 | 177.2 | 177.1 | -93.5 | 0 | 0 | 0 | 111.7 | T170 G174 F178 C193 L197 F223 S224 F225 L229 T230 G231 | T170-Y227 HydrophobicContact CG2-CE2 4.17Å; T170-Y227 WeakPolarHBondContact O-CE2 3.29Å; T170-Y227 PolarHBondContact O-OH 3.48Å; G174-Y227 WeakPolarHBondContact CA-OH 3.37Å; F178-Y227 AromaticContact CE2-CD1 3.53Å; F178-Y227 HydrophobicContact CE2-CD1 3.53Å; F178-Y227 AromaticContact CE2-CE1 3.69Å; F178-Y227 HydrophobicContact CE2-CE1 3.69Å; F178-Y227 HydrophobicContact CE2-CG 4.05Å; F178-Y227 AromaticContact CZ-CD1 3.91Å; F178-Y227 HydrophobicContact CZ-CD1 3.91Å; F178-Y227 HydrophobicContact CZ-CE1 4.49Å; F178-Y227 HydrophobicContact CZ-CG 4.32Å; C193-Y227 WeakPolarHBondContact CB-OH 3.43Å; C193-Y227 PolarHBondContact SG-OH 3.49Å; L197-Y227 HydrophobicContact CD1-CE1 4.35Å; L197-Y227 HydrophobicContact CD2-CE1 4.34Å; L197-Y227 HydrophobicContact CG-CE1 4.48Å; F223-Y227 VanDerWaalsContact O-CB 3.3Å; F223-Y227 WeakPolarHBondContact O-CB 3.47Å; F223-Y227 PolarHBondContact O-N 3.14Å; S224-Y227 PolarHBondContact O-N 2.79Å; F225-Y227 VanDerWaalsContact C-N 3.33Å; F225-Y227 PolarHBondContact O-N 2.99Å; Y227-L229 PolarHBondContact O-N 3.39Å; Y227-T230 PolarHBondContact O-OG1 3.09Å; Y227-G231 WeakPolarHBondContact O-CA 3.22Å; Y227-G231 PolarHBondContact O-N 3.29Å |
| 228 | I | 97.3 | Very high | 95.6 | Very high | 0 Ų | 0 | 38.3 Ų | 38.3 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -60.8 | -48.5 | 179.9 | -69.3 | 166.9 | 0 | 0 | 0 | 110.5 | Y85 I88 I94 T196 S224 F225 L232 | Y85-I228 HydrophobicContact CE2-CD1 3.89Å; I88-I228 HydrophobicContact CG2-CG2 4.04Å; I94-I228 HydrophobicContact CD1-CG2 3.78Å; T196-I228 HydrophobicContact CG2-CG1 4.04Å; S224-I228 VanDerWaalsContact O-CG1 3.29Å; S224-I228 WeakPolarHBondContact O-CG1 3.5Å; S224-I228 PolarHBondContact O-N 3.42Å; F225-I228 PolarHBondContact O-N 2.97Å; I228-L232 HydrophobicContact CG2-CD1 3.88Å; I228-L232 HydrophobicContact CG2-CG 4.46Å; I228-L232 WeakPolarHBondContact O-CB 3.41Å; I228-L232 VanDerWaalsContact O-CG 3.25Å; I228-L232 WeakPolarHBondContact O-CG 3.45Å; I228-L232 PolarHBondContact O-N 2.9Å |
| 229 | L | 95.9 | Very high | 95.5 | Very high | 63 Ų | 63 | 37.7 Ų | 37.7 | 33% | 0.33 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -65.9 | -44.8 | -178 | -67.3 | 173.5 | 0 | 0 | 0 | 112.3 | F125 F225 V226 Y227 T233 | F125-L229 WeakPolarHBondContact CE1-O 3.36Å; F125-L229 HydrophobicContact CZ-CD2 4.33Å; F225-L229 WeakPolarHBondContact O-CG 3.49Å; F225-L229 PolarHBondContact O-N 3.19Å; V226-L229 PolarHBondContact O-N 3.1Å; Y227-L229 PolarHBondContact O-N 3.39Å; L229-T233 PolarHBondContact O-N 3.02Å; L229-T233 VanDerWaalsContact O-N 3.13Å; L229-T233 PolarHBondContact O-OG1 3.07Å |
| 230 | T | 96.3 | Very high | 95.2 | Very high | 74 Ų | 74 | 30.6 Ų | 30.6 | 45% | 0.454 | 17% | 0.173 | S | C | . | . | H | α-helix | trans | -68.9 | -42.2 | 178.4 | 54.6 | 0 | 0 | 0 | 0 | 111.6 | V226 Y227 T233 V234 | V226-T230 HydrophobicContact CG1-CG2 4.06Å; V226-T230 WeakPolarHBondContact O-CB 3.41Å; V226-T230 VanDerWaalsContact O-CG2 3.29Å; V226-T230 WeakPolarHBondContact O-CG2 3.49Å; V226-T230 PolarHBondContact O-N 3.21Å; V226-T230 PolarHBondContact O-OG1 3.14Å; Y227-T230 PolarHBondContact O-OG1 3.09Å; T230-T233 WeakPolarHBondContact O-CB 3.28Å; T230-T233 PolarHBondContact O-N 3.33Å; T230-T233 VanDerWaalsContact O-N 3.13Å; T230-V234 WeakPolarHBondContact O-CG2 3.49Å; T230-V234 PolarHBondContact O-N 2.91Å |
| 231 | G | 97.1 | Very high | 94.8 | Very high | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -63.3 | -44.4 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | Y227 T233 V234 I235 | Y227-G231 WeakPolarHBondContact O-CA 3.22Å; Y227-G231 PolarHBondContact O-N 3.29Å; G231-T233 PolarHBondContact O-N 3.49Å; G231-V234 PolarHBondContact O-N 3.37Å; G231-V234 VanDerWaalsContact O-N 3.1Å; G231-I235 WeakPolarHBondContact O-CG1 3.42Å; G231-I235 PolarHBondContact O-N 3.08Å |
| 232 | L | 96.3 | Very high | 94.5 | Very high | 11 Ų | 11 | 32.8 Ų | 32.8 | 6% | 0.058 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -61.5 | -33.8 | 173.5 | -76 | 172.2 | 0 | 0 | 0 | 111.8 | T92 I94 F125 L197 T199 I228 G236 | T92-L232 HydrophobicContact CG2-CD1 3.52Å; I94-L232 HydrophobicContact CD1-CD1 4.26Å; F125-L232 HydrophobicContact CD1-CB 4.48Å; F125-L232 HydrophobicContact CE1-CB 3.86Å; F125-L232 HydrophobicContact CE2-CB 3.94Å; F125-L232 HydrophobicContact CE2-CD1 3.93Å; F125-L232 HydrophobicContact CZ-CB 3.55Å; F125-L232 HydrophobicContact CZ-CD1 3.78Å; F125-L232 HydrophobicContact CZ-CG 4.34Å; L197-L232 HydrophobicContact CD2-CG 4.28Å; L197-L232 WeakPolarHBondContact O-CD2 3.28Å; T199-L232 HydrophobicContact CG2-CD2 3.56Å; I228-L232 HydrophobicContact CG2-CD1 3.88Å; I228-L232 HydrophobicContact CG2-CG 4.46Å; I228-L232 WeakPolarHBondContact O-CB 3.41Å; I228-L232 VanDerWaalsContact O-CG 3.25Å; I228-L232 WeakPolarHBondContact O-CG 3.45Å; I228-L232 PolarHBondContact O-N 2.9Å; L232-G236 WeakPolarHBondContact O-CA 3.48Å; L232-G236 PolarHBondContact O-N 3.41Å |
| 233 | T | 95.8 | Very high | 94 | Very high | 13 Ų | 13 | 33 Ų | 33 | 8% | 0.08 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -67.8 | -39.5 | 174.7 | -49.8 | 0 | 0 | 0 | 0 | 111.5 | F125 L128 I132 L229 T230 G231 G236 A237 | F125-T233 WeakPolarHBondContact CD1-OG1 3.41Å; F125-T233 WeakPolarHBondContact CE1-OG1 3.23Å; L128-T233 HydrophobicContact CB-CG2 3.64Å; L128-T233 HydrophobicContact CD1-CG2 4.44Å; I132-T233 HydrophobicContact CD1-CG2 3.5Å; L229-T233 PolarHBondContact O-N 3.02Å; L229-T233 VanDerWaalsContact O-N 3.13Å; L229-T233 PolarHBondContact O-OG1 3.07Å; T230-T233 WeakPolarHBondContact O-CB 3.28Å; T230-T233 PolarHBondContact O-N 3.33Å; T230-T233 VanDerWaalsContact O-N 3.13Å; G231-T233 PolarHBondContact O-N 3.49Å; T233-G236 PolarHBondContact O-N 2.96Å; T233-A237 VanDerWaalsContact O-CB 3.31Å; T233-A237 WeakPolarHBondContact O-CB 3.44Å; T233-A237 PolarHBondContact O-N 3.2Å |
| 234 | V | 96.3 | Very high | 93.1 | Very high | 27 Ų | 27 | 33.5 Ų | 33.5 | 16% | 0.164 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -64.6 | -49.3 | 175.9 | 172.2 | 0 | 0 | 0 | 0 | 111.1 | S166 T230 G231 G236 A237 F238 | S166-V234 WeakPolarHBondContact OG-CG1 3.42Å; T230-V234 WeakPolarHBondContact O-CG2 3.49Å; T230-V234 PolarHBondContact O-N 2.91Å; G231-V234 PolarHBondContact O-N 3.37Å; G231-V234 VanDerWaalsContact O-N 3.1Å; V234-G236 VanDerWaalsContact C-N 3.33Å; V234-G236 PolarHBondContact O-N 3.45Å; V234-A237 WeakPolarHBondContact O-CB 3.37Å; V234-A237 PolarHBondContact O-N 3.04Å; V234-F238 PolarHBondContact O-N 3.44Å; V234-F238 VanDerWaalsContact O-N 3.08Å |
| 235 | I | 95.3 | Very high | 91.9 | Very high | 27 Ų | 27 | 39.9 Ų | 39.9 | 14% | 0.138 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -62.3 | -44 | 176.3 | -60.1 | -50.5 | 0 | 0 | 0 | 110.3 | C167 L197 G231 A237 F238 L239 | C167-I235 HydrophobicContact CB-CD1 3.87Å; L197-I235 HydrophobicContact CB-CG1 3.87Å; L197-I235 HydrophobicContact CD1-CG1 4.42Å; G231-I235 WeakPolarHBondContact O-CG1 3.42Å; G231-I235 PolarHBondContact O-N 3.08Å; I235-A237 VanDerWaalsContact C-N 3.33Å; I235-A237 PolarHBondContact O-N 3.01Å; I235-F238 PolarHBondContact O-N 3.43Å; I235-F238 VanDerWaalsContact O-N 3.16Å; I235-L239 HydrophobicContact CG2-CD1 4Å; I235-L239 HydrophobicContact CG2-CG 4.24Å; I235-L239 WeakPolarHBondContact O-CG 3.47Å; I235-L239 PolarHBondContact O-N 3.29Å |
| 236 | G | 93.4 | Very high | 90.9 | Very high | 9 Ų | 9 | 45.2 Ų | 45.2 | 9% | 0.093 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -59.1 | -40.5 | 175.8 | 0 | 0 | 0 | 0 | 0 | 113.1 | L232 T233 V234 L239 N240 | L232-G236 WeakPolarHBondContact O-CA 3.48Å; L232-G236 PolarHBondContact O-N 3.41Å; T233-G236 PolarHBondContact O-N 2.96Å; V234-G236 VanDerWaalsContact C-N 3.33Å; V234-G236 PolarHBondContact O-N 3.45Å; G236-L239 PolarHBondContact O-N 2.89Å; G236-N240 VanDerWaalsContact O-CB 3.28Å; G236-N240 WeakPolarHBondContact O-CB 3.23Å; G236-N240 PolarHBondContact O-N 2.88Å |
| 237 | A | 93.4 | Very high | 89.9 | Confident | 4 Ų | 4 | 47.4 Ų | 47.4 | 3% | 0.033 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -63.5 | -40.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112 | N133 T233 V234 I235 L241 | N133-A237 PolarHBondContact ND2-O 3.06Å; T233-A237 VanDerWaalsContact O-CB 3.31Å; T233-A237 WeakPolarHBondContact O-CB 3.44Å; T233-A237 PolarHBondContact O-N 3.2Å; V234-A237 WeakPolarHBondContact O-CB 3.37Å; V234-A237 PolarHBondContact O-N 3.04Å; I235-A237 VanDerWaalsContact C-N 3.33Å; I235-A237 PolarHBondContact O-N 3.01Å; A237-L241 PolarHBondContact O-N 2.84Å; A237-L241 VanDerWaalsContact O-N 3.07Å |
| 238 | F | 94 | Very high | 89 | Confident | 50 Ų | 50 | 49.7 Ų | 49.7 | 22% | 0.219 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -67.5 | -44.7 | 176.4 | -175.9 | -108.3 | 0 | 0 | 0 | 112 | V160 F164 V234 I235 N240 L241 V242 | V160-F238 HydrophobicContact CG1-CE2 4.29Å; F164-F238 HydrophobicContact CB-CE2 4.27Å; V234-F238 PolarHBondContact O-N 3.44Å; V234-F238 VanDerWaalsContact O-N 3.08Å; I235-F238 PolarHBondContact O-N 3.43Å; I235-F238 VanDerWaalsContact O-N 3.16Å; F238-N240 VanDerWaalsContact C-N 3.34Å; F238-N240 PolarHBondContact O-N 3.46Å; F238-L241 WeakPolarHBondContact O-CB 3.18Å; F238-L241 PolarHBondContact O-N 2.92Å; F238-V242 HydrophobicContact CD2-CG2 4.35Å; F238-V242 HydrophobicContact CE1-CG2 4.39Å; F238-V242 HydrophobicContact CE2-CG2 3.97Å; F238-V242 HydrophobicContact CZ-CG2 3.99Å; F238-V242 PolarHBondContact O-N 3.38Å |
| 239 | L | 91.1 | Very high | 87.9 | Confident | 81 Ų | 81 | 52.8 Ų | 52.8 | 42% | 0.424 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -62.4 | -40 | 174.8 | -68.1 | 176.2 | 0 | 0 | 0 | 111.8 | I235 G236 L241 V242 V243 L244 | I235-L239 HydrophobicContact CG2-CD1 4Å; I235-L239 HydrophobicContact CG2-CG 4.24Å; I235-L239 WeakPolarHBondContact O-CG 3.47Å; I235-L239 PolarHBondContact O-N 3.29Å; G236-L239 PolarHBondContact O-N 2.89Å; L239-L241 VanDerWaalsContact C-N 3.33Å; L239-L241 PolarHBondContact O-N 3.33Å; L239-V242 PolarHBondContact O-N 3.31Å; L239-V243 HydrophobicContact CD2-CG2 3.8Å; L239-V243 WeakPolarHBondContact O-CA 3.3Å; L239-V243 VanDerWaalsContact O-CB 3.29Å; L239-V243 WeakPolarHBondContact O-CB 3.42Å; L239-V243 PolarHBondContact O-N 2.9Å; L239-L244 PolarHBondContact O-N 3.32Å |
| 240 | N | 88.1 | Confident | 86.8 | Confident | 25 Ų | 25 | 52.6 Ų | 52.6 | 13% | 0.134 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -60.2 | -44.3 | 174.4 | -172.5 | -8.3 | 0 | 0 | 0 | 111 | Q126 G236 F238 L244 | Q126-N240 PolarHBondContact O-ND2 2.95Å; Q126-N240 VanDerWaalsContact OE1-CB 3.3Å; Q126-N240 PolarHBondContact OE1-ND2 3.4Å; G236-N240 VanDerWaalsContact O-CB 3.28Å; G236-N240 WeakPolarHBondContact O-CB 3.23Å; G236-N240 PolarHBondContact O-N 2.88Å; F238-N240 VanDerWaalsContact C-N 3.34Å; F238-N240 PolarHBondContact O-N 3.46Å; N240-L244 VanDerWaalsContact O-CB 3.29Å; N240-L244 WeakPolarHBondContact O-CB 3.36Å; N240-L244 WeakPolarHBondContact OD1-CD2 3.49Å |
| 241 | L | 87.1 | Confident | 86 | Confident | 15 Ų | 15 | 52.1 Ų | 52.1 | 8% | 0.079 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -63.9 | -44 | 179.4 | -176.6 | 70.7 | 0 | 0 | 0 | 113.1 | M156 M159 V160 A237 F238 L239 | M156-L241 HydrophobicContact CE-CD1 3.7Å; M156-L241 HydrophobicContact CE-CG 4.41Å; M159-L241 HydrophobicContact CB-CD1 4.22Å; M159-L241 HydrophobicContact CB-CD2 3.78Å; V160-L241 HydrophobicContact CB-CD2 4.49Å; V160-L241 HydrophobicContact CG2-CD2 3.84Å; V160-L241 HydrophobicContact CG2-CG 4.39Å; A237-L241 PolarHBondContact O-N 2.84Å; A237-L241 VanDerWaalsContact O-N 3.07Å; F238-L241 WeakPolarHBondContact O-CB 3.18Å; F238-L241 PolarHBondContact O-N 2.92Å; L239-L241 VanDerWaalsContact C-N 3.33Å; L239-L241 PolarHBondContact O-N 3.33Å |
| 242 | V | 88.2 | Confident | 85.1 | Confident | 47 Ų | 47 | 57.1 Ų | 57.1 | 29% | 0.285 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -96.4 | -49.9 | -170 | 179.5 | 0 | 0 | 0 | 0 | 112.4 | V160 F238 L239 F246 | V160-V242 HydrophobicContact CG2-CG2 4.22Å; F238-V242 HydrophobicContact CD2-CG2 4.35Å; F238-V242 HydrophobicContact CE1-CG2 4.39Å; F238-V242 HydrophobicContact CE2-CG2 3.97Å; F238-V242 HydrophobicContact CZ-CG2 3.99Å; F238-V242 PolarHBondContact O-N 3.38Å; L239-V242 PolarHBondContact O-N 3.31Å; V242-F246 WeakPolarHBondContact O-CD2 3.32Å; V242-F246 WeakPolarHBondContact O-CE2 3.49Å |
| 243 | V | 84.1 | Confident | 84.2 | Confident | 58 Ų | 58 | 57 Ų | 57 | 35% | 0.352 | 30% | 0.296 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.7 | -37.7 | -166.8 | -178.5 | 0 | 0 | 0 | 0 | 112.2 | L239 R245 F246 M247 | L239-V243 HydrophobicContact CD2-CG2 3.8Å; L239-V243 WeakPolarHBondContact O-CA 3.3Å; L239-V243 VanDerWaalsContact O-CB 3.29Å; L239-V243 WeakPolarHBondContact O-CB 3.42Å; L239-V243 PolarHBondContact O-N 2.9Å; V243-R245 PolarHBondContact O-N 3.46Å; V243-F246 PolarHBondContact O-N 3.31Å; V243-M247 HydrophobicContact CG1-CE 4.35Å; V243-M247 PolarHBondContact O-N 3.41Å |
| 244 | L | 77.1 | Confident | 83.4 | Confident | 76 Ų | 76 | 62 Ų | 62 | 40% | 0.398 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -61.6 | -34.1 | -174.4 | -164.2 | 68.3 | 0 | 0 | 0 | 112.3 | L239 N240 F246 M247 T248 | L239-L244 PolarHBondContact O-N 3.32Å; N240-L244 VanDerWaalsContact O-CB 3.29Å; N240-L244 WeakPolarHBondContact O-CB 3.36Å; N240-L244 WeakPolarHBondContact OD1-CD2 3.49Å; L244-F246 VanDerWaalsContact C-N 3.3Å; L244-F246 PolarHBondContact O-N 2.96Å; L244-M247 WeakPolarHBondContact O-CB 3.49Å; L244-M247 PolarHBondContact O-N 3.37Å; L244-T248 PolarHBondContact O-N 3.47Å; L244-T248 VanDerWaalsContact O-N 3.12Å |
| 245 | R | 72.1 | Confident | 82.8 | Confident | 135 Ų | 135 | 67.2 Ų | 67.2 | 51% | 0.509 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -63.5 | -32.2 | 175.8 | -68.1 | -171.9 | 175.6 | -144.8 | -5.3 | 113.5 | V243 T248 M249 | V243-R245 PolarHBondContact O-N 3.46Å; R245-T248 PolarHBondContact O-OG1 2.89Å; R245-M249 PolarHBondContact O-N 3.02Å |
| 246 | F | 75.5 | Confident | 82.1 | Confident | 134 Ų | 134 | 72 Ų | 72 | 59% | 0.588 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -74.8 | -33.8 | 176.2 | -70.3 | -70.3 | 0 | 0 | 0 | 111.8 | V242 V243 L244 M249 | V242-F246 WeakPolarHBondContact O-CD2 3.32Å; V242-F246 WeakPolarHBondContact O-CE2 3.49Å; V243-F246 PolarHBondContact O-N 3.31Å; L244-F246 VanDerWaalsContact C-N 3.3Å; L244-F246 PolarHBondContact O-N 2.96Å; F246-M249 HydrophobicContact CD1-CE 4.2Å; F246-M249 WeakPolarHBondContact O-CB 3.33Å; F246-M249 PolarHBondContact O-N 3.41Å |
| 247 | M | 75.8 | Confident | 81.5 | Confident | 134 Ų | 134 | 74.7 Ų | 74.7 | 66% | 0.66 | 37% | 0.368 | S | S | * | . | H | α-helix | trans | -65.8 | -43.3 | 176.5 | -66.9 | -81 | 176 | 0 | 0 | 111.5 | V243 L244 M249 | V243-M247 HydrophobicContact CG1-CE 4.35Å; V243-M247 PolarHBondContact O-N 3.41Å; L244-M247 WeakPolarHBondContact O-CB 3.49Å; L244-M247 PolarHBondContact O-N 3.37Å; M247-M249 VanDerWaalsContact C-N 3.33Å; M247-M249 PolarHBondContact O-N 2.89Å |
| 248 | T | 78.3 | Confident | 81 | Confident | 61 Ų | 61 | 76.8 Ų | 76.8 | 37% | 0.374 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -73.4 | -23.8 | -179.7 | 60.1 | 0 | 0 | 0 | 0 | 113.3 | L244 R245 N250 A251 E252 | L244-T248 PolarHBondContact O-N 3.47Å; L244-T248 VanDerWaalsContact O-N 3.12Å; R245-T248 PolarHBondContact O-OG1 2.89Å; T248-N250 PolarHBondContact O-N 3.44Å; T248-N250 VanDerWaalsContact O-N 3.16Å; T248-A251 PolarHBondContact O-N 3.33Å; T248-A251 VanDerWaalsContact O-N 3.11Å; T248-E252 WeakPolarHBondContact O-CG 3.48Å; T248-E252 PolarHBondContact O-N 3.47Å |
| 249 | M | 74.6 | Confident | 80.6 | Confident | 64 Ų | 64 | 79.1 Ų | 79.1 | 32% | 0.315 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -57.9 | -31 | 179.2 | -168 | 172 | 65.7 | 0 | 0 | 112.8 | R245 F246 M247 D253 | R245-M249 PolarHBondContact O-N 3.02Å; F246-M249 HydrophobicContact CD1-CE 4.2Å; F246-M249 WeakPolarHBondContact O-CB 3.33Å; F246-M249 PolarHBondContact O-N 3.41Å; M247-M249 VanDerWaalsContact C-N 3.33Å; M247-M249 PolarHBondContact O-N 2.89Å; M249-D253 WeakPolarHBondContact O-CB 3.25Å; M249-D253 PolarHBondContact O-N 3.3Å |
| 250 | N | 74.2 | Confident | 80.2 | Confident | 60 Ų | 60 | 80.9 Ų | 80.9 | 32% | 0.321 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -65.2 | -45.2 | 176.9 | -69.3 | 8.3 | 0 | 0 | 0 | 112.4 | R7 T248 D253 E254 | R7-N250 PolarHBondContact NE-OD1 3.24Å; R7-N250 PolarHBondContact NH1-OD1 3.03Å; R7-N250 VanDerWaalsContact NH1-OD1 3.16Å; R7-N250 PolarHBondContact NH2-OD1 2.83Å; R7-N250 VanDerWaalsContact NH2-OD1 3.09Å; T248-N250 PolarHBondContact O-N 3.44Å; T248-N250 VanDerWaalsContact O-N 3.16Å; N250-D253 PolarHBondContact O-N 3.24Å; N250-E254 PolarHBondContact O-N 2.94Å; N250-E254 VanDerWaalsContact O-N 3.13Å |
| 251 | A | 77.7 | Confident | 79.9 | Confident | 63 Ų | 63 | 86.1 Ų | 86.1 | 52% | 0.521 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -71.1 | -36.9 | 179.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | T248 E254 K255 | T248-A251 PolarHBondContact O-N 3.33Å; T248-A251 VanDerWaalsContact O-N 3.11Å; A251-E254 PolarHBondContact O-N 3.36Å; A251-K255 WeakPolarHBondContact O-CB 3.47Å; A251-K255 PolarHBondContact O-N 3.34Å |
| 252 | E | 78.5 | Confident | 79.7 | Confident | 105 Ų | 105 | 88.3 Ų | 88.3 | 49% | 0.491 | 44% | 0.441 | S | S | . | . | H | α-helix | trans | -64.2 | -40.1 | 174.4 | -71.6 | 176.3 | -165.5 | 0 | 0 | 112.2 | T248 E254 K255 R256 | T248-E252 WeakPolarHBondContact O-CG 3.48Å; T248-E252 PolarHBondContact O-N 3.47Å; E252-E254 VanDerWaalsContact C-N 3.34Å; E252-K255 PolarHBondContact O-N 3.41Å; E252-R256 WeakPolarHBondContact O-CB 3.32Å; E252-R256 VanDerWaalsContact O-CG 3.31Å; E252-R256 WeakPolarHBondContact O-CG 3.39Å; E252-R256 PolarHBondContact O-N 2.96Å |
| 253 | D | 78.6 | Confident | 79.6 | Confident | 9 Ų | 9 | 91 Ų | 91 | 5% | 0.048 | 45% | 0.453 | C | S | . | . | H | α-helix | trans | -62.9 | -40.9 | 172.5 | -71.2 | -23.9 | 0 | 0 | 0 | 111.6 | Q4 R7 M249 N250 R256 D257 | Q4-D253 HydrophobicContact CG-CB 4.37Å; R7-D253 IonicContact CZ-OD2 3.18Å; R7-D253 IonicContact NH1-OD2 2.71Å; R7-D253 PolarHBondContact NH1-OD2 3.01Å; R7-D253 IonicContact NH2-OD2 2.86Å; R7-D253 PolarHBondContact NH2-OD2 2.83Å; M249-D253 WeakPolarHBondContact O-CB 3.25Å; M249-D253 PolarHBondContact O-N 3.3Å; N250-D253 PolarHBondContact O-N 3.24Å; D253-R256 PolarHBondContact O-N 2.96Å; D253-R256 IonicContact OD1-CZ 3.42Å; D253-R256 IonicContact OD1-NE 3.71Å; D253-R256 IonicContact OD1-NH2 2.62Å; D253-R256 PolarHBondContact OD1-NH2 2.83Å; D253-D257 WeakPolarHBondContact O-CB 3.46Å; D253-D257 PolarHBondContact O-N 2.85Å |
| 254 | E | 78.4 | Confident | 79.6 | Confident | 118 Ų | 118 | 93.4 Ų | 93.4 | 55% | 0.551 | 46% | 0.463 | S | S | * | . | H | α-helix | trans | -65 | -41.9 | 179 | -164.8 | 172.5 | -177.7 | 0 | 0 | 112 | Q4 N250 A251 E252 D257 A258 | Q4-E254 VanDerWaalsContact NE2-CB 3.29Å; N250-E254 PolarHBondContact O-N 2.94Å; N250-E254 VanDerWaalsContact O-N 3.13Å; A251-E254 PolarHBondContact O-N 3.36Å; E252-E254 VanDerWaalsContact C-N 3.34Å; E254-D257 PolarHBondContact O-N 3.18Å; E254-A258 WeakPolarHBondContact O-CB 3.34Å; E254-A258 PolarHBondContact O-N 3.45Å |
| 255 | K | 82.8 | Confident | 79.8 | Confident | 136 Ų | 136 | 94 Ų | 94 | 59% | 0.591 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -62 | -45.8 | 174.7 | -171.9 | -179.7 | 176 | -170.1 | 0 | 111.1 | A251 E252 D257 A258 E259 | A251-K255 WeakPolarHBondContact O-CB 3.47Å; A251-K255 PolarHBondContact O-N 3.34Å; E252-K255 PolarHBondContact O-N 3.41Å; K255-D257 PolarHBondContact O-N 3.16Å; K255-A258 PolarHBondContact O-N 3.46Å; K255-E259 WeakPolarHBondContact CE-OE1 3.43Å; K255-E259 WeakPolarHBondContact O-CG 3.38Å; K255-E259 PolarHBondContact O-N 3.49Å |
| 256 | R | 81.5 | Confident | 80 | Confident | 129 Ų | 129 | 96.4 Ų | 96.4 | 49% | 0.487 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -61.6 | -42.7 | 176.3 | -75.1 | -173.3 | -73.7 | -176 | -8.5 | 112.4 | E252 D253 A258 E259 H260 | E252-R256 WeakPolarHBondContact O-CB 3.32Å; E252-R256 VanDerWaalsContact O-CG 3.31Å; E252-R256 WeakPolarHBondContact O-CG 3.39Å; E252-R256 PolarHBondContact O-N 2.96Å; D253-R256 PolarHBondContact O-N 2.96Å; D253-R256 IonicContact OD1-CZ 3.42Å; D253-R256 IonicContact OD1-NE 3.71Å; D253-R256 IonicContact OD1-NH2 2.62Å; D253-R256 PolarHBondContact OD1-NH2 2.83Å; R256-A258 VanDerWaalsContact C-N 3.32Å; R256-A258 PolarHBondContact O-N 3.15Å; R256-E259 PolarHBondContact O-N 2.83Å; R256-H260 WeakPolarHBondContact O-CB 3.37Å; R256-H260 PolarHBondContact O-N 3.37Å |
| 257 | D | 81.3 | Confident | 79.9 | Confident | 65 Ų | 65 | 95.5 Ų | 95.5 | 35% | 0.348 | 48% | 0.481 | S | S | . | . | H | α-helix | trans | -69.2 | -29.6 | 177.5 | -75.7 | -9.5 | 0 | 0 | 0 | 112.4 | D253 E254 K255 R261 | D253-D257 WeakPolarHBondContact O-CB 3.46Å; D253-D257 PolarHBondContact O-N 2.85Å; E254-D257 PolarHBondContact O-N 3.18Å; K255-D257 PolarHBondContact O-N 3.16Å; D257-R261 WeakPolarHBondContact O-CB 3.46Å; D257-R261 WeakPolarHBondContact O-CG 3.49Å; D257-R261 PolarHBondContact O-N 3.35Å; D257-R261 PolarHBondContact O-NE 2.98Å |
| 258 | A | 82.6 | Confident | 79.2 | Confident | 47 Ų | 47 | 91.7 Ų | 91.7 | 39% | 0.388 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -72.8 | -44.4 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | E254 K255 R256 R261 A262 | E254-A258 WeakPolarHBondContact O-CB 3.34Å; E254-A258 PolarHBondContact O-N 3.45Å; K255-A258 PolarHBondContact O-N 3.46Å; R256-A258 VanDerWaalsContact C-N 3.32Å; R256-A258 PolarHBondContact O-N 3.15Å; A258-R261 PolarHBondContact O-N 3.35Å; A258-A262 PolarHBondContact O-N 3.45Å |
| 259 | E | 85.3 | Confident | 78.1 | Confident | 100 Ų | 100 | 96.2 Ų | 96.2 | 47% | 0.467 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -61.5 | -46.2 | 175.2 | -73.7 | 172.1 | -176.9 | 0 | 0 | 111.4 | K255 R256 R261 A262 L263 | K255-E259 WeakPolarHBondContact CE-OE1 3.43Å; K255-E259 WeakPolarHBondContact O-CG 3.38Å; K255-E259 PolarHBondContact O-N 3.49Å; R256-E259 PolarHBondContact O-N 2.83Å; E259-R261 VanDerWaalsContact C-N 3.32Å; E259-R261 PolarHBondContact O-N 3.12Å; E259-A262 PolarHBondContact O-N 2.96Å; E259-L263 WeakPolarHBondContact O-CG 3.32Å; E259-L263 PolarHBondContact O-N 3.49Å |
| 260 | H | 82 | Confident | 77.1 | Confident | 117 Ų | 117 | 97 Ų | 97 | 54% | 0.542 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -62.7 | -38 | 177.9 | -162.7 | -92.1 | 0 | 0 | 0 | 112.1 | R256 L263 L264 | R256-H260 WeakPolarHBondContact O-CB 3.37Å; R256-H260 PolarHBondContact O-N 3.37Å; H260-L263 PolarHBondContact O-N 3.49Å; H260-L264 WeakPolarHBondContact O-CG 3.43Å; H260-L264 PolarHBondContact O-N 2.87Å; H260-L264 VanDerWaalsContact O-N 3.13Å |
| 261 | R | 81.8 | Confident | 76.1 | Confident | 135 Ų | 135 | 97.6 Ų | 97.6 | 51% | 0.509 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -65.4 | -42.4 | 173.1 | -83.9 | -179.6 | -74.2 | 148.9 | -4.7 | 112.5 | D257 A258 E259 L263 L264 T265 | D257-R261 WeakPolarHBondContact O-CB 3.46Å; D257-R261 WeakPolarHBondContact O-CG 3.49Å; D257-R261 PolarHBondContact O-N 3.35Å; D257-R261 PolarHBondContact O-NE 2.98Å; A258-R261 PolarHBondContact O-N 3.35Å; E259-R261 VanDerWaalsContact C-N 3.32Å; E259-R261 PolarHBondContact O-N 3.12Å; R261-L263 VanDerWaalsContact C-N 3.3Å; R261-L263 PolarHBondContact O-N 3.3Å; R261-L264 PolarHBondContact O-N 3.39Å; R261-T265 PolarHBondContact O-N 2.94Å; R261-T265 VanDerWaalsContact O-N 3.1Å; R261-T265 PolarHBondContact O-OG1 3.18Å; R261-T265 VanDerWaalsContact O-OG1 3.11Å |
| 262 | A | 84.5 | Confident | 74.5 | Confident | 62 Ų | 62 | 97.9 Ų | 97.9 | 51% | 0.512 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -62.2 | -38.5 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | A258 E259 T265 R266 | A258-A262 PolarHBondContact O-N 3.45Å; E259-A262 PolarHBondContact O-N 2.96Å; A262-T265 PolarHBondContact O-N 3.34Å; A262-R266 PolarHBondContact O-N 2.99Å; A262-R266 VanDerWaalsContact O-N 3.13Å |
| 263 | L | 84.4 | Confident | 72.9 | Confident | 102 Ų | 102 | 96.3 Ų | 96.3 | 53% | 0.534 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -64.5 | -42.4 | 175.1 | -70.6 | 173 | 0 | 0 | 0 | 112.6 | E259 H260 R261 R266 N267 | E259-L263 WeakPolarHBondContact O-CG 3.32Å; E259-L263 PolarHBondContact O-N 3.49Å; H260-L263 PolarHBondContact O-N 3.49Å; R261-L263 VanDerWaalsContact C-N 3.3Å; R261-L263 PolarHBondContact O-N 3.3Å; L263-R266 PolarHBondContact O-N 3.46Å; L263-N267 PolarHBondContact O-N 2.83Å |
| 264 | L | 83.9 | Confident | 71.1 | Confident | 109 Ų | 109 | 99.7 Ų | 99.7 | 57% | 0.571 | 59% | 0.588 | S | S | * | * | H | α-helix | trans | -63.4 | -41.3 | 177 | -70 | 172 | 0 | 0 | 0 | 112.1 | H260 R261 N267 G268 | H260-L264 WeakPolarHBondContact O-CG 3.43Å; H260-L264 PolarHBondContact O-N 2.87Å; H260-L264 VanDerWaalsContact O-N 3.13Å; R261-L264 PolarHBondContact O-N 3.39Å; L264-N267 PolarHBondContact O-N 3Å; L264-G268 PolarHBondContact O-N 3.43Å |
| 265 | T | 81.7 | Confident | 69.3 | Low | 90 Ų | 90 | 98 Ų | 98 | 55% | 0.552 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -63.8 | -41.5 | 176.5 | -51.5 | 0 | 0 | 0 | 0 | 111.9 | R261 A262 G268 Q269 | R261-T265 PolarHBondContact O-N 2.94Å; R261-T265 VanDerWaalsContact O-N 3.1Å; R261-T265 PolarHBondContact O-OG1 3.18Å; R261-T265 VanDerWaalsContact O-OG1 3.11Å; A262-T265 PolarHBondContact O-N 3.34Å; T265-G268 PolarHBondContact O-N 2.94Å; T265-Q269 PolarHBondContact O-N 3.04Å; T265-Q269 VanDerWaalsContact O-N 3.12Å |
| 266 | R | 76.8 | Confident | 67.1 | Low | 185 Ų | 185 | 95.8 Ų | 95.8 | 70% | 0.698 | 62% | 0.617 | S | S | * | * | H | α-helix | trans | -65.5 | -43 | 178.7 | -176 | 176.7 | 129.5 | 168.2 | -0.9 | 112.5 | A262 L263 Q269 A270 | A262-R266 PolarHBondContact O-N 2.99Å; A262-R266 VanDerWaalsContact O-N 3.13Å; L263-R266 PolarHBondContact O-N 3.46Å; R266-Q269 PolarHBondContact O-N 2.9Å; R266-A270 PolarHBondContact O-N 2.85Å |
| 267 | N | 73.3 | Confident | 64.8 | Low | 115 Ų | 115 | 93.5 Ų | 93.5 | 62% | 0.615 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -71.5 | -31.4 | 176.7 | -80.9 | 2.7 | 0 | 0 | 0 | 112.5 | L263 L264 Q269 A270 G271 | L263-N267 PolarHBondContact O-N 2.83Å; L264-N267 PolarHBondContact O-N 3Å; N267-Q269 VanDerWaalsContact C-N 3.33Å; N267-Q269 PolarHBondContact O-N 3.35Å; N267-A270 PolarHBondContact O-N 3.49Å; N267-G271 PolarHBondContact O-N 3.31Å |
| 268 | G | 61.3 | Low | 62.6 | Low | 53 Ų | 53 | 96.4 Ų | 96.4 | 55% | 0.546 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -65.1 | -33.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | L264 T265 | L264-G268 PolarHBondContact O-N 3.43Å; T265-G268 PolarHBondContact O-N 2.94Å |
| 269 | Q | 56 | Low | 60.2 | Low | 156 Ų | 156 | 98.3 Ų | 98.3 | 73% | 0.729 | 68% | 0.675 | S | S | * | * | H | α-helix | trans | -78 | -28.3 | 173.3 | -94.6 | 163.9 | -28.8 | 0 | 0 | 113.7 | T265 R266 N267 | T265-Q269 PolarHBondContact O-N 3.04Å; T265-Q269 VanDerWaalsContact O-N 3.12Å; R266-Q269 PolarHBondContact O-N 2.9Å; N267-Q269 VanDerWaalsContact C-N 3.33Å; N267-Q269 PolarHBondContact O-N 3.35Å |
| 270 | A | 53.7 | Low | 57.5 | Low | 82 Ų | 82 | 102.2 Ų | 102.2 | 68% | 0.678 | 69% | 0.693 | S | S | * | * | H | α-helix | trans | -76.4 | -24.6 | 174.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | R266 N267 | R266-A270 PolarHBondContact O-N 2.85Å; N267-A270 PolarHBondContact O-N 3.49Å |
| 271 | G | 51.3 | Low | 55.3 | Low | 72 Ų | 72 | 101.9 Ų | 101.9 | 74% | 0.742 | 70% | 0.699 | S | S | * | * | S | Bend | trans | -91.6 | -3.7 | 177.7 | 0 | 0 | 0 | 0 | 0 | 115.5 | N267 | N267-G271 PolarHBondContact O-N 3.31Š|
| 272 | G | 46.1 | Very low | 52.8 | Low | 69 Ų | 69 | 102.2 Ų | 102.2 | 71% | 0.711 | 72% | 0.716 | S | S | * | * | S | Bend | trans | -103.7 | 2.4 | -172.7 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||
| 273 | G | 43.8 | Very low | 50.1 | Low | 72 Ų | 72 | 106.4 Ų | 106.4 | 74% | 0.742 | 73% | 0.73 | S | S | * | * | trans | -129.9 | 90.5 | -177.6 | 0 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 274 | G | 40.7 | Very low | 47.5 | Very low | 80 Ų | 80 | 108 Ų | 108 | 83% | 0.825 | 74% | 0.744 | S | S | * | * | trans | 178 | 60.8 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | ||||
| 275 | G | 39.7 | Very low | 44.8 | Very low | 83 Ų | 83 | 106.7 Ų | 106.7 | 86% | 0.856 | 75% | 0.75 | S | S | * | * | trans | -80 | 135.4 | 164.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 276 | G | 37.6 | Very low | 42.1 | Very low | 88 Ų | 88 | 108 Ų | 108 | 91% | 0.907 | 76% | 0.762 | S | S | * | * | trans | 95.8 | 116.1 | 153.5 | 0 | 0 | 0 | 0 | 0 | 117.3 | ||||
| 277 | G | 32.9 | Very low | 39.7 | Very low | 82 Ų | 82 | 104.3 Ų | 104.3 | 85% | 0.845 | 77% | 0.765 | S | S | * | * | trans | 151.2 | 99.8 | 160.6 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||||
| 278 | S | 34.3 | Very low | 37.6 | Very low | 126 Ų | 126 | 105.4 Ų | 105.4 | 88% | 0.881 | 78% | 0.776 | S | S | * | * | trans | -75.9 | 159.8 | 173.5 | -163.3 | 0 | 0 | 0 | 0 | 112.3 | ||||
| 279 | A | 32.7 | Very low | 36 | Very low | 86 Ų | 86 | 108 Ų | 108 | 71% | 0.711 | 79% | 0.792 | S | S | * | * | trans | 99.9 | 125.9 | 152 | 0 | 0 | 0 | 0 | 0 | 120.9 | ||||
| 280 | H | 30.2 | Very low | 34.6 | Very low | 183 Ų | 183 | 105.2 Ų | 105.2 | 85% | 0.847 | 80% | 0.796 | S | S | * | * | trans | 108 | 114.7 | 143.2 | -91.5 | -59.1 | 0 | 0 | 0 | 121.6 | ||||
| 281 | T | 34.9 | Very low | 33.6 | Very low | 110 Ų | 110 | 106.6 Ų | 106.6 | 68% | 0.675 | 81% | 0.807 | S | S | * | * | trans | -53.1 | 142.9 | 164.8 | 48.2 | 0 | 0 | 0 | 0 | 115.1 | ||||
| 282 | T | 29.6 | Very low | 32.4 | Very low | 141 Ų | 141 | 106.8 Ų | 106.8 | 87% | 0.865 | 81% | 0.809 | S | S | * | * | -171 | 138.3 | 119.7 | 22.2 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 283 | D | 28.3 | Very low | 31.8 | Very low | 151 Ų | 151 | 107.9 Ų | 107.9 | 81% | 0.807 | 82% | 0.82 | S | S | * | * | trans | -60 | 156.7 | 175 | -63.8 | -58.1 | 0 | 0 | 0 | 113.8 | ||||
| 284 | T | 28.2 | Very low | 31 | Very low | 135 Ų | 135 | 108.3 Ų | 108.3 | 83% | 0.828 | 83% | 0.825 | S | S | * | * | 170.1 | 120.5 | 109.7 | -58.4 | 0 | 0 | 0 | 0 | 112.2 | |||||
| 285 | A | 27.3 | Very low | 30.3 | Very low | 82 Ų | 82 | 107.2 Ų | 107.2 | 68% | 0.678 | 81% | 0.813 | S | S | * | * | trans | 61.2 | 122.6 | 144.2 | 0 | 0 | 0 | 0 | 0 | 124.2 | ||||
| 286 | S | 25.7 | Very low | 30 | Very low | 116 Ų | 116 | 113.1 Ų | 113.1 | 81% | 0.811 | 82% | 0.816 | S | S | * | * | 72.7 | 107.6 | 126.3 | 67.4 | 0 | 0 | 0 | 0 | 120.8 | |||||
| 287 | S | 27.2 | Very low | 29.7 | Very low | 109 Ų | 109 | 119.9 Ų | 119.9 | 76% | 0.762 | 81% | 0.814 | S | S | * | * | -166.4 | 104.4 | 120.3 | 58.6 | 0 | 0 | 0 | 0 | 111.4 | |||||
| 288 | T | 27.3 | Very low | 29.6 | Very low | 137 Ų | 137 | 123 Ų | 123 | 84% | 0.84 | 81% | 0.811 | S | S | * | * | trans | 26 | 116 | 140.7 | 47.2 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 289 | A | 28.6 | Very low | 29.8 | Very low | 108 Ų | 108 | 122.8 Ų | 122.8 | 89% | 0.893 | 80% | 0.804 | S | S | * | * | trans | -58.8 | 129.8 | 154.5 | 0 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 290 | A | 27.5 | Very low | 29.7 | Very low | 98 Ų | 98 | 128.5 Ų | 128.5 | 81% | 0.81 | 81% | 0.809 | S | S | * | * | trans | -134.6 | 100.1 | 159.2 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 291 | A | 32.6 | Very low | 30.1 | Very low | 111 Ų | 111 | 123.6 Ų | 123.6 | 92% | 0.917 | 80% | 0.8 | S | S | * | * | trans | -71.1 | 129.7 | 158.5 | 0 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 292 | G | 26 | Very low | 30.1 | Very low | 75 Ų | 75 | 126.8 Ų | 126.8 | 77% | 0.773 | 81% | 0.807 | S | S | * | * | trans | -171.3 | 108.8 | 176 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 293 | G | 32.2 | Very low | 30.6 | Very low | 92 Ų | 92 | 125.1 Ų | 125.1 | 95% | 0.948 | 80% | 0.797 | S | S | * | * | trans | -68.3 | 157.3 | -171.6 | 0 | 0 | 0 | 0 | 0 | 116 | ||||
| 294 | G | 27.1 | Very low | 31 | Very low | 82 Ų | 82 | 124 Ų | 124 | 85% | 0.845 | 79% | 0.79 | S | S | * | * | trans | 170.8 | 80.4 | 170.7 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 295 | G | 26.3 | Very low | 31.4 | Very low | 56 Ų | 56 | 125.9 Ų | 125.9 | 58% | 0.577 | 79% | 0.789 | S | S | * | * | cis | 92.9 | 70.7 | 47 | 0 | 0 | 0 | 0 | 0 | 110.1 | R297 | G295-R297 PolarHBondContact O-N 2.89Š| ||
| 296 | F | 33.1 | Very low | 31.6 | Very low | 207 Ų | 207 | 130.7 Ų | 130.7 | 91% | 0.908 | 80% | 0.795 | S | S | * | * | S | Bend | trans | 49.1 | 42.7 | 133.8 | -86.9 | -85.7 | 0 | 0 | 0 | 119.3 | ||
| 297 | R | 31.5 | Very low | 32.2 | Very low | 231 Ų | 231 | 132.9 Ų | 132.9 | 87% | 0.872 | 79% | 0.792 | S | S | * | * | trans | -122.8 | -0.5 | 176.6 | -84.1 | 178.7 | 73.8 | -178.5 | 0.7 | 118.2 | G295 | G295-R297 PolarHBondContact O-N 2.89Š| ||
| 298 | N | 31.7 | Very low | 32.7 | Very low | 147 Ų | 147 | 131.9 Ų | 131.9 | 79% | 0.786 | 79% | 0.785 | S | S | * | * | S | Bend | trans | -124.5 | 7.8 | -175 | -106.2 | -1.4 | 0 | 0 | 0 | 117.9 | ||
| 299 | V | 37.2 | Very low | 33.2 | Very low | 122 Ų | 122 | 130.6 Ų | 130.6 | 74% | 0.739 | 77% | 0.771 | S | S | * | * | S | Bend | trans | -91 | -8.1 | -179.2 | -176.4 | 0 | 0 | 0 | 0 | 113.2 | ||
| 300 | Y | 32.5 | Very low | 33.4 | Very low | 206 Ų | 206 | 129 Ų | 129 | 81% | 0.808 | 75% | 0.753 | S | S | * | * | S | Bend | trans | -86.3 | -6.7 | -179.1 | -79.2 | -81.1 | 0 | 0 | 0 | 114.9 | ||
| 301 | A | 36.8 | Very low | 34 | Very low | 80 Ų | 80 | 129.8 Ų | 129.8 | 66% | 0.661 | 75% | 0.753 | S | S | * | * | S | Bend | trans | -85.4 | -22.4 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114 | ||
| 302 | E | 35.5 | Very low | 34.4 | Very low | 176 Ų | 176 | 129.3 Ų | 129.3 | 82% | 0.822 | 74% | 0.741 | S | S | * | * | G | 310 helix | trans | -84.3 | -6.8 | -178.8 | -77.5 | -163.4 | 145.3 | 0 | 0 | 114.6 | L304 | E302-L304 VanDerWaalsContact C-N 3.29Å; E302-L304 PolarHBondContact O-N 3.03Å |
| 303 | V | 40.5 | Very low | 35 | Very low | 106 Ų | 106 | 131.3 Ų | 131.3 | 64% | 0.642 | 73% | 0.734 | S | S | * | * | G | 310 helix | trans | -84.8 | 4.2 | -173.2 | -175.5 | 0 | 0 | 0 | 0 | 113.4 | ||
| 304 | L | 35.5 | Very low | 35.3 | Very low | 128 Ų | 128 | 135.3 Ų | 135.3 | 67% | 0.67 | 72% | 0.72 | S | S | * | * | G | 310 helix | trans | -106.8 | 1.9 | -179.2 | -79.6 | 167.8 | 0 | 0 | 0 | 115.6 | E302 | E302-L304 VanDerWaalsContact C-N 3.29Å; E302-L304 PolarHBondContact O-N 3.03Å |
| 305 | H | 37.8 | Very low | 35.6 | Very low | 175 Ų | 175 | 141.6 Ų | 141.6 | 81% | 0.81 | 72% | 0.72 | S | S | * | * | trans | -120.9 | 17.1 | -173.5 | -106.5 | -66.8 | 0 | 0 | 0 | 117 | Q307 | H305-Q307 PolarHBondContact O-N 3.13Š| ||
| 306 | F | 31.6 | Very low | 36 | Very low | 182 Ų | 182 | 147 Ų | 147 | 80% | 0.798 | 73% | 0.727 | S | S | * | * | trans | -97.7 | 94.8 | 168.9 | -114.4 | -92.9 | 0 | 0 | 0 | 111.3 | M309 | F306-M309 HydrophobicContact CD1-CG 4.38Å; F306-M309 HydrophobicContact CE1-CE 4.42Å; F306-M309 HydrophobicContact CE1-CG 4.15Å | ||
| 307 | Q | 37.3 | Very low | 36 | Very low | 162 Ų | 162 | 140.9 Ų | 140.9 | 76% | 0.757 | 71% | 0.71 | S | S | * | * | trans | -47.4 | 143.1 | 160.5 | -79.4 | 174.8 | -37 | 0 | 0 | 110.5 | H305 M309 | H305-Q307 PolarHBondContact O-N 3.13Å; Q307-M309 PolarHBondContact O-N 3.47Å | ||
| 308 | S | 39.1 | Very low | 36.2 | Very low | 88 Ų | 88 | 139.9 Ų | 139.9 | 62% | 0.615 | 71% | 0.707 | S | S | * | * | trans | -54.2 | 112.8 | 170.7 | 62.7 | 0 | 0 | 0 | 0 | 110.1 | C310 | S308-C310 VanDerWaalsContact C-N 3.33Å; S308-C310 PolarHBondContact O-N 2.9Å | ||
| 309 | M | 36.9 | Very low | 36.5 | Very low | 110 Ų | 110 | 140.6 Ų | 140.6 | 54% | 0.542 | 71% | 0.705 | S | S | . | * | trans | -80.2 | 88.4 | 175.2 | -73.9 | -99.2 | -89.1 | 0 | 0 | 108 | F306 Q307 | F306-M309 HydrophobicContact CD1-CG 4.38Å; F306-M309 HydrophobicContact CE1-CE 4.42Å; F306-M309 HydrophobicContact CE1-CG 4.15Å; Q307-M309 PolarHBondContact O-N 3.47Å | ||
| 310 | C | 33.6 | Very low | 36.3 | Very low | 76 Ų | 76 | 143.5 Ų | 143.5 | 51% | 0.514 | 71% | 0.708 | S | S | . | * | trans | -69.8 | 134 | 158.2 | -161 | 0 | 0 | 0 | 0 | 108.2 | S308 C312 L313 | S308-C310 VanDerWaalsContact C-N 3.33Å; S308-C310 PolarHBondContact O-N 2.9Å; C310-C312 PolarHBondContact O-N 3.39Å; C310-L313 PolarHBondContact O-N 3.49Å; C310-L313 VanDerWaalsContact O-N 3.14Å | ||
| 311 | S | 40.2 | Very low | 36.4 | Very low | 114 Ų | 114 | 140.6 Ų | 140.6 | 80% | 0.797 | 71% | 0.706 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -57.1 | -9.8 | -170.7 | -55 | 0 | 0 | 0 | 0 | 115.8 | ||
| 312 | C | 39.4 | Very low | 36.1 | Very low | 101 Ų | 101 | 144.8 Ų | 144.8 | 68% | 0.682 | 71% | 0.711 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.8 | -13.8 | 177.5 | 21.9 | 0 | 0 | 0 | 0 | 115 | C310 | C310-C312 PolarHBondContact O-N 3.39Š|
| 313 | L | 40.2 | Very low | 36 | Very low | 117 Ų | 117 | 146.9 Ų | 146.9 | 61% | 0.613 | 71% | 0.713 | S | S | * | * | S | Bend | trans | -86.3 | -19.1 | 174.1 | -100.9 | 121.7 | 0 | 0 | 0 | 113.9 | C310 Y315 K316 | C310-L313 PolarHBondContact O-N 3.49Å; C310-L313 VanDerWaalsContact O-N 3.14Å; L313-Y315 PolarHBondContact O-N 3.06Å; L313-K316 PolarHBondContact O-N 3.39Å |
| 314 | W | 38.5 | Very low | 35.6 | Very low | 176 Ų | 176 | 146.5 Ų | 146.5 | 67% | 0.667 | 72% | 0.715 | S | S | * | * | H | α-helix | trans | -66.4 | -25.3 | -179.3 | -126.2 | 78.2 | 0 | 0 | 0 | 113.1 | K316 | W314-K316 VanDerWaalsContact C-N 3.32Å; W314-K316 PolarHBondContact O-N 3.4Å |
| 315 | Y | 33.3 | Very low | 35.3 | Very low | 214 Ų | 214 | 147.8 Ų | 147.8 | 84% | 0.839 | 72% | 0.722 | S | S | * | * | H | α-helix | trans | -72 | -25 | 178.9 | -160.7 | -98.8 | 0 | 0 | 0 | 113 | L313 | L313-Y315 PolarHBondContact O-N 3.06Å |
| 316 | K | 33 | Very low | 35 | Very low | 168 Ų | 168 | 145 Ų | 145 | 73% | 0.73 | 72% | 0.719 | S | S | * | * | H | α-helix | trans | -91.8 | -11.1 | -176.9 | -148.1 | 173.1 | -174.8 | 174.2 | 0 | 114.1 | L313 W314 | L313-K316 PolarHBondContact O-N 3.39Å; W314-K316 VanDerWaalsContact C-N 3.32Å; W314-K316 PolarHBondContact O-N 3.4Å |
| 317 | S | 34.2 | Very low | 34.8 | Very low | 79 Ų | 79 | 143.7 Ų | 143.7 | 55% | 0.552 | 72% | 0.717 | S | S | * | * | H | α-helix | trans | -82.2 | -20.2 | 179.8 | -173.5 | 0 | 0 | 0 | 0 | 113 | E319 K320 | S317-E319 PolarHBondContact O-N 3.22Å; S317-K320 PolarHBondContact O-N 3.37Å |
| 318 | R | 36.3 | Very low | 34.5 | Very low | 210 Ų | 210 | 143.5 Ų | 143.5 | 79% | 0.792 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.9 | -20 | -176.5 | -136.9 | 179.1 | 177.1 | -172.8 | -1.9 | 114.4 | ||
| 319 | E | 37.5 | Very low | 34.1 | Very low | 162 Ų | 162 | 145.1 Ų | 145.1 | 76% | 0.757 | 72% | 0.72 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -76.7 | -21.8 | 174.5 | -82 | -176.8 | 153.2 | 0 | 0 | 113.6 | S317 | S317-E319 PolarHBondContact O-N 3.22Š|
| 320 | K | 33.1 | Very low | 33.7 | Very low | 184 Ų | 184 | 145.3 Ų | 145.3 | 80% | 0.8 | 73% | 0.73 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -90.8 | -5.8 | -178.6 | -76.4 | -165.6 | 175.6 | -172.1 | 0 | 114.8 | S317 | S317-K320 PolarHBondContact O-N 3.37Š|
| 321 | L | 33.5 | Very low | 33.5 | Very low | 144 Ų | 144 | 152.6 Ų | 152.6 | 75% | 0.754 | 75% | 0.746 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -94.6 | 7.9 | 177.7 | -136.4 | 80.5 | 0 | 0 | 0 | 113.8 | ||
| 322 | Q | 32 | Very low | 32.9 | Very low | 168 Ų | 168 | 154.1 Ų | 154.1 | 79% | 0.785 | 75% | 0.746 | S | S | * | * | S | Bend | trans | -92.5 | -2.6 | 177.5 | -150.1 | 103.7 | -9.7 | 0 | 0 | 113.4 | ||
| 323 | Y | 32.1 | Very low | 32.4 | Very low | 220 Ų | 220 | 156.4 Ų | 156.4 | 86% | 0.863 | 75% | 0.75 | S | S | * | * | S | Bend | trans | -121.4 | 57.2 | -178.6 | -95.2 | -84.6 | 0 | 0 | 0 | 111.7 | ||
| 324 | S | 31.7 | Very low | 31.6 | Very low | 98 Ų | 98 | 155.5 Ų | 155.5 | 69% | 0.685 | 75% | 0.754 | S | S | * | * | trans | -164.8 | 61.7 | 164 | 0.7 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 325 | I | 30.5 | Very low | 31 | Very low | 156 Ų | 156 | 152.9 Ų | 152.9 | 80% | 0.8 | 76% | 0.757 | S | S | * | * | trans | -122.6 | 115 | 159.6 | -56.1 | 177.2 | 0 | 0 | 0 | 106.2 | M327 | I325-M327 PolarHBondContact O-N 3.4Š| ||
| 326 | P | 30.7 | Very low | 30.7 | Very low | 117 Ų | 117 | 147.3 Ų | 147.3 | 76% | 0.76 | 75% | 0.75 | S | S | * | * | trans | -72.9 | 112.2 | 171.7 | 28.3 | -27.7 | 0 | 0 | 0 | 108 | I328 | P326-I328 PolarHBondContact O-N 3.34Š| ||
| 327 | M | 27.3 | Very low | 30.4 | Very low | 153 Ų | 153 | 147 Ų | 147 | 75% | 0.754 | 76% | 0.756 | S | S | * | * | trans | -78.5 | 108.1 | 173.5 | -160.7 | -167.6 | -53.2 | 0 | 0 | 108.2 | I325 I329 | I325-M327 PolarHBondContact O-N 3.4Å; M327-I329 HydrophobicContact CG-CD1 4.4Å; M327-I329 HydrophobicContact CG-CG1 3.87Å; M327-I329 PolarHBondContact O-N 3.17Å; M327-I329 HydrophobicContact SD-CD1 3.55Å; M327-I329 VanDerWaalsContact SD-CD1 3.55Å; M327-I329 HydrophobicContact SD-CG1 3.62Å | ||
| 328 | I | 32.4 | Very low | 30 | Very low | 159 Ų | 159 | 149.8 Ų | 149.8 | 82% | 0.815 | 77% | 0.77 | S | S | * | * | trans | -82.3 | 107.9 | 166.2 | -66.9 | 165.7 | 0 | 0 | 0 | 106.4 | P326 | P326-I328 PolarHBondContact O-N 3.34Š| ||
| 329 | I | 29.1 | Very low | 29.6 | Very low | 121 Ų | 121 | 145.6 Ų | 145.6 | 62% | 0.621 | 77% | 0.772 | S | S | * | * | trans | -104.2 | 126.4 | 170.6 | -56.6 | 175.6 | 0 | 0 | 0 | 107.8 | M327 | M327-I329 HydrophobicContact CG-CD1 4.4Å; M327-I329 HydrophobicContact CG-CG1 3.87Å; M327-I329 PolarHBondContact O-N 3.17Å; M327-I329 HydrophobicContact SD-CD1 3.55Å; M327-I329 VanDerWaalsContact SD-CD1 3.55Å; M327-I329 HydrophobicContact SD-CG1 3.62Å | ||
| 330 | P | 29.6 | Very low | 29 | Very low | 114 Ų | 114 | 143.9 Ų | 143.9 | 74% | 0.74 | 77% | 0.772 | S | S | * | * | trans | -76.8 | 123.7 | 157.9 | -6.2 | 24.1 | 0 | 0 | 0 | 109.2 | ||||
| 331 | R | 30 | Very low | 28.6 | Very low | 229 Ų | 229 | 142.5 Ų | 142.5 | 86% | 0.864 | 77% | 0.768 | S | S | * | * | trans | -65.6 | 134.9 | 162.5 | -94.7 | -175.4 | 165.3 | 158.4 | -3.6 | 108.7 | ||||
| 332 | D | 27 | Very low | 28.1 | Very low | 147 Ų | 147 | 143 Ų | 143 | 79% | 0.786 | 77% | 0.767 | S | S | * | * | -172.8 | 140.9 | 123.5 | -99.4 | -19.9 | 0 | 0 | 0 | 115.2 | |||||
| 333 | L | 28.5 | Very low | 27.7 | Very low | 149 Ų | 149 | 139.2 Ų | 139.2 | 78% | 0.78 | 76% | 0.758 | S | S | * | * | trans | 65.6 | 108.9 | 164.8 | -75.7 | 90.7 | 0 | 0 | 0 | 120 | ||||
| 334 | S | 24 | Very low | 27.4 | Very low | 98 Ų | 98 | 137.2 Ų | 137.2 | 69% | 0.685 | 76% | 0.757 | S | S | * | * | 77.9 | 102.4 | 74.5 | -175 | 0 | 0 | 0 | 0 | 111.8 | |||||
| 335 | T | 26.1 | Very low | 27.1 | Very low | 121 Ų | 121 | 138 Ų | 138 | 74% | 0.742 | 76% | 0.763 | S | S | * | * | 177.8 | 124.3 | 84.9 | 30.3 | 0 | 0 | 0 | 0 | 106.9 | |||||
| 336 | S | 25.8 | Very low | 27 | Very low | 97 Ų | 97 | 136 Ų | 136 | 68% | 0.678 | 76% | 0.762 | S | S | * | * | 87.8 | 120.7 | 96.4 | -56.7 | 0 | 0 | 0 | 0 | 115.5 | |||||
| 337 | D | 26.6 | Very low | 27.6 | Very low | 162 Ų | 162 | 136.4 Ų | 136.4 | 87% | 0.866 | 77% | 0.765 | S | S | * | * | trans | 88.1 | 112 | 142.2 | -54.3 | -23.8 | 0 | 0 | 0 | 122.5 | ||||
| 338 | T | 27.1 | Very low | 27.7 | Very low | 136 Ų | 136 | 132.8 Ų | 132.8 | 83% | 0.834 | 77% | 0.767 | S | S | * | * | trans | -85.6 | 132.8 | 153.9 | 45.8 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 339 | C | 26.8 | Very low | 27.6 | Very low | 123 Ų | 123 | 130.5 Ų | 130.5 | 83% | 0.831 | 77% | 0.771 | S | S | * | * | trans | -159.1 | 117.7 | 152.3 | -93.2 | 0 | 0 | 0 | 0 | 107.1 | ||||
| 340 | V | 24.8 | Very low | 27.5 | Very low | 125 Ų | 125 | 128.9 Ų | 128.9 | 76% | 0.758 | 79% | 0.785 | S | S | * | * | 71.9 | 119.8 | 79.1 | -179.7 | 0 | 0 | 0 | 0 | 114.3 | |||||
| 341 | E | 24.6 | Very low | 27.5 | Very low | 155 Ų | 155 | 126.7 Ų | 126.7 | 72% | 0.724 | 78% | 0.783 | S | S | * | * | trans | 74.7 | 116.3 | 153.7 | -82.9 | -172.6 | 123.6 | 0 | 0 | 124.3 | ||||
| 342 | Q | 23.3 | Very low | 27.4 | Very low | 155 Ų | 155 | 126.4 Ų | 126.4 | 72% | 0.724 | 78% | 0.782 | S | S | * | * | 87.5 | 126.2 | 110.2 | -160.7 | 161.6 | 67.4 | 0 | 0 | 121.4 | |||||
| 343 | S | 22.9 | Very low | 27.6 | Very low | 88 Ų | 88 | 128.2 Ų | 128.2 | 62% | 0.615 | 78% | 0.779 | S | S | * | * | trans | 82 | 116.9 | 144.5 | -70.1 | 0 | 0 | 0 | 0 | 123.5 | ||||
| 344 | H | 26.4 | Very low | 27.6 | Very low | 178 Ų | 178 | 125.1 Ų | 125.1 | 82% | 0.824 | 77% | 0.77 | S | S | * | * | trans | 66.9 | 139.8 | 132 | -75.2 | -76 | 0 | 0 | 0 | 123.3 | ||||
| 345 | S | 24.8 | Very low | 27.8 | Very low | 116 Ų | 116 | 126.7 Ų | 126.7 | 81% | 0.811 | 77% | 0.771 | S | S | * | * | trans | 95.6 | 110.6 | 146.3 | 68.3 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 346 | S | 28.9 | Very low | 28 | Very low | 114 Ų | 114 | 126.5 Ų | 126.5 | 80% | 0.797 | 77% | 0.769 | S | S | * | * | trans | -67 | 169.4 | 145.7 | -66.3 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 347 | P | 43.1 | Very low | 29 | Very low | 125 Ų | 125 | 126.9 Ų | 126.9 | 81% | 0.812 | 77% | 0.77 | S | S | * | * | cis | -149.1 | 167.6 | 29.5 | 38.9 | -16.4 | 0 | 0 | 0 | 118.9 | ||||
| 348 | G | 29.2 | Very low | 29.2 | Very low | 77 Ų | 77 | 123.9 Ų | 123.9 | 79% | 0.794 | 76% | 0.761 | S | S | * | * | trans | 74.8 | 122 | 134.5 | 0 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 349 | A | 30.9 | Very low | 29.5 | Very low | 110 Ų | 110 | 126.9 Ų | 126.9 | 91% | 0.909 | 76% | 0.757 | S | S | * | * | 145.4 | 133 | 105.9 | 0 | 0 | 0 | 0 | 0 | 115.6 | |||||
| 350 | G | 27.7 | Very low | 29.7 | Very low | 88 Ų | 88 | 130.6 Ų | 130.6 | 91% | 0.907 | 75% | 0.754 | S | S | * | * | trans | 100.7 | 120.5 | 148.2 | 0 | 0 | 0 | 0 | 0 | 116.1 | ||||
| 351 | G | 28.3 | Very low | 29.8 | Very low | 68 Ų | 68 | 128.9 Ų | 128.9 | 70% | 0.701 | 75% | 0.747 | S | S | * | * | cis | 145.7 | 155.8 | 5.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | ||||
| 352 | R | 29.4 | Very low | 30.2 | Very low | 223 Ų | 223 | 128.6 Ų | 128.6 | 84% | 0.842 | 75% | 0.749 | S | S | * | * | trans | 93.4 | 136.2 | 163.8 | -64.4 | 175.7 | -170 | -157.7 | 7.2 | 117.1 | ||||
| 353 | Y | 29.4 | Very low | 30.4 | Very low | 184 Ų | 184 | 126.3 Ų | 126.3 | 72% | 0.722 | 75% | 0.749 | S | S | * | * | cis | -163.3 | 144.9 | 9.3 | -123.6 | -59.7 | 0 | 0 | 0 | 109.9 | ||||
| 354 | S | 30 | Very low | 30.7 | Very low | 85 Ų | 85 | 128 Ų | 128 | 59% | 0.594 | 76% | 0.761 | S | S | * | * | trans | 33.7 | 145.8 | 139.3 | 53.2 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 355 | D | 26.7 | Very low | 30.8 | Very low | 130 Ų | 130 | 122.5 Ų | 122.5 | 70% | 0.695 | 75% | 0.753 | S | S | * | * | cis | -166.1 | 125.8 | 18.1 | -111 | -35.7 | 0 | 0 | 0 | 106.3 | ||||
| 356 | T | 31.4 | Very low | 31.1 | Very low | 117 Ų | 117 | 122.1 Ų | 122.1 | 72% | 0.718 | 76% | 0.757 | S | S | * | * | 54.6 | 157.5 | 99.3 | 69.1 | 0 | 0 | 0 | 0 | 116.7 | |||||
| 357 | P | 47 | Very low | 32.2 | Very low | 105 Ų | 105 | 122.6 Ų | 122.6 | 68% | 0.682 | 76% | 0.757 | S | S | * | * | cis | -143.1 | -179.7 | -47.6 | 39.2 | -22.7 | 0 | 0 | 0 | 114.4 | ||||
| 358 | S | 31.4 | Very low | 31.5 | Very low | 99 Ų | 99 | 128.8 Ų | 128.8 | 69% | 0.692 | 76% | 0.764 | S | S | * | * | trans | 87.7 | 143.3 | 140.6 | 85.3 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 359 | R | 32.5 | Very low | 31.4 | Very low | 199 Ų | 199 | 130.4 Ų | 130.4 | 75% | 0.751 | 76% | 0.763 | S | S | * | * | cis | -177.5 | 139.8 | -1.8 | -115.2 | 171.7 | 177.7 | -163 | -3.7 | 104.5 | ||||
| 360 | R | 30.8 | Very low | 31.3 | Very low | 201 Ų | 201 | 129.1 Ų | 129.1 | 76% | 0.758 | 75% | 0.753 | S | S | * | * | 144.6 | 150 | 90 | -110.8 | 166.1 | -164.1 | -141.8 | 7.8 | 105.6 | |||||
| 361 | C | 27.3 | Very low | 31.2 | Very low | 90 Ų | 90 | 132.2 Ų | 132.2 | 61% | 0.608 | 75% | 0.747 | S | S | * | * | cis | -179.4 | 149 | -9.4 | -117.8 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 362 | L | 31.8 | Very low | 31.1 | Very low | 149 Ų | 149 | 133.9 Ų | 133.9 | 78% | 0.78 | 75% | 0.747 | S | S | * | * | trans | 64.8 | 145 | 130.7 | -64.3 | 164.5 | 0 | 0 | 0 | 119.8 | ||||
| 363 | C | 27.7 | Very low | 31 | Very low | 106 Ų | 106 | 127.9 Ų | 127.9 | 72% | 0.716 | 74% | 0.74 | S | S | * | * | cis | 178.5 | 159.2 | -12.9 | -124.2 | 0 | 0 | 0 | 0 | 110.3 | ||||
| 364 | S | 30.3 | Very low | 30.9 | Very low | 124 Ų | 124 | 126.5 Ų | 126.5 | 87% | 0.867 | 75% | 0.75 | S | S | * | * | trans | 72.8 | 145.6 | 138.8 | -171.9 | 0 | 0 | 0 | 0 | 119.9 | ||||
| 365 | G | 28 | Very low | 30.8 | Very low | 63 Ų | 63 | 127.2 Ų | 127.2 | 65% | 0.649 | 76% | 0.755 | S | S | * | * | cis | 164.4 | 161.2 | 1.1 | 0 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 366 | A | 31.2 | Very low | 30.9 | Very low | 108 Ų | 108 | 127.8 Ų | 127.8 | 89% | 0.893 | 76% | 0.764 | S | S | * | * | trans | 76.9 | 149.2 | 157.3 | 0 | 0 | 0 | 0 | 0 | 123.2 | ||||
| 367 | P | 52.8 | Low | 30.8 | Very low | 123 Ų | 123 | 125 Ų | 125 | 80% | 0.799 | 76% | 0.758 | S | S | * | * | trans | -108.1 | 161.2 | 178.4 | 40.4 | -31.6 | 0 | 0 | 0 | 114.9 | ||||
| 368 | R | 28.2 | Very low | 29.8 | Very low | 255 Ų | 255 | 127.6 Ų | 127.6 | 96% | 0.962 | 77% | 0.765 | S | S | * | * | trans | -176.4 | 167.9 | 157.2 | -106.3 | 171.7 | -175.8 | -170.8 | 1.6 | 113.9 | ||||
| 369 | S | 27.1 | Very low | 29.7 | Very low | 111 Ų | 111 | 131 Ų | 131 | 78% | 0.776 | 77% | 0.77 | S | S | * | * | trans | -88.4 | 167 | -164.5 | 49.7 | 0 | 0 | 0 | 0 | 119 | ||||
| 370 | A | 28 | Very low | 29.3 | Very low | 84 Ų | 84 | 126.2 Ų | 126.2 | 69% | 0.694 | 77% | 0.767 | S | S | * | * | trans | 104.1 | 126.1 | 142.7 | 0 | 0 | 0 | 0 | 0 | 122.5 | ||||
| 371 | I | 25.9 | Very low | 29.2 | Very low | 153 Ų | 153 | 124.2 Ų | 124.2 | 79% | 0.785 | 77% | 0.771 | S | S | * | * | trans | 77.4 | 118.6 | 138.1 | -62.4 | 165.5 | 0 | 0 | 0 | 122.4 | ||||
| 372 | S | 25.6 | Very low | 29.3 | Very low | 102 Ų | 102 | 124 Ų | 124 | 71% | 0.713 | 77% | 0.77 | S | S | * | * | trans | 43 | 161.6 | 138.5 | 94.6 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 373 | S | 28.3 | Very low | 29.2 | Very low | 97 Ų | 97 | 123.1 Ų | 123.1 | 68% | 0.678 | 77% | 0.771 | S | S | * | * | cis | 173.9 | 138.7 | -9 | 41.1 | 0 | 0 | 0 | 0 | 105.9 | ||||
| 374 | V | 26.9 | Very low | 29.3 | Very low | 155 Ų | 155 | 128.4 Ų | 128.4 | 94% | 0.939 | 78% | 0.782 | S | S | * | * | trans | -149.7 | 137.1 | 146.8 | 179.7 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 375 | S | 27.3 | Very low | 29.3 | Very low | 101 Ų | 101 | 134.1 Ų | 134.1 | 71% | 0.706 | 79% | 0.785 | S | S | * | * | trans | -116.7 | 155.4 | -178.1 | 162.6 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 376 | T | 30.3 | Very low | 29.3 | Very low | 142 Ų | 142 | 134 Ų | 134 | 87% | 0.871 | 78% | 0.784 | S | S | * | * | trans | -150.5 | 123.8 | 146.2 | 48 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 377 | G | 27.9 | Very low | 29.3 | Very low | 58 Ų | 58 | 136.6 Ų | 136.6 | 60% | 0.598 | 78% | 0.782 | S | S | * | * | cis | 109.7 | 102.1 | 13.4 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 378 | L | 27.5 | Very low | 28.2 | Very low | 160 Ų | 160 | 138 Ų | 138 | 84% | 0.838 | 78% | 0.779 | S | S | * | * | 172.3 | 116.9 | 128.1 | -105.3 | 123.5 | 0 | 0 | 0 | 115.3 | |||||
| 379 | H | 27.7 | Very low | 28.3 | Very low | 170 Ų | 170 | 134.4 Ų | 134.4 | 79% | 0.787 | 77% | 0.771 | S | S | * | * | trans | 52.6 | 154.3 | 137.1 | -70.2 | -108 | 0 | 0 | 0 | 122.9 | ||||
| 380 | S | 25.6 | Very low | 28.5 | Very low | 98 Ų | 98 | 141 Ų | 141 | 69% | 0.685 | 78% | 0.779 | S | S | * | * | cis | 164 | 139.9 | -20.6 | 178 | 0 | 0 | 0 | 0 | 105.7 | ||||
| 381 | L | 28.3 | Very low | 29.1 | Very low | 160 Ų | 160 | 148.6 Ų | 148.6 | 84% | 0.838 | 79% | 0.79 | S | S | * | * | trans | 168.5 | 91.3 | 153.3 | -92.3 | 164.1 | 0 | 0 | 0 | 107.3 | ||||
| 382 | S | 29 | Very low | 29.4 | Very low | 85 Ų | 85 | 146.4 Ų | 146.4 | 59% | 0.594 | 79% | 0.788 | S | S | * | * | 77 | 104.6 | 86.3 | 75.6 | 0 | 0 | 0 | 0 | 116.1 | |||||
| 383 | T | 30.3 | Very low | 29.8 | Very low | 130 Ų | 130 | 146.4 Ų | 146.4 | 80% | 0.798 | 79% | 0.788 | S | S | * | * | 43.5 | 122.9 | 129.6 | 48 | 0 | 0 | 0 | 0 | 121.8 | |||||
| 384 | F | 28.6 | Very low | 30.6 | Very low | 217 Ų | 217 | 152.1 Ų | 152.1 | 95% | 0.952 | 82% | 0.818 | S | S | * | * | -139.2 | 122.9 | 125.8 | -132.4 | -93.8 | 0 | 0 | 0 | 110.6 | |||||
| 385 | R | 30.3 | Very low | 30.8 | Very low | 244 Ų | 244 | 152 Ų | 152 | 92% | 0.921 | 81% | 0.812 | S | S | * | * | trans | -127.3 | 134.3 | 176.4 | -166.9 | -172.1 | -161.8 | -165.9 | 6.8 | 106.9 | ||||
| 386 | G | 27.8 | Very low | 31 | Very low | 62 Ų | 62 | 154.7 Ų | 154.7 | 64% | 0.639 | 82% | 0.818 | S | S | * | * | trans | 144.2 | 138.6 | 167.1 | 0 | 0 | 0 | 0 | 0 | 110.8 | ||||
| 387 | L | 31.5 | Very low | 31 | Very low | 162 Ų | 162 | 155.4 Ų | 155.4 | 85% | 0.848 | 82% | 0.815 | S | S | * | * | cis | -170.6 | 137.2 | 0.3 | -122.3 | 150.7 | 0 | 0 | 0 | 106.4 | ||||
| 388 | M | 30.1 | Very low | 31.2 | Very low | 151 Ų | 151 | 161.1 Ų | 161.1 | 74% | 0.744 | 83% | 0.827 | S | S | * | * | trans | 36.5 | 123.8 | 145.1 | -82.4 | -157.4 | 178.1 | 0 | 0 | 123.9 | ||||
| 389 | K | 29.4 | Very low | 31.5 | Very low | 181 Ų | 181 | 161.2 Ų | 161.2 | 79% | 0.787 | 83% | 0.827 | S | S | * | * | 65.9 | 111.1 | 109.2 | -153.5 | -179.2 | -168.5 | 179.6 | 0 | 118.6 | |||||
| 390 | R | 32.7 | Very low | 31.7 | Very low | 250 Ų | 250 | 160.6 Ų | 160.6 | 94% | 0.943 | 83% | 0.829 | S | S | * | * | trans | -162.2 | 135.1 | 131.5 | -125 | 176.7 | -176.1 | -168.4 | 0.3 | 114.4 | ||||
| 391 | R | 40.3 | Very low | 32.1 | Very low | 243 Ų | 243 | 165.1 Ų | 165.1 | 92% | 0.917 | 84% | 0.84 | S | S | * | * | trans | -58.7 | 151.7 | 161.9 | -73.5 | 173.1 | 167.1 | 175.1 | -5.8 | 111 | ||||
| 392 | S | 31.7 | Very low | 32.4 | Very low | 107 Ų | 107 | 165.5 Ų | 165.5 | 75% | 0.748 | 84% | 0.84 | S | S | * | * | 171.6 | 136.3 | 102.4 | -165.3 | 0 | 0 | 0 | 0 | 111.2 | |||||
| 393 | S | 35.3 | Very low | 32.7 | Very low | 101 Ų | 101 | 172.2 Ų | 172.2 | 71% | 0.706 | 86% | 0.86 | S | S | * | * | trans | -52.2 | 145.1 | 152.1 | 46.7 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 394 | V | 44.8 | Very low | 33 | Very low | 218 Ų | 218 | 176 Ų | 176 | 100% | 1.321 | 87% | 0.866 | S | S | * | * | -134.5 | 0 | 129 | 177.1 | 0 | 0 | 0 | 0 | 106.3 |
Retrieved 394 of 394 residues in 94.9 ms
(Link to these results)