| 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 | 72.2 | Confident | 82.5 | Confident | 47 Ų | 47 | 71.3 Ų | 71.3 | 23% | 0.232 | 35% | 0.348 | C | S | . | . | 0 | -56.5 | 0 | -168.7 | -80.9 | -78 | 0 | 0 | 109.5 | T3 L4 Y5 L51 E58 A66 | M1-T3 PolarHBondContact O-N 2.74Å; M1-L4 PolarHBondContact O-N 2.91Å; M1-Y5 WeakPolarHBondContact O-CB 3.22Å; M1-Y5 PolarHBondContact O-N 3.15Å; M1-L51 HydrophobicContact CG-CD1 4.05Å; M1-L51 WeakPolarHBondContact O-CD1 3.41Å; M1-L51 HydrophobicContact SD-CD1 4.35Å; M1-E58 WeakPolarHBondContact CB-OE1 3.25Å; M1-E58 WeakPolarHBondContact CE-OE1 3.36Å; M1-E58 VanDerWaalsContact CG-OE1 3.29Å; M1-E58 WeakPolarHBondContact CG-OE1 3.32Å; M1-A66 HydrophobicContact CE-CB 3.84Å | |||
| 2 | E | 75.9 | Confident | 82.9 | Confident | 125 Ų | 125 | 65.5 Ų | 65.5 | 58% | 0.584 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -60.2 | -41.5 | -179.1 | -71.5 | -177.9 | 148.8 | 0 | 0 | 115.5 | L4 Y5 H6 | E2-L4 PolarHBondContact O-N 3.02Å; E2-Y5 WeakPolarHBondContact O-CB 3.03Å; E2-Y5 PolarHBondContact O-N 3.11Å; E2-H6 PolarHBondContact O-CD2 3.3Å; E2-H6 PolarHBondContact O-N 3.07Å |
| 3 | T | 80.5 | Confident | 83.3 | Confident | 120 Ų | 120 | 69.2 Ų | 69.2 | 74% | 0.736 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -62.3 | -45.9 | 178.8 | 51.3 | 0 | 0 | 0 | 0 | 112.2 | M1 H6 Q7 | M1-T3 PolarHBondContact O-N 2.74Å; T3-H6 PolarHBondContact O-N 2.96Å; T3-Q7 WeakPolarHBondContact O-CB 3.43Å; T3-Q7 PolarHBondContact O-N 2.8Å |
| 4 | L | 79.9 | Confident | 83.5 | Confident | 25 Ų | 25 | 69.4 Ų | 69.4 | 13% | 0.131 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -65.9 | -39.3 | 176.9 | -171 | 67.6 | 0 | 0 | 0 | 111 | M1 E2 Q7 T8 R50 L51 L54 | M1-L4 PolarHBondContact O-N 2.91Å; E2-L4 PolarHBondContact O-N 3.02Å; L4-Q7 PolarHBondContact O-N 2.67Å; L4-T8 WeakPolarHBondContact O-CB 3.5Å; L4-T8 PolarHBondContact O-N 3.08Å; L4-T8 PolarHBondContact O-OG1 3.07Å; L4-R50 HydrophobicContact CD2-CB 4.27Å; L4-R50 HydrophobicContact CD2-CG 4.38Å; L4-L51 HydrophobicContact CB-CD1 4.06Å; L4-L51 HydrophobicContact CD2-CB 4.08Å; L4-L51 HydrophobicContact CD2-CD1 4.01Å; L4-L51 HydrophobicContact CG-CD1 4.19Å; L4-L54 HydrophobicContact CD2-CD1 3.98Å |
| 5 | Y | 80.4 | Confident | 83.7 | Confident | 32 Ų | 32 | 64.8 Ų | 64.8 | 13% | 0.125 | 31% | 0.314 | C | S | . | . | H | α-helix | trans | -59.5 | -48.6 | 175.8 | 176 | -96.5 | 0 | 0 | 0 | 112.4 | M1 E2 Q7 T8 N9 L51 R69 L73 | M1-Y5 WeakPolarHBondContact O-CB 3.22Å; M1-Y5 PolarHBondContact O-N 3.15Å; E2-Y5 WeakPolarHBondContact O-CB 3.03Å; E2-Y5 PolarHBondContact O-N 3.11Å; Y5-Q7 VanDerWaalsContact C-N 3.33Å; Y5-Q7 PolarHBondContact O-N 3.14Å; Y5-T8 PolarHBondContact O-N 2.95Å; Y5-N9 WeakPolarHBondContact O-CB 3.25Å; Y5-N9 PolarHBondContact O-N 3.29Å; Y5-L51 HydrophobicContact CD2-CD2 4.04Å; Y5-R69 HydrophobicContact CD2-CB 4.38Å; Y5-R69 HydrophobicContact CE2-CB 3.73Å; Y5-R69 HydrophobicContact CE2-CG 4.34Å; Y5-L73 HydrophobicContact CD2-CD1 4.27Å; Y5-L73 HydrophobicContact CD2-CD2 3.71Å; Y5-L73 HydrophobicContact CE2-CD1 3.37Å; Y5-L73 HydrophobicContact CE2-CD2 3.68Å; Y5-L73 HydrophobicContact CE2-CG 4.16Å |
| 6 | H | 85.3 | Confident | 83.8 | Confident | 119 Ų | 119 | 66.4 Ų | 66.4 | 55% | 0.551 | 32% | 0.32 | S | S | * | . | H | α-helix | trans | -64.9 | -38.4 | 177.9 | -73.1 | -53 | 0 | 0 | 0 | 112.5 | E2 T3 N9 K10 | E2-H6 PolarHBondContact O-CD2 3.3Å; E2-H6 PolarHBondContact O-N 3.07Å; T3-H6 PolarHBondContact O-N 2.96Å; H6-N9 PolarHBondContact O-N 2.93Å; H6-K10 WeakPolarHBondContact O-CB 3.41Å; H6-K10 PolarHBondContact O-N 2.89Å |
| 7 | Q | 86.4 | Confident | 83.8 | Confident | 105 Ų | 105 | 66.9 Ų | 66.9 | 49% | 0.491 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -62.6 | -48.9 | 175.2 | -174.9 | 177.5 | -2.3 | 0 | 0 | 111.5 | T3 L4 Y5 N9 K10 Q11 | T3-Q7 WeakPolarHBondContact O-CB 3.43Å; T3-Q7 PolarHBondContact O-N 2.8Å; L4-Q7 PolarHBondContact O-N 2.67Å; Y5-Q7 VanDerWaalsContact C-N 3.33Å; Y5-Q7 PolarHBondContact O-N 3.14Å; Q7-N9 VanDerWaalsContact C-N 3.33Å; Q7-N9 PolarHBondContact O-N 3.43Å; Q7-K10 PolarHBondContact O-N 3.28Å; Q7-Q11 WeakPolarHBondContact O-CG 3.35Å; Q7-Q11 PolarHBondContact O-N 3.03Å |
| 8 | T | 84.6 | Confident | 83.6 | Confident | 0 Ų | 0 | 64.3 Ų | 64.3 | 0% | 0 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -61.4 | -42.4 | 177.6 | -55.2 | 0 | 0 | 0 | 0 | 111.4 | L4 Y5 K10 Q11 I12 I44 L48 L73 | L4-T8 WeakPolarHBondContact O-CB 3.5Å; L4-T8 PolarHBondContact O-N 3.08Å; L4-T8 PolarHBondContact O-OG1 3.07Å; Y5-T8 PolarHBondContact O-N 2.95Å; T8-K10 PolarHBondContact O-N 3.36Å; T8-Q11 PolarHBondContact O-N 2.96Å; T8-I12 HydrophobicContact CG2-CD1 4.15Å; T8-I12 WeakPolarHBondContact O-CG1 3.26Å; T8-I12 PolarHBondContact O-N 3.38Å; T8-I44 HydrophobicContact CG2-CG2 3.91Å; T8-L48 HydrophobicContact CG2-CG 4.48Å; T8-L73 HydrophobicContact CG2-CD2 3.94Å |
| 9 | N | 86.8 | Confident | 83.3 | Confident | 46 Ų | 46 | 62.5 Ų | 62.5 | 25% | 0.246 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -64 | -40.4 | 178.1 | -165.7 | 21.5 | 0 | 0 | 0 | 112.2 | Y5 H6 Q7 I12 Q13 | Y5-N9 WeakPolarHBondContact O-CB 3.25Å; Y5-N9 PolarHBondContact O-N 3.29Å; H6-N9 PolarHBondContact O-N 2.93Å; Q7-N9 VanDerWaalsContact C-N 3.33Å; Q7-N9 PolarHBondContact O-N 3.43Å; N9-I12 PolarHBondContact O-N 3.33Å; N9-Q13 WeakPolarHBondContact O-CG 3.49Å; N9-Q13 PolarHBondContact O-N 2.8Å; N9-Q13 VanDerWaalsContact O-N 3.08Å |
| 10 | K | 89.4 | Confident | 83.1 | Confident | 131 Ų | 131 | 61.3 Ų | 61.3 | 57% | 0.57 | 32% | 0.315 | S | S | * | . | H | α-helix | trans | -61.4 | -44.6 | 173.4 | -173.3 | -175 | 175.4 | -170.2 | 0 | 111.4 | H6 Q7 T8 I12 Q13 E14 | H6-K10 WeakPolarHBondContact O-CB 3.41Å; H6-K10 PolarHBondContact O-N 2.89Å; Q7-K10 PolarHBondContact O-N 3.28Å; T8-K10 PolarHBondContact O-N 3.36Å; K10-I12 VanDerWaalsContact C-N 3.31Å; K10-I12 PolarHBondContact O-N 2.9Å; K10-Q13 PolarHBondContact O-N 2.84Å; K10-E14 VanDerWaalsContact CE-OE1 3.31Å; K10-E14 WeakPolarHBondContact CE-OE1 3.45Å; K10-E14 WeakPolarHBondContact O-CG 3.22Å; K10-E14 PolarHBondContact O-N 3.21Å |
| 11 | Q | 86.1 | Confident | 82.9 | Confident | 34 Ų | 34 | 65.4 Ų | 65.4 | 16% | 0.159 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -62.1 | -37.7 | 176.8 | -70.4 | -176.5 | -61.3 | 0 | 0 | 112.3 | Q7 T8 E14 V15 I44 H47 | Q7-Q11 WeakPolarHBondContact O-CG 3.35Å; Q7-Q11 PolarHBondContact O-N 3.03Å; T8-Q11 PolarHBondContact O-N 2.96Å; Q11-E14 PolarHBondContact O-N 3.33Å; Q11-V15 WeakPolarHBondContact O-CG2 3.42Å; Q11-V15 PolarHBondContact O-N 2.86Å; Q11-I44 HydrophobicContact CB-CD1 3.85Å; Q11-I44 HydrophobicContact CB-CG1 3.79Å; Q11-H47 PolarHBondContact OE1-CE1 3.35Å; Q11-H47 PolarHBondContact OE1-ND1 2.93Å |
| 12 | I | 87.1 | Confident | 83 | Confident | 2 Ų | 2 | 63.3 Ų | 63.3 | 1% | 0.01 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -61.9 | -45.4 | 174.9 | -72.6 | 166.6 | 0 | 0 | 0 | 111 | T8 N9 K10 E14 V15 Q16 I44 L73 V77 L80 | T8-I12 HydrophobicContact CG2-CD1 4.15Å; T8-I12 WeakPolarHBondContact O-CG1 3.26Å; T8-I12 PolarHBondContact O-N 3.38Å; N9-I12 PolarHBondContact O-N 3.33Å; K10-I12 VanDerWaalsContact C-N 3.31Å; K10-I12 PolarHBondContact O-N 2.9Å; I12-E14 VanDerWaalsContact C-N 3.34Å; I12-E14 PolarHBondContact O-N 3.14Å; I12-V15 PolarHBondContact O-N 3.42Å; I12-Q16 WeakPolarHBondContact O-CG 3.48Å; I12-Q16 PolarHBondContact O-N 2.93Å; I12-I44 HydrophobicContact CD1-CG2 4.37Å; I12-I44 HydrophobicContact CG1-CD1 4.17Å; I12-I44 HydrophobicContact CG1-CG2 4.02Å; I12-L73 HydrophobicContact CD1-CB 4.29Å; I12-L73 HydrophobicContact CD1-CD2 4.38Å; I12-L73 HydrophobicContact CD1-CG 3.86Å; I12-V77 HydrophobicContact CD1-CG2 3.57Å; I12-V77 HydrophobicContact CG1-CG2 3.76Å; I12-L80 HydrophobicContact CG2-CD1 3.92Å |
| 13 | Q | 88.1 | Confident | 82.7 | Confident | 113 Ų | 113 | 64.4 Ų | 64.4 | 53% | 0.528 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -64.1 | -38.4 | 177.2 | -69.9 | -179.5 | -5.8 | 0 | 0 | 112.3 | N9 K10 Q16 S17 | N9-Q13 WeakPolarHBondContact O-CG 3.49Å; N9-Q13 PolarHBondContact O-N 2.8Å; N9-Q13 VanDerWaalsContact O-N 3.08Å; K10-Q13 PolarHBondContact O-N 2.84Å; Q13-Q16 PolarHBondContact O-N 3.38Å; Q13-S17 PolarHBondContact O-N 2.97Å |
| 14 | E | 86.8 | Confident | 82.5 | Confident | 72 Ų | 72 | 65.5 Ų | 65.5 | 34% | 0.336 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -61.7 | -45 | 173.3 | -73.6 | 176.1 | -164.9 | 0 | 0 | 111.4 | K10 Q11 I12 Q16 S17 L18 R40 | K10-E14 VanDerWaalsContact CE-OE1 3.31Å; K10-E14 WeakPolarHBondContact CE-OE1 3.45Å; K10-E14 WeakPolarHBondContact O-CG 3.22Å; K10-E14 PolarHBondContact O-N 3.21Å; Q11-E14 PolarHBondContact O-N 3.33Å; I12-E14 VanDerWaalsContact C-N 3.34Å; I12-E14 PolarHBondContact O-N 3.14Å; E14-Q16 VanDerWaalsContact C-N 3.35Å; E14-Q16 PolarHBondContact O-N 3.39Å; E14-S17 WeakPolarHBondContact O-CB 3.5Å; E14-S17 PolarHBondContact O-N 2.76Å; E14-L18 VanDerWaalsContact O-CG 3.32Å; E14-L18 WeakPolarHBondContact O-CG 3.47Å; E14-L18 PolarHBondContact O-N 3.42Å; E14-R40 IonicContact OE2-NH1 3.3Å; E14-R40 PolarHBondContact OE2-NH1 3.36Å |
| 15 | V | 86.4 | Confident | 82.3 | Confident | 1 Ų | 1 | 66.3 Ų | 66.3 | 1% | 0.006 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -61.8 | -41.6 | 176.3 | 168.3 | 0 | 0 | 0 | 0 | 111.4 | Q11 I12 S17 L18 M19 L37 R40 I41 I44 L80 | Q11-V15 WeakPolarHBondContact O-CG2 3.42Å; Q11-V15 PolarHBondContact O-N 2.86Å; I12-V15 PolarHBondContact O-N 3.42Å; V15-S17 PolarHBondContact O-N 2.77Å; V15-L18 PolarHBondContact O-N 3.29Å; V15-M19 VanDerWaalsContact O-CB 3.3Å; V15-M19 WeakPolarHBondContact O-CB 3.47Å; V15-M19 PolarHBondContact O-N 3.34Å; V15-L37 HydrophobicContact CB-CD2 4.41Å; V15-L37 HydrophobicContact CG1-CD2 3.79Å; V15-R40 HydrophobicContact CG2-CB 3.88Å; V15-I41 HydrophobicContact CG1-CD1 4.31Å; V15-I41 HydrophobicContact CG1-CG1 3.99Å; V15-I44 HydrophobicContact CG2-CD1 3.73Å; V15-L80 HydrophobicContact CG1-CD1 4.07Å |
| 16 | Q | 84.4 | Confident | 82 | Confident | 90 Ų | 90 | 70.7 Ų | 70.7 | 42% | 0.421 | 35% | 0.354 | S | S | . | . | H | α-helix | trans | -60.2 | -44.4 | 174.2 | -77.5 | 172.1 | -8.3 | 0 | 0 | 112.2 | I12 Q13 E14 M19 G20 L80 | I12-Q16 WeakPolarHBondContact O-CG 3.48Å; I12-Q16 PolarHBondContact O-N 2.93Å; Q13-Q16 PolarHBondContact O-N 3.38Å; E14-Q16 VanDerWaalsContact C-N 3.35Å; E14-Q16 PolarHBondContact O-N 3.39Å; Q16-M19 PolarHBondContact O-N 2.91Å; Q16-G20 PolarHBondContact O-N 3.47Å; Q16-L80 HydrophobicContact CG-CD1 3.98Å; Q16-L80 HydrophobicContact CG-CD2 3.54Å; Q16-L80 HydrophobicContact CG-CG 4.32Å |
| 17 | S | 84.2 | Confident | 81.2 | Confident | 75 Ų | 75 | 73 Ų | 73 | 52% | 0.524 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -62.7 | -44.9 | 176.4 | 176.5 | 0 | 0 | 0 | 0 | 111.9 | Q13 E14 V15 M19 G20 R21 | Q13-S17 PolarHBondContact O-N 2.97Å; E14-S17 WeakPolarHBondContact O-CB 3.5Å; E14-S17 PolarHBondContact O-N 2.76Å; V15-S17 PolarHBondContact O-N 2.77Å; S17-M19 VanDerWaalsContact C-N 3.32Å; S17-M19 PolarHBondContact O-N 3.21Å; S17-G20 PolarHBondContact O-N 3.24Å; S17-R21 WeakPolarHBondContact O-CG 3.49Å; S17-R21 PolarHBondContact O-N 3.18Å |
| 18 | L | 80.1 | Confident | 80.4 | Confident | 21 Ų | 21 | 76.2 Ų | 76.2 | 11% | 0.11 | 37% | 0.373 | C | S | . | . | H | α-helix | trans | -63.3 | -38.3 | 176.8 | -71 | 172.2 | 0 | 0 | 0 | 111.8 | E14 V15 R21 L22 L33 L37 | E14-L18 VanDerWaalsContact O-CG 3.32Å; E14-L18 WeakPolarHBondContact O-CG 3.47Å; E14-L18 PolarHBondContact O-N 3.42Å; V15-L18 PolarHBondContact O-N 3.29Å; L18-R21 CarbonylContact O-C 3.56Å; L18-R21 WeakPolarHBondContact O-CB 3.33Å; L18-R21 PolarHBondContact O-N 3.21Å; L18-L22 PolarHBondContact O-N 3.19Å; L18-L33 HydrophobicContact CD2-CD1 4.36Å; L18-L37 HydrophobicContact CB-CD2 3.73Å; L18-L37 HydrophobicContact CB-CG 4.32Å; L18-L37 HydrophobicContact CD1-CD2 4.49Å |
| 19 | M | 77.9 | Confident | 80.1 | Confident | 29 Ų | 29 | 78.6 Ų | 78.6 | 14% | 0.143 | 39% | 0.39 | C | S | . | . | H | α-helix | trans | -66.3 | -38.1 | 175.3 | -174.3 | 164.7 | -92.8 | 0 | 0 | 112.3 | V15 Q16 S17 R21 L22 L80 A83 L84 | V15-M19 VanDerWaalsContact O-CB 3.3Å; V15-M19 WeakPolarHBondContact O-CB 3.47Å; V15-M19 PolarHBondContact O-N 3.34Å; Q16-M19 PolarHBondContact O-N 2.91Å; S17-M19 VanDerWaalsContact C-N 3.32Å; S17-M19 PolarHBondContact O-N 3.21Å; M19-R21 VanDerWaalsContact C-N 3.28Å; M19-R21 PolarHBondContact O-N 3.05Å; M19-L22 VanDerWaalsContact O-CB 3.22Å; M19-L22 WeakPolarHBondContact O-CB 3.46Å; M19-L22 PolarHBondContact O-N 3.18Å; M19-L80 WeakPolarHBondContact CE-O 3.22Å; M19-L80 HydrophobicContact SD-CD2 3.97Å; M19-A83 HydrophobicContact CE-CB 4.1Å; M19-A83 HydrophobicContact SD-CB 3.7Å; M19-L84 VanDerWaalsContact CE-CA 3.49Å; M19-L84 HydrophobicContact CE-CB 3.5Å; M19-L84 HydrophobicContact CE-CD1 4Å; M19-L84 HydrophobicContact CE-CG 4.31Å; M19-L84 VanDerWaalsContact CE-N 3.34Å |
| 20 | G | 79.5 | Confident | 79.7 | Confident | 38 Ų | 38 | 76.9 Ų | 76.9 | 39% | 0.392 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -66.3 | -29.1 | 171.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | Q16 S17 N24 | Q16-G20 PolarHBondContact O-N 3.47Å; S17-G20 PolarHBondContact O-N 3.24Å; G20-N24 PolarHBondContact O-ND2 3.07Å |
| 21 | R | 78.3 | Confident | 79.3 | Confident | 149 Ų | 149 | 74.4 Ų | 74.4 | 56% | 0.562 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -75.7 | -29.2 | 172.4 | -68.6 | 175.4 | 65.3 | -160.6 | -2.2 | 112.3 | S17 L18 M19 E23 N24 T25 | S17-R21 WeakPolarHBondContact O-CG 3.49Å; S17-R21 PolarHBondContact O-N 3.18Å; L18-R21 CarbonylContact O-C 3.56Å; L18-R21 WeakPolarHBondContact O-CB 3.33Å; L18-R21 PolarHBondContact O-N 3.21Å; M19-R21 VanDerWaalsContact C-N 3.28Å; M19-R21 PolarHBondContact O-N 3.05Å; R21-E23 PolarHBondContact O-N 3.27Å; R21-N24 PolarHBondContact O-N 2.91Å; R21-T25 WeakPolarHBondContact O-CB 3.39Å; R21-T25 PolarHBondContact O-N 3.35Å; R21-T25 VanDerWaalsContact O-N 3.14Å; R21-T25 PolarHBondContact O-OG1 2.89Å |
| 22 | L | 75.9 | Confident | 79.2 | Confident | 2 Ų | 2 | 79 Ų | 79 | 1% | 0.01 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -57.5 | -36.4 | 178.9 | -168.7 | 70.9 | 0 | 0 | 0 | 111.9 | L18 M19 N24 T25 V30 L33 E34 L37 L84 F87 | L18-L22 PolarHBondContact O-N 3.19Å; M19-L22 VanDerWaalsContact O-CB 3.22Å; M19-L22 WeakPolarHBondContact O-CB 3.46Å; M19-L22 PolarHBondContact O-N 3.18Å; L22-N24 VanDerWaalsContact C-N 3.25Å; L22-N24 PolarHBondContact O-N 2.93Å; L22-T25 PolarHBondContact O-N 2.75Å; L22-V30 HydrophobicContact CD1-CG1 4Å; L22-L33 HydrophobicContact CB-CD2 4.07Å; L22-L33 HydrophobicContact CD1-CB 3.82Å; L22-L33 HydrophobicContact CD1-CD2 3.62Å; L22-L33 HydrophobicContact CD1-CG 4.04Å; L22-L33 HydrophobicContact CG-CD2 4.47Å; L22-E34 HydrophobicContact CD1-CG 4.03Å; L22-E34 HydrophobicContact CD2-CG 4.24Å; L22-L37 HydrophobicContact CB-CD1 4.47Å; L22-L37 HydrophobicContact CD1-CD1 4.27Å; L22-L37 HydrophobicContact CD2-CD1 3.99Å; L22-L37 HydrophobicContact CG-CD1 4.49Å; L22-L84 HydrophobicContact CD2-CD1 4.13Å; L22-F87 HydrophobicContact CD1-CE1 4.36Å; L22-F87 HydrophobicContact CD2-CD1 3.48Å; L22-F87 VanDerWaalsContact CD2-CD1 3.48Å; L22-F87 HydrophobicContact CD2-CD2 4.35Å; L22-F87 HydrophobicContact CD2-CE1 3.57Å; L22-F87 HydrophobicContact CD2-CE2 4.41Å; L22-F87 HydrophobicContact CD2-CG 3.9Å; L22-F87 HydrophobicContact CD2-CZ 4.04Å; L22-F87 HydrophobicContact CG-CD1 4.13Å; L22-F87 HydrophobicContact CG-CE1 3.66Å; L22-F87 HydrophobicContact CG-CE2 4.41Å; L22-F87 HydrophobicContact CG-CZ 3.82Å |
| 23 | E | 69.6 | Low | 79 | Confident | 149 Ų | 149 | 80.1 Ų | 80.1 | 70% | 0.696 | 40% | 0.402 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -65.6 | -26.3 | 177.5 | -64 | -171.8 | 159.4 | 0 | 0 | 113.6 | R21 F87 | R21-E23 PolarHBondContact O-N 3.27Å; E23-F87 HydrophobicContact CG-CE2 4.29Å |
| 24 | N | 75.4 | Confident | 78.8 | Confident | 142 Ų | 142 | 75.2 Ų | 75.2 | 76% | 0.759 | 38% | 0.379 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -105.5 | 0.8 | -176.2 | -62.2 | -62.4 | 0 | 0 | 0 | 113.1 | G20 R21 L22 | G20-N24 PolarHBondContact O-ND2 3.07Å; R21-N24 PolarHBondContact O-N 2.91Å; L22-N24 VanDerWaalsContact C-N 3.25Å; L22-N24 PolarHBondContact O-N 2.93Å |
| 25 | T | 75.3 | Confident | 78.8 | Confident | 43 Ų | 43 | 77.1 Ų | 77.1 | 26% | 0.264 | 39% | 0.392 | S | S | . | . | S | Bend | trans | -89.4 | 147.5 | -173.5 | -64.7 | 0 | 0 | 0 | 0 | 111.1 | R21 L22 S29 V30 | R21-T25 WeakPolarHBondContact O-CB 3.39Å; R21-T25 PolarHBondContact O-N 3.35Å; R21-T25 VanDerWaalsContact O-N 3.14Å; R21-T25 PolarHBondContact O-OG1 2.89Å; L22-T25 PolarHBondContact O-N 2.75Å; T25-S29 WeakPolarHBondContact CG2-OG 3.43Å; T25-V30 HydrophobicContact CG2-CG2 4.12Å; T25-V30 VanDerWaalsContact O-CG2 3.25Å; T25-V30 WeakPolarHBondContact O-CG2 3.46Å |
| 26 | D | 74 | Confident | 78.8 | Confident | 124 Ų | 124 | 80.9 Ų | 80.9 | 66% | 0.663 | 41% | 0.409 | S | S | * | . | trans | -70.1 | 144.3 | -172.9 | -149.3 | -6.8 | 0 | 0 | 0 | 112.7 | Q28 S29 V30 | D26-Q28 PolarHBondContact O-N 3.4Å; D26-S29 PolarHBondContact O-N 2.85Å; D26-S29 PolarHBondContact O-OG 2.83Å; D26-V30 WeakPolarHBondContact O-CG2 3.32Å; D26-V30 PolarHBondContact O-N 2.66Å; D26-V30 VanDerWaalsContact O-N 3.08Å | ||
| 27 | R | 69.4 | Low | 79 | Confident | 166 Ų | 166 | 76.6 Ų | 76.6 | 63% | 0.626 | 39% | 0.389 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -50.3 | -33.4 | -167.2 | -104.7 | 179.2 | 170.1 | -173.8 | -7.7 | 114.1 | D98 | R27-D98 IonicContact CZ-OD2 3.74Å; R27-D98 IonicContact NH1-OD2 2.66Å; R27-D98 IonicContact NH2-OD2 3.4Å; R27-D98 PolarHBondContact NH2-OD2 3.29Å |
| 28 | Q | 69.9 | Low | 79.1 | Confident | 174 Ų | 174 | 75.6 Ų | 75.6 | 81% | 0.813 | 38% | 0.376 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.9 | -35.3 | -179.7 | -68.5 | 179.7 | -14.3 | 0 | 0 | 113.2 | D26 | D26-Q28 PolarHBondContact O-N 3.4Š|
| 29 | S | 77.1 | Confident | 79.4 | Confident | 50 Ų | 50 | 77 Ų | 77 | 35% | 0.35 | 39% | 0.39 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -88.2 | -17.5 | -178.1 | 56.9 | 0 | 0 | 0 | 0 | 113.9 | T25 D26 H31 L32 L33 | T25-S29 WeakPolarHBondContact CG2-OG 3.43Å; D26-S29 PolarHBondContact O-N 2.85Å; D26-S29 PolarHBondContact O-OG 2.83Å; S29-H31 VanDerWaalsContact C-N 3.28Å; S29-H31 PolarHBondContact O-N 3.43Å; S29-L32 PolarHBondContact O-N 3.49Å; S29-L33 PolarHBondContact O-N 2.86Å |
| 30 | V | 79.8 | Confident | 79.9 | Confident | 9 Ų | 9 | 79.3 Ų | 79.3 | 6% | 0.055 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -54.1 | -42.7 | 177.7 | 165.8 | 0 | 0 | 0 | 0 | 111.8 | L22 T25 D26 L32 L33 E34 F87 | L22-V30 HydrophobicContact CD1-CG1 4Å; T25-V30 HydrophobicContact CG2-CG2 4.12Å; T25-V30 VanDerWaalsContact O-CG2 3.25Å; T25-V30 WeakPolarHBondContact O-CG2 3.46Å; D26-V30 WeakPolarHBondContact O-CG2 3.32Å; D26-V30 PolarHBondContact O-N 2.66Å; D26-V30 VanDerWaalsContact O-N 3.08Å; V30-L32 PolarHBondContact O-N 3.25Å; V30-L33 PolarHBondContact O-N 2.89Å; V30-E34 HydrophobicContact CG1-CG 4.26Å; V30-E34 WeakPolarHBondContact O-CG 3.3Å; V30-E34 PolarHBondContact O-N 3.5Å; V30-F87 HydrophobicContact CG1-CE1 3.8Å; V30-F87 HydrophobicContact CG1-CZ 4.43Å |
| 31 | H | 80.1 | Confident | 80.2 | Confident | 80 Ų | 80 | 77.5 Ų | 77.5 | 37% | 0.37 | 38% | 0.379 | S | S | . | . | H | α-helix | trans | -63.7 | -38.1 | 180 | -74.3 | -60.1 | 0 | 0 | 0 | 114.6 | S29 L33 E34 N35 R91 | S29-H31 VanDerWaalsContact C-N 3.28Å; S29-H31 PolarHBondContact O-N 3.43Å; H31-L33 VanDerWaalsContact C-N 3.31Å; H31-E34 IonicContact ND1-OE2 2.8Å; H31-E34 PolarHBondContact ND1-OE2 3.16Å; H31-E34 PolarHBondContact O-N 3.5Å; H31-N35 PolarHBondContact O-N 3.09Å; H31-N35 PolarHBondContact O-ND2 2.98Å; H31-R91 PolarHBondContact CD2-NH1 2.96Å; H31-R91 PolarHBondContact CE1-NH1 3.44Å; H31-R91 PolarHBondContact CE1-NH2 3.33Å; H31-R91 PolarHBondContact ND1-NH1 3.26Å; H31-R91 PolarHBondContact NE2-NH1 2.92Å; H31-R91 PolarHBondContact NE2-NH2 2.89Å |
| 32 | L | 83.7 | Confident | 80.6 | Confident | 130 Ų | 130 | 74.1 Ų | 74.1 | 68% | 0.681 | 37% | 0.372 | S | S | * | . | H | α-helix | trans | -67.1 | -41 | 178 | -65.4 | 173.1 | 0 | 0 | 0 | 109.6 | S29 V30 N35 E36 | S29-L32 PolarHBondContact O-N 3.49Å; V30-L32 PolarHBondContact O-N 3.25Å; L32-N35 PolarHBondContact O-N 3.29Å; L32-E36 PolarHBondContact O-N 2.81Å |
| 33 | L | 83.7 | Confident | 81.2 | Confident | 25 Ų | 25 | 79.1 Ų | 79.1 | 13% | 0.131 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -67.8 | -37.6 | 176.8 | -158.4 | 73.7 | 0 | 0 | 0 | 112.1 | L18 L22 S29 V30 H31 E36 L37 | L18-L33 HydrophobicContact CD2-CD1 4.36Å; L22-L33 HydrophobicContact CB-CD2 4.07Å; L22-L33 HydrophobicContact CD1-CB 3.82Å; L22-L33 HydrophobicContact CD1-CD2 3.62Å; L22-L33 HydrophobicContact CD1-CG 4.04Å; L22-L33 HydrophobicContact CG-CD2 4.47Å; S29-L33 PolarHBondContact O-N 2.86Å; V30-L33 PolarHBondContact O-N 2.89Å; H31-L33 VanDerWaalsContact C-N 3.31Å; L33-E36 PolarHBondContact O-N 3.41Å; L33-L37 HydrophobicContact CG-CD1 4.34Å; L33-L37 VanDerWaalsContact O-CB 3.27Å; L33-L37 WeakPolarHBondContact O-CB 3.2Å; L33-L37 VanDerWaalsContact O-CG 3.31Å; L33-L37 WeakPolarHBondContact O-CG 3.47Å; L33-L37 PolarHBondContact O-N 3.29Å |
| 34 | E | 84.3 | Confident | 82 | Confident | 11 Ų | 11 | 72.1 Ų | 72.1 | 5% | 0.051 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -61 | -46.7 | 173.7 | -76 | 172.2 | 164.1 | 0 | 0 | 111.8 | L22 V30 H31 L37 Q38 L84 F87 Q88 | L22-E34 HydrophobicContact CD1-CG 4.03Å; L22-E34 HydrophobicContact CD2-CG 4.24Å; V30-E34 HydrophobicContact CG1-CG 4.26Å; V30-E34 WeakPolarHBondContact O-CG 3.3Å; V30-E34 PolarHBondContact O-N 3.5Å; H31-E34 IonicContact ND1-OE2 2.8Å; H31-E34 PolarHBondContact ND1-OE2 3.16Å; H31-E34 PolarHBondContact O-N 3.5Å; E34-L37 PolarHBondContact O-N 3.06Å; E34-Q38 WeakPolarHBondContact O-CB 3.23Å; E34-Q38 PolarHBondContact O-N 3.08Å; E34-L84 HydrophobicContact CG-CD1 4.37Å; E34-F87 WeakPolarHBondContact OE1-CD1 3.23Å; E34-Q88 HydrophobicContact CG-CG 4.33Å |
| 35 | N | 86.1 | Confident | 82.4 | Confident | 112 Ų | 112 | 67.6 Ų | 67.6 | 60% | 0.599 | 34% | 0.336 | S | S | * | . | H | α-helix | trans | -65 | -40.1 | 177.4 | -79.8 | -34.9 | 0 | 0 | 0 | 111.7 | H31 L32 Q38 A39 | H31-N35 PolarHBondContact O-N 3.09Å; H31-N35 PolarHBondContact O-ND2 2.98Å; L32-N35 PolarHBondContact O-N 3.29Å; N35-Q38 PolarHBondContact O-N 2.83Å; N35-A39 WeakPolarHBondContact O-CB 3.14Å; N35-A39 PolarHBondContact O-N 3.3Å |
| 36 | E | 87.3 | Confident | 82.8 | Confident | 80 Ų | 80 | 69 Ų | 69 | 37% | 0.374 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -64.1 | -44.6 | 174.2 | -169.7 | -173 | 163.3 | 0 | 0 | 111.6 | L32 L33 Q38 A39 R40 | L32-E36 PolarHBondContact O-N 2.81Å; L33-E36 PolarHBondContact O-N 3.41Å; E36-Q38 VanDerWaalsContact C-N 3.34Å; E36-Q38 PolarHBondContact O-N 2.84Å; E36-A39 PolarHBondContact O-N 2.83Å; E36-R40 WeakPolarHBondContact O-CG 3.31Å; E36-R40 PolarHBondContact O-N 3.34Å; E36-R40 IonicContact OE1-CZ 3.36Å; E36-R40 IonicContact OE1-NE 2.97Å; E36-R40 PolarHBondContact OE1-NE 3.42Å; E36-R40 IonicContact OE1-NH2 3.64Å; E36-R40 PolarHBondContact OE1-NH2 3.43Å |
| 37 | L | 87.1 | Confident | 83.2 | Confident | 0 Ų | 0 | 65.4 Ų | 65.4 | 0% | 0 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -59.1 | -45.1 | 175.9 | -84.5 | 163.8 | 0 | 0 | 0 | 111.2 | V15 L18 L22 L33 E34 R40 I41 L84 | V15-L37 HydrophobicContact CB-CD2 4.41Å; V15-L37 HydrophobicContact CG1-CD2 3.79Å; L18-L37 HydrophobicContact CB-CD2 3.73Å; L18-L37 HydrophobicContact CB-CG 4.32Å; L18-L37 HydrophobicContact CD1-CD2 4.49Å; L22-L37 HydrophobicContact CB-CD1 4.47Å; L22-L37 HydrophobicContact CD1-CD1 4.27Å; L22-L37 HydrophobicContact CD2-CD1 3.99Å; L22-L37 HydrophobicContact CG-CD1 4.49Å; L33-L37 HydrophobicContact CG-CD1 4.34Å; L33-L37 VanDerWaalsContact O-CB 3.27Å; L33-L37 WeakPolarHBondContact O-CB 3.2Å; L33-L37 VanDerWaalsContact O-CG 3.31Å; L33-L37 WeakPolarHBondContact O-CG 3.47Å; L33-L37 PolarHBondContact O-N 3.29Å; E34-L37 PolarHBondContact O-N 3.06Å; L37-R40 PolarHBondContact O-N 3.4Å; L37-I41 VanDerWaalsContact O-CG1 3.26Å; L37-I41 WeakPolarHBondContact O-CG1 3.47Å; L37-I41 PolarHBondContact O-N 3.06Å; L37-L84 HydrophobicContact CB-CD1 4.26Å; L37-L84 HydrophobicContact CB-CD2 4.08Å; L37-L84 HydrophobicContact CD1-CD1 4.19Å |
| 38 | Q | 86.9 | Confident | 83.8 | Confident | 54 Ų | 54 | 57.9 Ų | 57.9 | 25% | 0.252 | 30% | 0.299 | S | S | . | . | H | α-helix | trans | -60 | -49.7 | 177.1 | -173 | 61.6 | 45.5 | 0 | 0 | 111.1 | E34 N35 E36 R40 I41 D42 L84 | E34-Q38 WeakPolarHBondContact O-CB 3.23Å; E34-Q38 PolarHBondContact O-N 3.08Å; N35-Q38 PolarHBondContact O-N 2.83Å; E36-Q38 VanDerWaalsContact C-N 3.34Å; E36-Q38 PolarHBondContact O-N 2.84Å; Q38-R40 VanDerWaalsContact C-N 3.31Å; Q38-R40 PolarHBondContact O-N 2.99Å; Q38-I41 PolarHBondContact O-N 2.87Å; Q38-D42 PolarHBondContact NE2-OD1 3.49Å; Q38-D42 VanDerWaalsContact O-CG 3.27Å; Q38-D42 PolarHBondContact O-N 2.97Å; Q38-L84 HydrophobicContact CB-CD2 4.23Å |
| 39 | A | 86.9 | Confident | 84.4 | Confident | 49 Ų | 49 | 55.6 Ų | 55.6 | 41% | 0.405 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -60.6 | -39.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | N35 E36 D42 Q43 | N35-A39 WeakPolarHBondContact O-CB 3.14Å; N35-A39 PolarHBondContact O-N 3.3Å; E36-A39 PolarHBondContact O-N 2.83Å; A39-D42 PolarHBondContact O-N 3.46Å; A39-Q43 WeakPolarHBondContact O-CG 3.27Å; A39-Q43 PolarHBondContact O-N 3.24Å |
| 40 | R | 87.6 | Confident | 84.6 | Confident | 78 Ų | 78 | 61.5 Ų | 61.5 | 29% | 0.294 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -67.1 | -40.2 | 175.7 | -75.1 | -179.6 | -178.6 | -107.1 | 3.4 | 112.2 | E14 V15 E36 L37 Q38 D42 Q43 I44 | E14-R40 IonicContact OE2-NH1 3.3Å; E14-R40 PolarHBondContact OE2-NH1 3.36Å; V15-R40 HydrophobicContact CG2-CB 3.88Å; E36-R40 WeakPolarHBondContact O-CG 3.31Å; E36-R40 PolarHBondContact O-N 3.34Å; E36-R40 IonicContact OE1-CZ 3.36Å; E36-R40 IonicContact OE1-NE 2.97Å; E36-R40 PolarHBondContact OE1-NE 3.42Å; E36-R40 IonicContact OE1-NH2 3.64Å; E36-R40 PolarHBondContact OE1-NH2 3.43Å; L37-R40 PolarHBondContact O-N 3.4Å; Q38-R40 VanDerWaalsContact C-N 3.31Å; Q38-R40 PolarHBondContact O-N 2.99Å; R40-D42 VanDerWaalsContact C-N 3.34Å; R40-Q43 PolarHBondContact O-N 3.47Å; R40-I44 VanDerWaalsContact O-CG1 3.27Å; R40-I44 WeakPolarHBondContact O-CG1 3.3Å; R40-I44 PolarHBondContact O-N 3.34Å |
| 41 | I | 87 | Confident | 84.7 | Confident | 1 Ų | 1 | 61.1 Ų | 61.1 | 1% | 0.005 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -62.2 | -43.3 | 175.4 | -70.7 | 170.9 | 0 | 0 | 0 | 110.3 | V15 L37 Q38 Q43 I44 F45 V77 Q81 L84 | V15-I41 HydrophobicContact CG1-CD1 4.31Å; V15-I41 HydrophobicContact CG1-CG1 3.99Å; L37-I41 VanDerWaalsContact O-CG1 3.26Å; L37-I41 WeakPolarHBondContact O-CG1 3.47Å; L37-I41 PolarHBondContact O-N 3.06Å; Q38-I41 PolarHBondContact O-N 2.87Å; I41-Q43 VanDerWaalsContact C-N 3.35Å; I41-Q43 PolarHBondContact O-N 3.35Å; I41-I44 WeakPolarHBondContact O-CB 3.39Å; I41-I44 PolarHBondContact O-N 3.47Å; I41-I44 VanDerWaalsContact O-N 3.17Å; I41-F45 HydrophobicContact CG2-CD2 3.85Å; I41-F45 HydrophobicContact CG2-CE2 3.85Å; I41-F45 WeakPolarHBondContact O-CD2 3.48Å; I41-F45 PolarHBondContact O-N 2.94Å; I41-V77 HydrophobicContact CG2-CG1 4.26Å; I41-Q81 HydrophobicContact CG2-CB 4.31Å; I41-L84 HydrophobicContact CD1-CD2 3.86Å |
| 42 | D | 85.9 | Confident | 84.7 | Confident | 77 Ų | 77 | 61.8 Ų | 61.8 | 41% | 0.412 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -65.5 | -37.1 | 178.9 | -64.2 | -25.5 | 0 | 0 | 0 | 112.2 | Q38 A39 R40 F45 S46 | Q38-D42 PolarHBondContact NE2-OD1 3.49Å; Q38-D42 VanDerWaalsContact O-CG 3.27Å; Q38-D42 PolarHBondContact O-N 2.97Å; A39-D42 PolarHBondContact O-N 3.46Å; R40-D42 VanDerWaalsContact C-N 3.34Å; D42-F45 PolarHBondContact O-N 2.85Å; D42-S46 PolarHBondContact O-N 3.37Å; D42-S46 VanDerWaalsContact O-N 3.1Å; D42-S46 PolarHBondContact O-OG 2.98Å; D42-S46 VanDerWaalsContact O-OG 3.1Å |
| 43 | Q | 87.9 | Confident | 84.7 | Confident | 107 Ų | 107 | 59.9 Ų | 59.9 | 50% | 0.5 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -63.6 | -42.7 | 171.2 | -74.3 | -179.5 | -6.3 | 0 | 0 | 112.2 | A39 R40 I41 F45 S46 H47 | A39-Q43 WeakPolarHBondContact O-CG 3.27Å; A39-Q43 PolarHBondContact O-N 3.24Å; R40-Q43 PolarHBondContact O-N 3.47Å; I41-Q43 VanDerWaalsContact C-N 3.35Å; I41-Q43 PolarHBondContact O-N 3.35Å; Q43-F45 VanDerWaalsContact C-N 3.33Å; Q43-F45 PolarHBondContact O-N 3Å; Q43-S46 WeakPolarHBondContact O-CB 3.31Å; Q43-S46 PolarHBondContact O-N 3.38Å; Q43-H47 PolarHBondContact O-N 2.86Å |
| 44 | I | 86.9 | Confident | 84.5 | Confident | 2 Ų | 2 | 61.8 Ų | 61.8 | 1% | 0.01 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -63.1 | -40.3 | 177 | -71.5 | 165.8 | 0 | 0 | 0 | 110.9 | T8 Q11 I12 V15 R40 I41 S46 H47 L48 V77 | T8-I44 HydrophobicContact CG2-CG2 3.91Å; Q11-I44 HydrophobicContact CB-CD1 3.85Å; Q11-I44 HydrophobicContact CB-CG1 3.79Å; I12-I44 HydrophobicContact CD1-CG2 4.37Å; I12-I44 HydrophobicContact CG1-CD1 4.17Å; I12-I44 HydrophobicContact CG1-CG2 4.02Å; V15-I44 HydrophobicContact CG2-CD1 3.73Å; R40-I44 VanDerWaalsContact O-CG1 3.27Å; R40-I44 WeakPolarHBondContact O-CG1 3.3Å; R40-I44 PolarHBondContact O-N 3.34Å; I41-I44 WeakPolarHBondContact O-CB 3.39Å; I41-I44 PolarHBondContact O-N 3.47Å; I41-I44 VanDerWaalsContact O-N 3.17Å; I44-S46 PolarHBondContact O-N 2.97Å; I44-H47 PolarHBondContact O-N 3.47Å; I44-L48 HydrophobicContact CG2-CD1 4.29Å; I44-L48 WeakPolarHBondContact O-CB 3.32Å; I44-L48 PolarHBondContact O-N 3.35Å; I44-V77 HydrophobicContact CG2-CB 4.41Å; I44-V77 HydrophobicContact CG2-CG1 4.11Å; I44-V77 HydrophobicContact CG2-CG2 3.38Å |
| 45 | F | 84.2 | Confident | 84.3 | Confident | 48 Ų | 48 | 61.5 Ų | 61.5 | 21% | 0.211 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -58.8 | -46.4 | 173.6 | -94.9 | -71.9 | 0 | 0 | 0 | 111.9 | I41 D42 Q43 H47 L48 E49 V77 Q78 Q81 | I41-F45 HydrophobicContact CG2-CD2 3.85Å; I41-F45 HydrophobicContact CG2-CE2 3.85Å; I41-F45 WeakPolarHBondContact O-CD2 3.48Å; I41-F45 PolarHBondContact O-N 2.94Å; D42-F45 PolarHBondContact O-N 2.85Å; Q43-F45 VanDerWaalsContact C-N 3.33Å; Q43-F45 PolarHBondContact O-N 3Å; F45-H47 VanDerWaalsContact C-N 3.28Å; F45-H47 PolarHBondContact O-N 3.19Å; F45-L48 WeakPolarHBondContact O-CB 3.39Å; F45-L48 PolarHBondContact O-N 2.92Å; F45-L48 VanDerWaalsContact O-N 3.08Å; F45-E49 PolarHBondContact O-N 3.25Å; F45-V77 HydrophobicContact CD2-CG1 3.72Å; F45-V77 HydrophobicContact CE1-CG1 4.31Å; F45-V77 HydrophobicContact CE2-CG1 3.41Å; F45-V77 VanDerWaalsContact CE2-CG1 3.41Å; F45-V77 HydrophobicContact CG-CG1 4.3Å; F45-V77 HydrophobicContact CZ-CG1 3.74Å; F45-Q78 HydrophobicContact CZ-CG 4.29Å; F45-Q81 VanDerWaalsContact CE2-OE1 3.3Å |
| 46 | S | 83.3 | Confident | 83.9 | Confident | 72 Ų | 72 | 58.9 Ų | 58.9 | 50% | 0.503 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -59.8 | -38.8 | 176.3 | -59.7 | 0 | 0 | 0 | 0 | 112.1 | D42 Q43 I44 R50 | D42-S46 PolarHBondContact O-N 3.37Å; D42-S46 VanDerWaalsContact O-N 3.1Å; D42-S46 PolarHBondContact O-OG 2.98Å; D42-S46 VanDerWaalsContact O-OG 3.1Å; Q43-S46 WeakPolarHBondContact O-CB 3.31Å; Q43-S46 PolarHBondContact O-N 3.38Å; I44-S46 PolarHBondContact O-N 2.97Å; S46-R50 PolarHBondContact O-N 2.92Å |
| 47 | H | 82.8 | Confident | 83.8 | Confident | 48 Ų | 48 | 62.8 Ų | 62.8 | 22% | 0.222 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -67.6 | -37.6 | 174.1 | -68.8 | 170.9 | 0 | 0 | 0 | 112.6 | Q11 Q43 I44 F45 R50 L51 | Q11-H47 PolarHBondContact OE1-CE1 3.35Å; Q11-H47 PolarHBondContact OE1-ND1 2.93Å; Q43-H47 PolarHBondContact O-N 2.86Å; I44-H47 PolarHBondContact O-N 3.47Å; F45-H47 VanDerWaalsContact C-N 3.28Å; F45-H47 PolarHBondContact O-N 3.19Å; H47-R50 PolarHBondContact O-N 2.98Å; H47-L51 WeakPolarHBondContact O-CB 3.38Å; H47-L51 PolarHBondContact O-N 3.29Å |
| 48 | L | 81.4 | Confident | 83.4 | Confident | 9 Ų | 9 | 64.7 Ų | 64.7 | 5% | 0.047 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -64.3 | -44 | 176 | -102.1 | 162.5 | 0 | 0 | 0 | 112.2 | T8 I44 F45 R50 L51 E52 V70 L73 K74 V77 | T8-L48 HydrophobicContact CG2-CG 4.48Å; I44-L48 HydrophobicContact CG2-CD1 4.29Å; I44-L48 WeakPolarHBondContact O-CB 3.32Å; I44-L48 PolarHBondContact O-N 3.35Å; F45-L48 WeakPolarHBondContact O-CB 3.39Å; F45-L48 PolarHBondContact O-N 2.92Å; F45-L48 VanDerWaalsContact O-N 3.08Å; L48-R50 VanDerWaalsContact C-N 3.3Å; L48-R50 PolarHBondContact O-N 3.27Å; L48-L51 CarbonylContact O-C 3.58Å; L48-L51 WeakPolarHBondContact O-CB 3.45Å; L48-L51 PolarHBondContact O-N 3.4Å; L48-L51 VanDerWaalsContact O-N 3.13Å; L48-E52 WeakPolarHBondContact O-CB 3.42Å; L48-E52 PolarHBondContact O-N 2.88Å; L48-V70 HydrophobicContact CD2-CG1 4.07Å; L48-L73 HydrophobicContact CD2-CB 3.88Å; L48-K74 HydrophobicContact CD2-CB 4.36Å; L48-V77 HydrophobicContact CD1-CB 4.07Å; L48-V77 HydrophobicContact CD1-CG1 4.45Å; L48-V77 HydrophobicContact CD1-CG2 3.72Å |
| 49 | E | 83.1 | Confident | 83 | Confident | 126 Ų | 126 | 66.2 Ų | 66.2 | 59% | 0.589 | 33% | 0.333 | S | S | * | . | H | α-helix | trans | -59.4 | -43.6 | 175.2 | -71.9 | -177.6 | 175.6 | 0 | 0 | 111.3 | F45 L51 E52 I53 | F45-E49 PolarHBondContact O-N 3.25Å; E49-L51 VanDerWaalsContact C-N 3.32Å; E49-L51 PolarHBondContact O-N 3.2Å; E49-E52 PolarHBondContact O-N 3.49Å; E49-I53 WeakPolarHBondContact O-CG1 3.49Å; E49-I53 PolarHBondContact O-N 2.88Å; E49-I53 VanDerWaalsContact O-N 3.11Å |
| 50 | R | 79.9 | Confident | 82.2 | Confident | 174 Ų | 174 | 69.4 Ų | 69.4 | 66% | 0.657 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -65.6 | -37.1 | 175.9 | -162 | 172.2 | -172.1 | 171.2 | 2.3 | 112 | L4 S46 H47 L48 L54 | L4-R50 HydrophobicContact CD2-CB 4.27Å; L4-R50 HydrophobicContact CD2-CG 4.38Å; S46-R50 PolarHBondContact O-N 2.92Å; H47-R50 PolarHBondContact O-N 2.98Å; L48-R50 VanDerWaalsContact C-N 3.3Å; L48-R50 PolarHBondContact O-N 3.27Å; R50-L54 WeakPolarHBondContact O-CG 3.47Å; R50-L54 PolarHBondContact O-N 2.9Å; R50-L54 VanDerWaalsContact O-N 3.1Å |
| 51 | L | 81.9 | Confident | 81.7 | Confident | 0 Ų | 0 | 73.2 Ų | 73.2 | 0% | 0 | 37% | 0.374 | C | S | . | . | H | α-helix | trans | -68.7 | -36.5 | 176.4 | -167.9 | 72.5 | 0 | 0 | 0 | 111.8 | M1 L4 Y5 H47 L48 E49 L54 A55 V70 L73 | M1-L51 HydrophobicContact CG-CD1 4.05Å; M1-L51 WeakPolarHBondContact O-CD1 3.41Å; M1-L51 HydrophobicContact SD-CD1 4.35Å; L4-L51 HydrophobicContact CB-CD1 4.06Å; L4-L51 HydrophobicContact CD2-CB 4.08Å; L4-L51 HydrophobicContact CD2-CD1 4.01Å; L4-L51 HydrophobicContact CG-CD1 4.19Å; Y5-L51 HydrophobicContact CD2-CD2 4.04Å; H47-L51 WeakPolarHBondContact O-CB 3.38Å; H47-L51 PolarHBondContact O-N 3.29Å; L48-L51 CarbonylContact O-C 3.58Å; L48-L51 WeakPolarHBondContact O-CB 3.45Å; L48-L51 PolarHBondContact O-N 3.4Å; L48-L51 VanDerWaalsContact O-N 3.13Å; E49-L51 VanDerWaalsContact C-N 3.32Å; E49-L51 PolarHBondContact O-N 3.2Å; L51-L54 PolarHBondContact O-N 2.79Å; L51-A55 WeakPolarHBondContact O-CB 3.41Å; L51-A55 PolarHBondContact O-N 3.36Å; L51-V70 HydrophobicContact CB-CG2 4.49Å; L51-V70 HydrophobicContact CD2-CG2 3.74Å; L51-V70 HydrophobicContact CG-CG2 3.78Å; L51-L73 HydrophobicContact CD2-CD2 4.3Å |
| 52 | E | 80.3 | Confident | 81.3 | Confident | 94 Ų | 94 | 81.8 Ų | 81.8 | 44% | 0.439 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -63.2 | -43.8 | 174.8 | -174.2 | 171.6 | -176 | 0 | 0 | 111.2 | L48 E49 L54 A55 S56 V70 | L48-E52 WeakPolarHBondContact O-CB 3.42Å; L48-E52 PolarHBondContact O-N 2.88Å; E49-E52 PolarHBondContact O-N 3.49Å; E52-L54 VanDerWaalsContact C-N 3.33Å; E52-L54 PolarHBondContact O-N 3.47Å; E52-A55 PolarHBondContact O-N 2.78Å; E52-S56 WeakPolarHBondContact O-CB 3.35Å; E52-S56 PolarHBondContact O-N 3.46Å; E52-V70 HydrophobicContact CB-CG1 4.14Å |
| 53 | I | 83.9 | Confident | 81 | Confident | 91 Ų | 91 | 83.8 Ų | 83.8 | 47% | 0.467 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -59.9 | -45.6 | 173.5 | -65 | 166.2 | 0 | 0 | 0 | 110.3 | E49 S56 K57 | E49-I53 WeakPolarHBondContact O-CG1 3.49Å; E49-I53 PolarHBondContact O-N 2.88Å; E49-I53 VanDerWaalsContact O-N 3.11Å; I53-S56 PolarHBondContact O-N 2.98Å; I53-S56 PolarHBondContact O-OG 3.43Å; I53-K57 HydrophobicContact CG2-CD 4.39Å; I53-K57 WeakPolarHBondContact O-CG 3.46Å; I53-K57 PolarHBondContact O-N 3.38Å |
| 54 | L | 80.5 | Confident | 80.7 | Confident | 65 Ų | 65 | 84.2 Ų | 84.2 | 34% | 0.34 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -65.8 | -41.4 | 178.9 | -70.5 | 173.2 | 0 | 0 | 0 | 112.3 | L4 R50 L51 E52 S56 K57 E58 | L4-L54 HydrophobicContact CD2-CD1 3.98Å; R50-L54 WeakPolarHBondContact O-CG 3.47Å; R50-L54 PolarHBondContact O-N 2.9Å; R50-L54 VanDerWaalsContact O-N 3.1Å; L51-L54 PolarHBondContact O-N 2.79Å; E52-L54 VanDerWaalsContact C-N 3.33Å; E52-L54 PolarHBondContact O-N 3.47Å; L54-S56 VanDerWaalsContact C-N 3.27Å; L54-S56 PolarHBondContact O-N 2.79Å; L54-K57 PolarHBondContact O-N 2.84Å; L54-K57 VanDerWaalsContact O-N 3.14Å; L54-E58 PolarHBondContact O-N 3.3Å |
| 55 | A | 78.6 | Confident | 80.5 | Confident | 5 Ų | 5 | 87.9 Ų | 87.9 | 4% | 0.041 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -64.3 | -33.2 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | L51 E52 K57 E58 A66 V70 | L51-A55 WeakPolarHBondContact O-CB 3.41Å; L51-A55 PolarHBondContact O-N 3.36Å; E52-A55 PolarHBondContact O-N 2.78Å; A55-K57 VanDerWaalsContact C-N 3.25Å; A55-K57 PolarHBondContact O-N 2.83Å; A55-E58 PolarHBondContact O-N 2.8Å; A55-A66 HydrophobicContact CB-CB 3.98Å; A55-V70 HydrophobicContact CB-CG2 3.87Å |
| 56 | S | 79.1 | Confident | 80.3 | Confident | 57 Ų | 57 | 85.7 Ų | 85.7 | 40% | 0.399 | 42% | 0.42 | S | S | . | . | H | α-helix | trans | -67.3 | -26.4 | 175.4 | 81.8 | 0 | 0 | 0 | 0 | 113.4 | E52 I53 L54 R63 | E52-S56 WeakPolarHBondContact O-CB 3.35Å; E52-S56 PolarHBondContact O-N 3.46Å; I53-S56 PolarHBondContact O-N 2.98Å; I53-S56 PolarHBondContact O-OG 3.43Å; L54-S56 VanDerWaalsContact C-N 3.27Å; L54-S56 PolarHBondContact O-N 2.79Å; S56-R63 PolarHBondContact O-NE 3.23Å |
| 57 | K | 83.6 | Confident | 80.4 | Confident | 161 Ų | 161 | 88.1 Ų | 88.1 | 70% | 0.7 | 42% | 0.422 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -89.6 | -3.2 | -178.6 | -68.5 | 177.9 | -179.8 | -175.2 | 0 | 113.7 | I53 L54 A55 | I53-K57 HydrophobicContact CG2-CD 4.39Å; I53-K57 WeakPolarHBondContact O-CG 3.46Å; I53-K57 PolarHBondContact O-N 3.38Å; L54-K57 PolarHBondContact O-N 2.84Å; L54-K57 VanDerWaalsContact O-N 3.14Å; A55-K57 VanDerWaalsContact C-N 3.25Å; A55-K57 PolarHBondContact O-N 2.83Å |
| 58 | E | 80.4 | Confident | 80.5 | Confident | 41 Ų | 41 | 90.4 Ų | 90.4 | 19% | 0.192 | 44% | 0.435 | C | S | . | . | S | Bend | trans | -75.7 | 152.2 | 178.6 | -77 | -162.3 | 171.2 | 0 | 0 | 113.3 | M1 L54 A55 A66 | M1-E58 WeakPolarHBondContact CB-OE1 3.25Å; M1-E58 WeakPolarHBondContact CE-OE1 3.36Å; M1-E58 VanDerWaalsContact CG-OE1 3.29Å; M1-E58 WeakPolarHBondContact CG-OE1 3.32Å; L54-E58 PolarHBondContact O-N 3.3Å; A55-E58 PolarHBondContact O-N 2.8Å; E58-A66 VanDerWaalsContact OE2-CB 3.25Å; E58-A66 WeakPolarHBondContact OE2-CB 3.16Å |
| 59 | P | 77.3 | Confident | 80.7 | Confident | 86 Ų | 86 | 94 Ų | 94 | 56% | 0.558 | 45% | 0.448 | S | S | * | . | trans | -58.4 | 146.5 | 177.3 | 22.4 | -32 | 0 | 0 | 0 | 111.5 | N61 R62 R63 | P59-N61 PolarHBondContact O-N 3.31Å; P59-R62 PolarHBondContact O-N 3.33Å; P59-R63 WeakPolarHBondContact O-CB 3.26Å; P59-R63 PolarHBondContact O-N 3.4Å | ||
| 60 | T | 70.5 | Confident | 80.8 | Confident | 116 Ų | 116 | 88.2 Ų | 88.2 | 71% | 0.712 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -49.6 | -34.9 | -172.2 | 27.9 | 0 | 0 | 0 | 0 | 114.3 | R62 | T60-R62 PolarHBondContact O-N 2.76Å |
| 61 | N | 76.6 | Confident | 81.2 | Confident | 158 Ų | 158 | 83.6 Ų | 83.6 | 85% | 0.845 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -70.2 | -26.2 | 179 | -65.9 | -11.7 | 0 | 0 | 0 | 114.3 | P59 | P59-N61 PolarHBondContact O-N 3.31Å |
| 62 | R | 79.9 | Confident | 81.5 | Confident | 181 Ų | 181 | 88.3 Ų | 88.3 | 68% | 0.683 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -106.2 | -23.6 | -179.9 | -67.6 | -173.9 | 179.2 | 166.9 | 0 | 113.1 | P59 T60 Q64 N65 A66 | P59-R62 PolarHBondContact O-N 3.33Å; T60-R62 PolarHBondContact O-N 2.76Å; R62-Q64 VanDerWaalsContact C-N 3.28Å; R62-Q64 PolarHBondContact O-N 2.82Å; R62-N65 PolarHBondContact O-N 3.44Å; R62-A66 PolarHBondContact O-N 3.46Å |
| 63 | R | 78.8 | Confident | 81.7 | Confident | 119 Ų | 119 | 84 Ų | 84 | 45% | 0.449 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -52.5 | -39.7 | -178.6 | -173.3 | 171.2 | 177.7 | -174.4 | 1.2 | 113.9 | S56 P59 K67 | S56-R63 PolarHBondContact O-NE 3.23Å; P59-R63 WeakPolarHBondContact O-CB 3.26Å; P59-R63 PolarHBondContact O-N 3.4Å; R63-K67 VanDerWaalsContact O-CB 3.28Å; R63-K67 WeakPolarHBondContact O-CB 3.4Å; R63-K67 PolarHBondContact O-N 2.96Å |
| 64 | Q | 81.2 | Confident | 81.9 | Confident | 115 Ų | 115 | 83.4 Ų | 83.4 | 54% | 0.537 | 41% | 0.405 | S | S | . | . | H | α-helix | trans | -66.9 | -41.4 | 179.1 | -170.7 | 174.1 | 7.8 | 0 | 0 | 112.1 | R62 L68 | R62-Q64 VanDerWaalsContact C-N 3.28Å; R62-Q64 PolarHBondContact O-N 2.82Å; Q64-L68 PolarHBondContact O-N 3.17Å |
| 65 | N | 83.3 | Confident | 82.2 | Confident | 80 Ų | 80 | 87.5 Ų | 87.5 | 43% | 0.428 | 42% | 0.417 | S | S | . | . | H | α-helix | trans | -70.8 | -41.6 | 178.1 | -167.7 | -94.2 | 0 | 0 | 0 | 111.6 | R62 K67 L68 R69 | R62-N65 PolarHBondContact O-N 3.44Å; N65-K67 VanDerWaalsContact C-N 3.34Å; N65-K67 PolarHBondContact O-N 3.27Å; N65-L68 PolarHBondContact O-N 3Å; N65-R69 WeakPolarHBondContact O-CG 3.5Å; N65-R69 PolarHBondContact O-N 3.35Å; N65-R69 PolarHBondContact OD1-NE 2.97Å; N65-R69 VanDerWaalsContact OD1-NE 3.1Å |
| 66 | A | 80.8 | Confident | 82.6 | Confident | 2 Ų | 2 | 90 Ų | 90 | 2% | 0.017 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -60.4 | -43.6 | 175 | 0 | 0 | 0 | 0 | 0 | 111.8 | M1 A55 E58 R62 R69 V70 | M1-A66 HydrophobicContact CE-CB 3.84Å; A55-A66 HydrophobicContact CB-CB 3.98Å; E58-A66 VanDerWaalsContact OE2-CB 3.25Å; E58-A66 WeakPolarHBondContact OE2-CB 3.16Å; R62-A66 PolarHBondContact O-N 3.46Å; A66-R69 PolarHBondContact O-N 3.32Å; A66-V70 WeakPolarHBondContact O-CG2 3.23Å; A66-V70 PolarHBondContact O-N 3.47Å |
| 67 | K | 84.6 | Confident | 82.8 | Confident | 122 Ų | 122 | 87.3 Ų | 87.3 | 53% | 0.53 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -63.3 | -43.9 | 176.4 | -167.9 | 172.8 | -176.3 | 174.4 | 0 | 112.1 | R63 N65 R69 V70 D71 | R63-K67 VanDerWaalsContact O-CB 3.28Å; R63-K67 WeakPolarHBondContact O-CB 3.4Å; R63-K67 PolarHBondContact O-N 2.96Å; N65-K67 VanDerWaalsContact C-N 3.34Å; N65-K67 PolarHBondContact O-N 3.27Å; K67-R69 VanDerWaalsContact C-N 3.31Å; K67-R69 PolarHBondContact O-N 2.93Å; K67-V70 PolarHBondContact O-N 3.44Å; K67-D71 WeakPolarHBondContact O-CB 3.34Å; K67-D71 VanDerWaalsContact O-CG 3.31Å; K67-D71 PolarHBondContact O-N 3.23Å |
| 68 | L | 85.8 | Confident | 83 | Confident | 97 Ų | 97 | 83.9 Ų | 83.9 | 51% | 0.508 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -58.9 | -43.3 | 175.9 | -177.3 | 69 | 0 | 0 | 0 | 111.9 | Q64 N65 D71 Q72 | Q64-L68 PolarHBondContact O-N 3.17Å; N65-L68 PolarHBondContact O-N 3Å; L68-D71 PolarHBondContact O-N 3.08Å; L68-Q72 WeakPolarHBondContact O-CG 3.45Å; L68-Q72 PolarHBondContact O-N 2.91Å |
| 69 | R | 84 | Confident | 83.4 | Confident | 85 Ų | 85 | 87.4 Ų | 87.4 | 32% | 0.321 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -63.9 | -42.2 | 176.9 | -74.7 | 179.8 | -178.2 | 177.8 | 1.5 | 112.2 | Y5 N65 A66 K67 Q72 L73 | Y5-R69 HydrophobicContact CD2-CB 4.38Å; Y5-R69 HydrophobicContact CE2-CB 3.73Å; Y5-R69 HydrophobicContact CE2-CG 4.34Å; N65-R69 WeakPolarHBondContact O-CG 3.5Å; N65-R69 PolarHBondContact O-N 3.35Å; N65-R69 PolarHBondContact OD1-NE 2.97Å; N65-R69 VanDerWaalsContact OD1-NE 3.1Å; A66-R69 PolarHBondContact O-N 3.32Å; K67-R69 VanDerWaalsContact C-N 3.31Å; K67-R69 PolarHBondContact O-N 2.93Å; R69-Q72 PolarHBondContact O-N 3.34Å; R69-L73 WeakPolarHBondContact O-CD1 3.42Å; R69-L73 PolarHBondContact O-N 3.01Å; R69-L73 VanDerWaalsContact O-N 3.14Å |
| 70 | V | 86.6 | Confident | 83.7 | Confident | 4 Ų | 4 | 83.7 Ų | 83.7 | 2% | 0.024 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -63 | -44.5 | 175 | 172 | 0 | 0 | 0 | 0 | 110.9 | L48 L51 E52 A55 A66 K67 Q72 L73 K74 | L48-V70 HydrophobicContact CD2-CG1 4.07Å; L51-V70 HydrophobicContact CB-CG2 4.49Å; L51-V70 HydrophobicContact CD2-CG2 3.74Å; L51-V70 HydrophobicContact CG-CG2 3.78Å; E52-V70 HydrophobicContact CB-CG1 4.14Å; A55-V70 HydrophobicContact CB-CG2 3.87Å; A66-V70 WeakPolarHBondContact O-CG2 3.23Å; A66-V70 PolarHBondContact O-N 3.47Å; K67-V70 PolarHBondContact O-N 3.44Å; V70-Q72 VanDerWaalsContact C-N 3.31Å; V70-Q72 PolarHBondContact O-N 3.47Å; V70-L73 PolarHBondContact O-N 3.25Å; V70-K74 WeakPolarHBondContact O-CB 3.21Å; V70-K74 PolarHBondContact O-N 2.94Å |
| 71 | D | 87 | Confident | 84.4 | Confident | 76 Ų | 76 | 81.6 Ų | 81.6 | 41% | 0.406 | 37% | 0.372 | S | S | . | . | H | α-helix | trans | -62.2 | -38.3 | 178.9 | -73.6 | -22.6 | 0 | 0 | 0 | 111.8 | K67 L68 K74 Y75 | K67-D71 WeakPolarHBondContact O-CB 3.34Å; K67-D71 VanDerWaalsContact O-CG 3.31Å; K67-D71 PolarHBondContact O-N 3.23Å; L68-D71 PolarHBondContact O-N 3.08Å; D71-K74 PolarHBondContact O-N 3.25Å; D71-Y75 PolarHBondContact O-N 2.93Å |
| 72 | Q | 87.9 | Confident | 84.8 | Confident | 99 Ų | 99 | 78 Ų | 78 | 46% | 0.463 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -62.2 | -51 | 173.6 | -75.7 | 173.9 | -18.7 | 0 | 0 | 111.9 | L68 R69 V70 K74 Y75 D76 | L68-Q72 WeakPolarHBondContact O-CG 3.45Å; L68-Q72 PolarHBondContact O-N 2.91Å; R69-Q72 PolarHBondContact O-N 3.34Å; V70-Q72 VanDerWaalsContact C-N 3.31Å; V70-Q72 PolarHBondContact O-N 3.47Å; Q72-K74 PolarHBondContact O-N 2.99Å; Q72-Y75 WeakPolarHBondContact O-CB 3.49Å; Q72-Y75 PolarHBondContact O-N 3.29Å; Q72-Y75 VanDerWaalsContact O-N 3.12Å; Q72-D76 PolarHBondContact O-N 3.38Å |
| 73 | L | 85 | Confident | 85 | Confident | 3 Ų | 3 | 70.9 Ų | 70.9 | 2% | 0.016 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -60.5 | -37.2 | 177.8 | -93.6 | 58.8 | 0 | 0 | 0 | 111.8 | Y5 T8 I12 L48 L51 R69 V70 Y75 D76 V77 | Y5-L73 HydrophobicContact CD2-CD1 4.27Å; Y5-L73 HydrophobicContact CD2-CD2 3.71Å; Y5-L73 HydrophobicContact CE2-CD1 3.37Å; Y5-L73 HydrophobicContact CE2-CD2 3.68Å; Y5-L73 HydrophobicContact CE2-CG 4.16Å; T8-L73 HydrophobicContact CG2-CD2 3.94Å; I12-L73 HydrophobicContact CD1-CB 4.29Å; I12-L73 HydrophobicContact CD1-CD2 4.38Å; I12-L73 HydrophobicContact CD1-CG 3.86Å; L48-L73 HydrophobicContact CD2-CB 3.88Å; L51-L73 HydrophobicContact CD2-CD2 4.3Å; R69-L73 WeakPolarHBondContact O-CD1 3.42Å; R69-L73 PolarHBondContact O-N 3.01Å; R69-L73 VanDerWaalsContact O-N 3.14Å; V70-L73 PolarHBondContact O-N 3.25Å; L73-Y75 VanDerWaalsContact C-N 3.35Å; L73-D76 PolarHBondContact O-N 3.46Å; L73-V77 VanDerWaalsContact O-CG2 3.23Å; L73-V77 WeakPolarHBondContact O-CG2 3.37Å; L73-V77 PolarHBondContact O-N 3.42Å |
| 74 | K | 88.7 | Confident | 85.2 | Confident | 79 Ų | 79 | 65.2 Ų | 65.2 | 34% | 0.343 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -62 | -43.5 | 176.1 | -174.6 | 174 | -176.4 | 168.1 | 0 | 111.7 | L48 V70 D71 Q72 V77 Q78 | L48-K74 HydrophobicContact CD2-CB 4.36Å; V70-K74 WeakPolarHBondContact O-CB 3.21Å; V70-K74 PolarHBondContact O-N 2.94Å; D71-K74 PolarHBondContact O-N 3.25Å; Q72-K74 PolarHBondContact O-N 2.99Å; K74-V77 PolarHBondContact O-N 3.03Å; K74-Q78 WeakPolarHBondContact O-CB 3.39Å; K74-Q78 VanDerWaalsContact O-CG 3.29Å; K74-Q78 WeakPolarHBondContact O-CG 3.26Å; K74-Q78 PolarHBondContact O-N 2.91Å |
| 75 | Y | 87.5 | Confident | 85.4 | Confident | 151 Ų | 151 | 68.7 Ų | 68.7 | 59% | 0.592 | 32% | 0.322 | S | S | * | . | H | α-helix | trans | -60.9 | -47 | 175.7 | 179.7 | -95.1 | 0 | 0 | 0 | 111.6 | D71 Q72 L73 V77 Q78 H79 | D71-Y75 PolarHBondContact O-N 2.93Å; Q72-Y75 WeakPolarHBondContact O-CB 3.49Å; Q72-Y75 PolarHBondContact O-N 3.29Å; Q72-Y75 VanDerWaalsContact O-N 3.12Å; L73-Y75 VanDerWaalsContact C-N 3.35Å; Y75-V77 VanDerWaalsContact C-N 3.33Å; Y75-V77 PolarHBondContact O-N 3.39Å; Y75-Q78 PolarHBondContact O-N 3.35Å; Y75-H79 WeakPolarHBondContact O-CB 3.5Å; Y75-H79 PolarHBondContact O-N 3.31Å |
| 76 | D | 85.3 | Confident | 85.5 | Confident | 58 Ų | 58 | 69.1 Ų | 69.1 | 31% | 0.31 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -61.2 | -41.8 | -179.4 | -66.5 | -20 | 0 | 0 | 0 | 111.9 | Q72 L73 H79 L80 | Q72-D76 PolarHBondContact O-N 3.38Å; L73-D76 PolarHBondContact O-N 3.46Å; D76-H79 WeakPolarHBondContact O-CB 3.49Å; D76-H79 PolarHBondContact O-N 3.27Å; D76-L80 WeakPolarHBondContact O-CG 3.35Å; D76-L80 PolarHBondContact O-N 3.01Å |
| 77 | V | 84.9 | Confident | 85.6 | Confident | 1 Ų | 1 | 71.6 Ų | 71.6 | 1% | 0.006 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -69.5 | -41.1 | 179.1 | 175.3 | 0 | 0 | 0 | 0 | 111.7 | I12 I41 I44 F45 L48 L73 K74 Y75 H79 L80 Q81 | I12-V77 HydrophobicContact CD1-CG2 3.57Å; I12-V77 HydrophobicContact CG1-CG2 3.76Å; I41-V77 HydrophobicContact CG2-CG1 4.26Å; I44-V77 HydrophobicContact CG2-CB 4.41Å; I44-V77 HydrophobicContact CG2-CG1 4.11Å; I44-V77 HydrophobicContact CG2-CG2 3.38Å; F45-V77 HydrophobicContact CD2-CG1 3.72Å; F45-V77 HydrophobicContact CE1-CG1 4.31Å; F45-V77 HydrophobicContact CE2-CG1 3.41Å; F45-V77 VanDerWaalsContact CE2-CG1 3.41Å; F45-V77 HydrophobicContact CG-CG1 4.3Å; F45-V77 HydrophobicContact CZ-CG1 3.74Å; L48-V77 HydrophobicContact CD1-CB 4.07Å; L48-V77 HydrophobicContact CD1-CG1 4.45Å; L48-V77 HydrophobicContact CD1-CG2 3.72Å; L73-V77 VanDerWaalsContact O-CG2 3.23Å; L73-V77 WeakPolarHBondContact O-CG2 3.37Å; L73-V77 PolarHBondContact O-N 3.42Å; K74-V77 PolarHBondContact O-N 3.03Å; Y75-V77 VanDerWaalsContact C-N 3.33Å; Y75-V77 PolarHBondContact O-N 3.39Å; V77-H79 VanDerWaalsContact C-N 3.28Å; V77-H79 PolarHBondContact O-N 3.43Å; V77-L80 PolarHBondContact O-N 3.44Å; V77-Q81 WeakPolarHBondContact O-CB 3.46Å; V77-Q81 PolarHBondContact O-N 3.36Å |
| 78 | Q | 87.7 | Confident | 85.6 | Confident | 89 Ų | 89 | 68.7 Ų | 68.7 | 42% | 0.416 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -62 | -38.6 | 173.8 | -76 | 179.5 | -17.7 | 0 | 0 | 111.9 | F45 K74 Y75 Q81 T82 | F45-Q78 HydrophobicContact CZ-CG 4.29Å; K74-Q78 WeakPolarHBondContact O-CB 3.39Å; K74-Q78 VanDerWaalsContact O-CG 3.29Å; K74-Q78 WeakPolarHBondContact O-CG 3.26Å; K74-Q78 PolarHBondContact O-N 2.91Å; Y75-Q78 PolarHBondContact O-N 3.35Å; Q78-Q81 PolarHBondContact O-N 2.86Å; Q78-T82 WeakPolarHBondContact O-CB 3.35Å; Q78-T82 PolarHBondContact O-N 2.87Å; Q78-T82 PolarHBondContact O-OG1 2.97Å |
| 79 | H | 88 | Confident | 85.6 | Confident | 114 Ų | 114 | 70.3 Ų | 70.3 | 53% | 0.528 | 33% | 0.328 | S | S | . | . | H | α-helix | trans | -63.2 | -45.6 | 174.9 | -178.8 | -89.4 | 0 | 0 | 0 | 111.3 | Y75 D76 V77 Q81 T82 A83 | Y75-H79 WeakPolarHBondContact O-CB 3.5Å; Y75-H79 PolarHBondContact O-N 3.31Å; D76-H79 WeakPolarHBondContact O-CB 3.49Å; D76-H79 PolarHBondContact O-N 3.27Å; V77-H79 VanDerWaalsContact C-N 3.28Å; V77-H79 PolarHBondContact O-N 3.43Å; H79-Q81 PolarHBondContact O-N 3.28Å; H79-T82 PolarHBondContact O-N 3.41Å; H79-A83 WeakPolarHBondContact O-CB 3.47Å; H79-A83 PolarHBondContact O-N 3.45Å |
| 80 | L | 82.8 | Confident | 85.5 | Confident | 8 Ų | 8 | 75 Ų | 75 | 4% | 0.042 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -62.7 | -42 | 176.6 | -70.9 | 167 | 0 | 0 | 0 | 112.6 | I12 V15 Q16 M19 D76 V77 T82 A83 L84 | I12-L80 HydrophobicContact CG2-CD1 3.92Å; V15-L80 HydrophobicContact CG1-CD1 4.07Å; Q16-L80 HydrophobicContact CG-CD1 3.98Å; Q16-L80 HydrophobicContact CG-CD2 3.54Å; Q16-L80 HydrophobicContact CG-CG 4.32Å; M19-L80 WeakPolarHBondContact CE-O 3.22Å; M19-L80 HydrophobicContact SD-CD2 3.97Å; D76-L80 WeakPolarHBondContact O-CG 3.35Å; D76-L80 PolarHBondContact O-N 3.01Å; V77-L80 PolarHBondContact O-N 3.44Å; L80-T82 VanDerWaalsContact C-N 3.33Å; L80-T82 PolarHBondContact O-N 2.85Å; L80-A83 PolarHBondContact O-N 3.21Å; L80-L84 PolarHBondContact O-N 2.81Å |
| 81 | Q | 86.9 | Confident | 85.2 | Confident | 73 Ų | 73 | 77.1 Ų | 77.1 | 34% | 0.341 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -61.9 | -42.4 | 176.1 | -171.6 | 178.9 | 16.4 | 0 | 0 | 111.8 | I41 F45 V77 Q78 H79 L84 R85 | I41-Q81 HydrophobicContact CG2-CB 4.31Å; F45-Q81 VanDerWaalsContact CE2-OE1 3.3Å; V77-Q81 WeakPolarHBondContact O-CB 3.46Å; V77-Q81 PolarHBondContact O-N 3.36Å; Q78-Q81 PolarHBondContact O-N 2.86Å; H79-Q81 PolarHBondContact O-N 3.28Å; Q81-L84 PolarHBondContact O-N 3.33Å; Q81-R85 WeakPolarHBondContact O-CB 3.44Å; Q81-R85 PolarHBondContact O-N 3.35Å |
| 82 | T | 84.8 | Confident | 85 | Confident | 81 Ų | 81 | 80.5 Ų | 80.5 | 50% | 0.497 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -64.7 | -41.6 | 176.6 | -55.4 | 0 | 0 | 0 | 0 | 111.2 | Q78 H79 L80 R85 N86 | Q78-T82 WeakPolarHBondContact O-CB 3.35Å; Q78-T82 PolarHBondContact O-N 2.87Å; Q78-T82 PolarHBondContact O-OG1 2.97Å; H79-T82 PolarHBondContact O-N 3.41Å; L80-T82 VanDerWaalsContact C-N 3.33Å; L80-T82 PolarHBondContact O-N 2.85Å; T82-R85 PolarHBondContact O-N 3.46Å; T82-N86 WeakPolarHBondContact O-CB 3.49Å; T82-N86 VanDerWaalsContact O-CG 3.26Å; T82-N86 PolarHBondContact O-N 3.06Å; T82-N86 PolarHBondContact O-ND2 2.89Å |
| 83 | A | 83.3 | Confident | 84.7 | Confident | 32 Ų | 32 | 77.8 Ų | 77.8 | 26% | 0.264 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -61.1 | -44.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112 | M19 H79 L80 N86 F87 | M19-A83 HydrophobicContact CE-CB 4.1Å; M19-A83 HydrophobicContact SD-CB 3.7Å; H79-A83 WeakPolarHBondContact O-CB 3.47Å; H79-A83 PolarHBondContact O-N 3.45Å; L80-A83 PolarHBondContact O-N 3.21Å; A83-N86 PolarHBondContact O-N 2.92Å; A83-F87 PolarHBondContact O-N 3.39Å |
| 84 | L | 82.4 | Confident | 84.7 | Confident | 0 Ų | 0 | 85.4 Ų | 85.4 | 0% | 0 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -61 | -46.7 | 176.9 | -173.3 | 59.6 | 0 | 0 | 0 | 111.5 | M19 L22 E34 L37 Q38 I41 L80 Q81 N86 F87 Q88 | M19-L84 VanDerWaalsContact CE-CA 3.49Å; M19-L84 HydrophobicContact CE-CB 3.5Å; M19-L84 HydrophobicContact CE-CD1 4Å; M19-L84 HydrophobicContact CE-CG 4.31Å; M19-L84 VanDerWaalsContact CE-N 3.34Å; L22-L84 HydrophobicContact CD2-CD1 4.13Å; E34-L84 HydrophobicContact CG-CD1 4.37Å; L37-L84 HydrophobicContact CB-CD1 4.26Å; L37-L84 HydrophobicContact CB-CD2 4.08Å; L37-L84 HydrophobicContact CD1-CD1 4.19Å; Q38-L84 HydrophobicContact CB-CD2 4.23Å; I41-L84 HydrophobicContact CD1-CD2 3.86Å; L80-L84 PolarHBondContact O-N 2.81Å; Q81-L84 PolarHBondContact O-N 3.33Å; L84-N86 VanDerWaalsContact C-N 3.34Å; L84-N86 PolarHBondContact O-N 2.77Å; L84-F87 WeakPolarHBondContact O-CB 3.47Å; L84-F87 PolarHBondContact O-N 3.34Å; L84-Q88 WeakPolarHBondContact O-CG 3.46Å; L84-Q88 PolarHBondContact O-N 2.93Å |
| 85 | R | 86.3 | Confident | 84.4 | Confident | 188 Ų | 188 | 84.1 Ų | 84.1 | 71% | 0.709 | 38% | 0.377 | S | S | * | . | H | α-helix | trans | -62.8 | -40.7 | 179.5 | -170.6 | 175.7 | -178 | 167.4 | 1 | 112.2 | Q81 T82 F87 Q88 H89 | Q81-R85 WeakPolarHBondContact O-CB 3.44Å; Q81-R85 PolarHBondContact O-N 3.35Å; T82-R85 PolarHBondContact O-N 3.46Å; R85-F87 VanDerWaalsContact C-N 3.33Å; R85-Q88 PolarHBondContact O-N 2.86Å; R85-H89 WeakPolarHBondContact O-CB 3.23Å; R85-H89 PolarHBondContact O-N 3.17Å |
| 86 | N | 84.7 | Confident | 84.1 | Confident | 89 Ų | 89 | 78.8 Ų | 78.8 | 48% | 0.476 | 36% | 0.36 | S | S | . | . | H | α-helix | trans | -64.8 | -39.2 | 175.8 | -74.4 | -21.2 | 0 | 0 | 0 | 111.8 | T82 A83 L84 H89 R90 | T82-N86 WeakPolarHBondContact O-CB 3.49Å; T82-N86 VanDerWaalsContact O-CG 3.26Å; T82-N86 PolarHBondContact O-N 3.06Å; T82-N86 PolarHBondContact O-ND2 2.89Å; A83-N86 PolarHBondContact O-N 2.92Å; L84-N86 VanDerWaalsContact C-N 3.34Å; L84-N86 PolarHBondContact O-N 2.77Å; N86-H89 PolarHBondContact O-N 3.01Å; N86-R90 WeakPolarHBondContact O-CB 3.27Å; N86-R90 WeakPolarHBondContact O-CG 3.36Å; N86-R90 PolarHBondContact O-N 3.49Å |
| 87 | F | 83.6 | Confident | 84 | Confident | 54 Ų | 54 | 81.3 Ų | 81.3 | 24% | 0.237 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -63.3 | -50.6 | 175.5 | -172.8 | -87.2 | 0 | 0 | 0 | 111.2 | L22 E23 V30 E34 A83 L84 R85 H89 R90 R91 | L22-F87 HydrophobicContact CD1-CE1 4.36Å; L22-F87 HydrophobicContact CD2-CD1 3.48Å; L22-F87 VanDerWaalsContact CD2-CD1 3.48Å; L22-F87 HydrophobicContact CD2-CD2 4.35Å; L22-F87 HydrophobicContact CD2-CE1 3.57Å; L22-F87 HydrophobicContact CD2-CE2 4.41Å; L22-F87 HydrophobicContact CD2-CG 3.9Å; L22-F87 HydrophobicContact CD2-CZ 4.04Å; L22-F87 HydrophobicContact CG-CD1 4.13Å; L22-F87 HydrophobicContact CG-CE1 3.66Å; L22-F87 HydrophobicContact CG-CE2 4.41Å; L22-F87 HydrophobicContact CG-CZ 3.82Å; E23-F87 HydrophobicContact CG-CE2 4.29Å; V30-F87 HydrophobicContact CG1-CE1 3.8Å; V30-F87 HydrophobicContact CG1-CZ 4.43Å; E34-F87 WeakPolarHBondContact OE1-CD1 3.23Å; A83-F87 PolarHBondContact O-N 3.39Å; L84-F87 WeakPolarHBondContact O-CB 3.47Å; L84-F87 PolarHBondContact O-N 3.34Å; R85-F87 VanDerWaalsContact C-N 3.33Å; F87-H89 VanDerWaalsContact C-N 3.31Å; F87-H89 PolarHBondContact O-N 3.26Å; F87-R90 PolarHBondContact O-N 3.48Å; F87-R91 WeakPolarHBondContact O-CB 3.45Å; F87-R91 PolarHBondContact O-N 3.45Å |
| 88 | Q | 84 | Confident | 83.9 | Confident | 62 Ų | 62 | 84.1 Ų | 84.1 | 29% | 0.29 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -56.4 | -44.4 | 176.3 | -73 | 172.2 | -16.8 | 0 | 0 | 111.8 | E34 L84 R85 R91 Y92 | E34-Q88 HydrophobicContact CG-CG 4.33Å; L84-Q88 WeakPolarHBondContact O-CG 3.46Å; L84-Q88 PolarHBondContact O-N 2.93Å; R85-Q88 PolarHBondContact O-N 2.86Å; Q88-R91 WeakPolarHBondContact O-CB 3.48Å; Q88-R91 PolarHBondContact O-N 3.05Å; Q88-Y92 WeakPolarHBondContact O-CB 3.35Å; Q88-Y92 PolarHBondContact O-N 2.98Å |
| 89 | H | 85.3 | Confident | 83.8 | Confident | 130 Ų | 130 | 86.1 Ų | 86.1 | 60% | 0.602 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -65.4 | -45.8 | 179.4 | -172.3 | 61.1 | 0 | 0 | 0 | 112.3 | R85 N86 F87 R91 Y92 S93 | R85-H89 WeakPolarHBondContact O-CB 3.23Å; R85-H89 PolarHBondContact O-N 3.17Å; N86-H89 PolarHBondContact O-N 3.01Å; F87-H89 VanDerWaalsContact C-N 3.31Å; F87-H89 PolarHBondContact O-N 3.26Å; H89-R91 PolarHBondContact O-N 3.1Å; H89-Y92 PolarHBondContact O-N 3.36Å; H89-S93 VanDerWaalsContact O-CB 3.32Å; H89-S93 WeakPolarHBondContact O-CB 3.45Å; H89-S93 PolarHBondContact O-N 3.01Å |
| 90 | R | 83.3 | Confident | 83.6 | Confident | 184 Ų | 184 | 86.3 Ų | 86.3 | 69% | 0.694 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -58.6 | -39.4 | 174.3 | -77.5 | 178.7 | 179 | -179.4 | 1.1 | 111.6 | N86 F87 R94 | N86-R90 WeakPolarHBondContact O-CB 3.27Å; N86-R90 WeakPolarHBondContact O-CG 3.36Å; N86-R90 PolarHBondContact O-N 3.49Å; F87-R90 PolarHBondContact O-N 3.48Å; R90-R94 VanDerWaalsContact O-CG 3.3Å; R90-R94 WeakPolarHBondContact O-CG 3.29Å; R90-R94 PolarHBondContact O-N 3.38Å; R90-R94 VanDerWaalsContact O-N 3.08Å |
| 91 | R | 80.6 | Confident | 83.5 | Confident | 48 Ų | 48 | 93.4 Ų | 93.4 | 18% | 0.181 | 42% | 0.416 | C | S | . | . | H | α-helix | trans | -67.3 | -48.9 | 179.2 | -159.3 | -148.5 | 100.4 | 116.3 | 13.8 | 111.7 | H31 F87 Q88 H89 S93 R94 E95 | H31-R91 PolarHBondContact CD2-NH1 2.96Å; H31-R91 PolarHBondContact CE1-NH1 3.44Å; H31-R91 PolarHBondContact CE1-NH2 3.33Å; H31-R91 PolarHBondContact ND1-NH1 3.26Å; H31-R91 PolarHBondContact NE2-NH1 2.92Å; H31-R91 PolarHBondContact NE2-NH2 2.89Å; F87-R91 WeakPolarHBondContact O-CB 3.45Å; F87-R91 PolarHBondContact O-N 3.45Å; Q88-R91 WeakPolarHBondContact O-CB 3.48Å; Q88-R91 PolarHBondContact O-N 3.05Å; H89-R91 PolarHBondContact O-N 3.1Å; R91-S93 VanDerWaalsContact C-N 3.35Å; R91-S93 PolarHBondContact O-N 3.1Å; R91-R94 PolarHBondContact O-N 3.41Å; R91-E95 IonicContact CZ-OE2 3.66Å; R91-E95 IonicContact NH2-OE2 3.19Å; R91-E95 PolarHBondContact NH2-OE2 3.47Å; R91-E95 PolarHBondContact O-N 3.48Å |
| 92 | Y | 81.2 | Confident | 83.4 | Confident | 148 Ų | 148 | 96.2 Ų | 96.2 | 58% | 0.58 | 43% | 0.429 | S | S | * | . | H | α-helix | trans | -60.7 | -44.7 | 177.5 | -172.8 | -95.4 | 0 | 0 | 0 | 111.2 | Q88 H89 R94 E95 T96 | Q88-Y92 WeakPolarHBondContact O-CB 3.35Å; Q88-Y92 PolarHBondContact O-N 2.98Å; H89-Y92 PolarHBondContact O-N 3.36Å; Y92-R94 VanDerWaalsContact C-N 3.33Å; Y92-R94 PolarHBondContact O-N 3.03Å; Y92-E95 PolarHBondContact O-N 3.39Å; Y92-E95 VanDerWaalsContact O-N 3.16Å; Y92-T96 HydrophobicContact CD1-CG2 4.01Å; Y92-T96 HydrophobicContact CE1-CG2 3.62Å; Y92-T96 WeakPolarHBondContact O-CG2 3.27Å; Y92-T96 PolarHBondContact O-N 3.49Å; Y92-T96 PolarHBondContact O-OG1 3.04Å |
| 93 | S | 83.3 | Confident | 83.3 | Confident | 41 Ų | 41 | 98.5 Ų | 98.5 | 29% | 0.287 | 43% | 0.434 | S | S | . | . | H | α-helix | trans | -61.4 | -38.3 | 176.9 | -180 | 0 | 0 | 0 | 0 | 112.7 | H89 R91 T96 Q97 | H89-S93 VanDerWaalsContact O-CB 3.32Å; H89-S93 WeakPolarHBondContact O-CB 3.45Å; H89-S93 PolarHBondContact O-N 3.01Å; R91-S93 VanDerWaalsContact C-N 3.35Å; R91-S93 PolarHBondContact O-N 3.1Å; S93-T96 WeakPolarHBondContact CA-OG1 3.42Å; S93-T96 PolarHBondContact O-OG1 2.92Å; S93-Q97 WeakPolarHBondContact O-CB 3.36Å; S93-Q97 WeakPolarHBondContact O-CG 3.33Å; S93-Q97 PolarHBondContact O-N 3.31Å; S93-Q97 VanDerWaalsContact O-N 3.09Å |
| 94 | R | 83.9 | Confident | 83.1 | Confident | 163 Ų | 163 | 102.8 Ų | 102.8 | 62% | 0.615 | 45% | 0.452 | S | S | * | . | H | α-helix | trans | -67.2 | -42 | 173.1 | -74.6 | 176.2 | -176.9 | -159.6 | 1 | 112.1 | R90 R91 Y92 Q97 D98 | R90-R94 VanDerWaalsContact O-CG 3.3Å; R90-R94 WeakPolarHBondContact O-CG 3.29Å; R90-R94 PolarHBondContact O-N 3.38Å; R90-R94 VanDerWaalsContact O-N 3.08Å; R91-R94 PolarHBondContact O-N 3.41Å; Y92-R94 VanDerWaalsContact C-N 3.33Å; Y92-R94 PolarHBondContact O-N 3.03Å; R94-Q97 PolarHBondContact O-N 3.43Å; R94-D98 WeakPolarHBondContact O-CB 3.49Å; R94-D98 PolarHBondContact O-N 2.91Å |
| 95 | E | 82.8 | Confident | 82.5 | Confident | 53 Ų | 53 | 108.8 Ų | 108.8 | 25% | 0.248 | 48% | 0.482 | C | S | . | . | H | α-helix | trans | -66.2 | -38.5 | 179.3 | -168.8 | -175.6 | 164.9 | 0 | 0 | 112 | R91 Y92 D98 R99 | R91-E95 IonicContact CZ-OE2 3.66Å; R91-E95 IonicContact NH2-OE2 3.19Å; R91-E95 PolarHBondContact NH2-OE2 3.47Å; R91-E95 PolarHBondContact O-N 3.48Å; Y92-E95 PolarHBondContact O-N 3.39Å; Y92-E95 VanDerWaalsContact O-N 3.16Å; E95-D98 PolarHBondContact O-N 3.36Å; E95-R99 WeakPolarHBondContact O-CB 3.45Å; E95-R99 WeakPolarHBondContact O-CG 3.18Å; E95-R99 PolarHBondContact O-N 3.38Å; E95-R99 IonicContact OE1-CZ 2.85Å; E95-R99 IonicContact OE1-NH1 2.84Å; E95-R99 PolarHBondContact OE1-NH1 3Å; E95-R99 IonicContact OE1-NH2 2.83Å; E95-R99 PolarHBondContact OE1-NH2 3.28Å |
| 96 | T | 80.4 | Confident | 81.8 | Confident | 38 Ų | 38 | 103.9 Ų | 103.9 | 23% | 0.233 | 48% | 0.476 | C | S | . | . | H | α-helix | trans | -66.3 | -41 | 173.9 | 52.3 | 0 | 0 | 0 | 0 | 111.5 | Y92 S93 R99 E100 | Y92-T96 HydrophobicContact CD1-CG2 4.01Å; Y92-T96 HydrophobicContact CE1-CG2 3.62Å; Y92-T96 WeakPolarHBondContact O-CG2 3.27Å; Y92-T96 PolarHBondContact O-N 3.49Å; Y92-T96 PolarHBondContact O-OG1 3.04Å; S93-T96 WeakPolarHBondContact CA-OG1 3.42Å; S93-T96 PolarHBondContact O-OG1 2.92Å; T96-R99 PolarHBondContact O-N 3.48Å; T96-E100 WeakPolarHBondContact O-CB 3.23Å; T96-E100 WeakPolarHBondContact O-CG 3.48Å; T96-E100 PolarHBondContact O-N 2.85Å |
| 97 | Q | 84.5 | Confident | 80.9 | Confident | 112 Ų | 112 | 108.8 Ų | 108.8 | 52% | 0.523 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -64.1 | -42.5 | 175.7 | -74.5 | 170.4 | 11.9 | 0 | 0 | 112.4 | S93 R94 E100 R101 | S93-Q97 WeakPolarHBondContact O-CB 3.36Å; S93-Q97 WeakPolarHBondContact O-CG 3.33Å; S93-Q97 PolarHBondContact O-N 3.31Å; S93-Q97 VanDerWaalsContact O-N 3.09Å; R94-Q97 PolarHBondContact O-N 3.43Å; Q97-E100 PolarHBondContact O-N 2.78Å; Q97-R101 VanDerWaalsContact O-CB 3.26Å; Q97-R101 WeakPolarHBondContact O-CB 3.46Å; Q97-R101 PolarHBondContact O-N 2.92Å |
| 98 | D | 82.8 | Confident | 79.5 | Confident | 60 Ų | 60 | 111.7 Ų | 111.7 | 32% | 0.321 | 51% | 0.51 | S | S | . | . | H | α-helix | trans | -63.5 | -43.1 | 176.4 | -74.4 | -15.1 | 0 | 0 | 0 | 110.3 | R27 R94 E95 R101 E102 | R27-D98 IonicContact CZ-OD2 3.74Å; R27-D98 IonicContact NH1-OD2 2.66Å; R27-D98 IonicContact NH2-OD2 3.4Å; R27-D98 PolarHBondContact NH2-OD2 3.29Å; R94-D98 WeakPolarHBondContact O-CB 3.49Å; R94-D98 PolarHBondContact O-N 2.91Å; E95-D98 PolarHBondContact O-N 3.36Å; D98-R101 WeakPolarHBondContact O-CB 3.48Å; D98-R101 PolarHBondContact O-N 3.5Å; D98-E102 WeakPolarHBondContact O-CG 3.48Å; D98-E102 PolarHBondContact O-N 2.86Å |
| 99 | R | 84.8 | Confident | 78.1 | Confident | 130 Ų | 130 | 117.9 Ų | 117.9 | 49% | 0.491 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.7 | -48.9 | 174.6 | -82.4 | -168.9 | 177.8 | 106.7 | 12 | 112.9 | E95 T96 R101 E102 E103 | E95-R99 WeakPolarHBondContact O-CB 3.45Å; E95-R99 WeakPolarHBondContact O-CG 3.18Å; E95-R99 PolarHBondContact O-N 3.38Å; E95-R99 IonicContact OE1-CZ 2.85Å; E95-R99 IonicContact OE1-NH1 2.84Å; E95-R99 PolarHBondContact OE1-NH1 3Å; E95-R99 IonicContact OE1-NH2 2.83Å; E95-R99 PolarHBondContact OE1-NH2 3.28Å; T96-R99 PolarHBondContact O-N 3.48Å; R99-R101 VanDerWaalsContact C-N 3.25Å; R99-R101 PolarHBondContact O-N 3.34Å; R99-E102 PolarHBondContact O-N 2.97Å; R99-E102 VanDerWaalsContact O-N 3.14Å; R99-E103 WeakPolarHBondContact O-CG 3.43Å; R99-E103 PolarHBondContact O-N 3.32Å |
| 100 | E | 83.3 | Confident | 76.6 | Confident | 118 Ų | 118 | 117.6 Ų | 117.6 | 55% | 0.551 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -59 | -40.6 | 177.2 | -76.2 | 172.9 | -170.9 | 0 | 0 | 110.9 | T96 Q97 E103 L104 | T96-E100 WeakPolarHBondContact O-CB 3.23Å; T96-E100 WeakPolarHBondContact O-CG 3.48Å; T96-E100 PolarHBondContact O-N 2.85Å; Q97-E100 PolarHBondContact O-N 2.78Å; E100-E103 PolarHBondContact O-N 2.92Å; E100-L104 WeakPolarHBondContact O-CB 3.43Å; E100-L104 VanDerWaalsContact O-CG 3.22Å; E100-L104 WeakPolarHBondContact O-CG 3.18Å; E100-L104 PolarHBondContact O-N 2.75Å |
| 101 | R | 82.7 | Confident | 74.9 | Confident | 157 Ų | 157 | 114.6 Ų | 114.6 | 59% | 0.592 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -62.8 | -45.1 | 174.8 | -176.5 | -173.7 | 177.6 | 104.3 | 1.6 | 111.6 | Q97 D98 R99 L104 M105 | Q97-R101 VanDerWaalsContact O-CB 3.26Å; Q97-R101 WeakPolarHBondContact O-CB 3.46Å; Q97-R101 PolarHBondContact O-N 2.92Å; D98-R101 WeakPolarHBondContact O-CB 3.48Å; D98-R101 PolarHBondContact O-N 3.5Å; R99-R101 VanDerWaalsContact C-N 3.25Å; R99-R101 PolarHBondContact O-N 3.34Å; R101-L104 PolarHBondContact O-N 2.84Å; R101-M105 HydrophobicContact CG-CE 3.88Å; R101-M105 HydrophobicContact CG-SD 4.1Å; R101-M105 WeakPolarHBondContact O-CB 3.31Å; R101-M105 WeakPolarHBondContact O-CG 3.34Å; R101-M105 PolarHBondContact O-N 2.82Å |
| 102 | E | 83.1 | Confident | 73.4 | Confident | 133 Ų | 133 | 119.1 Ų | 119.1 | 62% | 0.621 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -63.4 | -40.6 | 176.3 | -77 | 178.4 | -177.6 | 0 | 0 | 112 | D98 R99 M105 S106 | D98-E102 WeakPolarHBondContact O-CG 3.48Å; D98-E102 PolarHBondContact O-N 2.86Å; R99-E102 PolarHBondContact O-N 2.97Å; R99-E102 VanDerWaalsContact O-N 3.14Å; E102-M105 CarbonylContact O-C 3.6Å; E102-M105 PolarHBondContact O-N 3.4Å; E102-S106 VanDerWaalsContact O-CB 3.25Å; E102-S106 WeakPolarHBondContact O-CB 3.34Å; E102-S106 PolarHBondContact O-N 3.5Å; E102-S106 PolarHBondContact O-OG 2.77Å |
| 103 | E | 83.4 | Confident | 71.5 | Confident | 129 Ų | 129 | 120 Ų | 120 | 60% | 0.603 | 59% | 0.589 | S | S | * | * | H | α-helix | trans | -61 | -45.9 | 174.9 | -74.8 | 178.9 | -176.8 | 0 | 0 | 111.3 | R99 E100 M105 S106 R107 | R99-E103 WeakPolarHBondContact O-CG 3.43Å; R99-E103 PolarHBondContact O-N 3.32Å; E100-E103 PolarHBondContact O-N 2.92Å; E103-M105 VanDerWaalsContact C-N 3.31Å; E103-M105 PolarHBondContact O-N 2.85Å; E103-S106 WeakPolarHBondContact CA-OG 3.35Å; E103-S106 PolarHBondContact O-N 3.37Å; E103-S106 PolarHBondContact O-OG 3.41Å; E103-R107 PolarHBondContact O-N 3.19Å |
| 104 | L | 78.1 | Confident | 69.9 | Low | 122 Ų | 122 | 123.1 Ų | 123.1 | 64% | 0.639 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -62.6 | -36.4 | 174.9 | -69.8 | 170.6 | 0 | 0 | 0 | 112.5 | E100 R101 | E100-L104 WeakPolarHBondContact O-CB 3.43Å; E100-L104 VanDerWaalsContact O-CG 3.22Å; E100-L104 WeakPolarHBondContact O-CG 3.18Å; E100-L104 PolarHBondContact O-N 2.75Å; R101-L104 PolarHBondContact O-N 2.84Å |
| 105 | M | 70.6 | Confident | 68 | Low | 126 Ų | 126 | 122.5 Ų | 122.5 | 62% | 0.621 | 62% | 0.62 | S | S | * | * | H | α-helix | trans | -75.4 | -33.2 | 176.6 | -73.2 | 179.9 | 170.3 | 0 | 0 | 113.1 | R101 E102 E103 R107 | R101-M105 HydrophobicContact CG-CE 3.88Å; R101-M105 HydrophobicContact CG-SD 4.1Å; R101-M105 WeakPolarHBondContact O-CB 3.31Å; R101-M105 WeakPolarHBondContact O-CG 3.34Å; R101-M105 PolarHBondContact O-N 2.82Å; E102-M105 CarbonylContact O-C 3.6Å; E102-M105 PolarHBondContact O-N 3.4Å; E103-M105 VanDerWaalsContact C-N 3.31Å; E103-M105 PolarHBondContact O-N 2.85Å; M105-R107 VanDerWaalsContact C-N 3.27Å |
| 106 | S | 72.8 | Confident | 66.6 | Low | 85 Ų | 85 | 126.3 Ų | 126.3 | 59% | 0.594 | 65% | 0.646 | S | S | * | * | H | α-helix | trans | -75.7 | -19.1 | 178.1 | 75.8 | 0 | 0 | 0 | 0 | 112.6 | E102 E103 T108 | E102-S106 VanDerWaalsContact O-CB 3.25Å; E102-S106 WeakPolarHBondContact O-CB 3.34Å; E102-S106 PolarHBondContact O-N 3.5Å; E102-S106 PolarHBondContact O-OG 2.77Å; E103-S106 WeakPolarHBondContact CA-OG 3.35Å; E103-S106 PolarHBondContact O-N 3.37Å; E103-S106 PolarHBondContact O-OG 3.41Å; S106-T108 VanDerWaalsContact C-N 3.26Å; S106-T108 PolarHBondContact O-N 2.99Å |
| 107 | R | 64 | Low | 64.8 | Low | 192 Ų | 192 | 129.2 Ų | 129.2 | 73% | 0.725 | 67% | 0.668 | S | S | * | * | S | Bend | trans | -67 | 89.5 | 172.6 | -161 | 177.2 | 179.2 | -162.4 | -2.8 | 108.4 | E103 M105 F109 | E103-R107 PolarHBondContact O-N 3.19Å; M105-R107 VanDerWaalsContact C-N 3.27Å; R107-F109 PolarHBondContact O-N 2.98Å |
| 108 | T | 55.5 | Low | 62.9 | Low | 115 Ų | 115 | 130.1 Ų | 130.1 | 71% | 0.706 | 68% | 0.675 | S | S | * | * | trans | -55 | 111.6 | 176.8 | -65.7 | 0 | 0 | 0 | 0 | 108.5 | S106 T110 | S106-T108 VanDerWaalsContact C-N 3.26Å; S106-T108 PolarHBondContact O-N 2.99Å; T108-T110 VanDerWaalsContact C-N 3.35Å; T108-T110 HydrophobicContact CG2-CG2 4.32Å; T108-T110 PolarHBondContact O-N 3.3Å | ||
| 109 | F | 54.3 | Low | 61.5 | Low | 192 Ų | 192 | 131.9 Ų | 131.9 | 84% | 0.842 | 69% | 0.69 | S | S | * | * | trans | -65.4 | 97.8 | 167.3 | -89.6 | -93.1 | 0 | 0 | 0 | 107.7 | R107 T111 | R107-F109 PolarHBondContact O-N 2.98Å; F109-T111 PolarHBondContact O-N 3.08Å; F109-T111 VanDerWaalsContact O-N 3.15Å | ||
| 110 | T | 53.7 | Low | 60 | Low | 123 Ų | 123 | 130.6 Ų | 130.6 | 76% | 0.755 | 69% | 0.692 | S | S | * | * | trans | -72.4 | 102.6 | 169.8 | 52.7 | 0 | 0 | 0 | 0 | 107.9 | T108 N112 | T108-T110 VanDerWaalsContact C-N 3.35Å; T108-T110 HydrophobicContact CG2-CG2 4.32Å; T108-T110 PolarHBondContact O-N 3.3Å; T110-N112 PolarHBondContact O-N 2.88Å; T110-N112 VanDerWaalsContact O-N 3.11Å | ||
| 111 | T | 47.5 | Very low | 58.7 | Low | 122 Ų | 122 | 129.9 Ų | 129.9 | 75% | 0.748 | 69% | 0.692 | S | S | * | * | trans | -74.3 | 96.2 | 169 | 52.1 | 0 | 0 | 0 | 0 | 108.6 | F109 | F109-T111 PolarHBondContact O-N 3.08Å; F109-T111 VanDerWaalsContact O-N 3.15Å | ||
| 112 | N | 48.3 | Very low | 57.5 | Low | 142 Ų | 142 | 129.1 Ų | 129.1 | 76% | 0.759 | 70% | 0.695 | S | S | * | * | trans | 149.8 | 91.1 | 151.6 | -79.9 | -28.8 | 0 | 0 | 0 | 108.3 | T110 | T110-N112 PolarHBondContact O-N 2.88Å; T110-N112 VanDerWaalsContact O-N 3.11Å | ||
| 113 | D | 41.8 | Very low | 56.4 | Low | 167 Ų | 167 | 127.2 Ų | 127.2 | 89% | 0.893 | 69% | 0.693 | S | S | * | * | trans | -126 | 100.9 | 131.7 | -117.7 | -20.5 | 0 | 0 | 0 | 106.7 | D115 | D113-D115 VanDerWaalsContact C-N 3.28Å; D113-D115 PolarHBondContact O-N 2.89Å; D113-D115 VanDerWaalsContact O-N 3.07Å | ||
| 114 | S | 49.1 | Very low | 55.6 | Low | 106 Ų | 106 | 126.1 Ų | 126.1 | 74% | 0.741 | 69% | 0.691 | S | S | * | * | trans | -75.1 | 80.6 | 176.7 | 50.2 | 0 | 0 | 0 | 0 | 108.2 | ||||
| 115 | D | 44.9 | Very low | 55.1 | Low | 151 Ų | 151 | 125 Ų | 125 | 81% | 0.807 | 68% | 0.682 | S | S | * | * | trans | -144.6 | 130.1 | 155.4 | -135.9 | -13.1 | 0 | 0 | 0 | 112.1 | D113 | D113-D115 VanDerWaalsContact C-N 3.28Å; D113-D115 PolarHBondContact O-N 2.89Å; D113-D115 VanDerWaalsContact O-N 3.07Å | ||
| 116 | T | 53.5 | Low | 55.2 | Low | 132 Ų | 132 | 124.1 Ų | 124.1 | 81% | 0.81 | 68% | 0.679 | S | S | * | * | trans | -85.7 | 115.6 | -170.6 | -58.1 | 0 | 0 | 0 | 0 | 108 | ||||
| 117 | S | 42.7 | Very low | 55.4 | Low | 99 Ų | 99 | 124.7 Ų | 124.7 | 69% | 0.692 | 68% | 0.676 | S | S | * | * | trans | -168.8 | 112 | 147.6 | 38.7 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 118 | I | 43.4 | Very low | 56.1 | Low | 131 Ų | 131 | 118 Ų | 118 | 67% | 0.672 | 66% | 0.658 | S | S | * | * | trans | 76 | 126.5 | 145.5 | -49.2 | 166.7 | 0 | 0 | 0 | 116 | I120 | I118-I120 HydrophobicContact CG2-CD1 4.28Å; I118-I120 HydrophobicContact CG2-CG1 4Å; I118-I120 PolarHBondContact O-N 3.4Å | ||
| 119 | P | 54.6 | Low | 57.1 | Low | 98 Ų | 98 | 117 Ų | 117 | 64% | 0.636 | 65% | 0.649 | S | S | * | * | trans | -72.2 | 74.4 | 176.6 | 32.7 | -34.6 | 0 | 0 | 0 | 110.7 | ||||
| 120 | I | 52.1 | Low | 58.4 | Low | 103 Ų | 103 | 112.8 Ų | 112.8 | 53% | 0.528 | 63% | 0.634 | S | S | . | * | trans | -88.2 | -25.2 | 167.8 | -72.4 | 171.7 | 0 | 0 | 0 | 109.8 | I118 T123 L124 | I118-I120 HydrophobicContact CG2-CD1 4.28Å; I118-I120 HydrophobicContact CG2-CG1 4Å; I118-I120 PolarHBondContact O-N 3.4Å; I120-T123 PolarHBondContact O-OG1 3.35Å; I120-T123 VanDerWaalsContact O-OG1 3.06Å; I120-L124 HydrophobicContact CG2-CD1 4.01Å; I120-L124 PolarHBondContact O-N 3.22Å | ||
| 121 | D | 55.8 | Low | 60 | Low | 102 Ų | 102 | 110.5 Ų | 110.5 | 55% | 0.545 | 62% | 0.618 | S | S | . | * | H | α-helix | trans | -72.8 | -31.6 | -177.2 | -156.1 | 38.8 | 0 | 0 | 0 | 113.1 | T123 L124 Q125 | D121-T123 VanDerWaalsContact C-N 3.35Å; D121-T123 PolarHBondContact O-N 3.26Å; D121-L124 PolarHBondContact O-N 3.5Å; D121-Q125 VanDerWaalsContact O-CB 3.23Å; D121-Q125 WeakPolarHBondContact O-CB 3.48Å; D121-Q125 VanDerWaalsContact O-CG 3.23Å; D121-Q125 WeakPolarHBondContact O-CG 3.48Å; D121-Q125 PolarHBondContact O-N 2.92Å; D121-Q125 PolarHBondContact OD2-NE2 3.24Å |
| 122 | E | 59.5 | Low | 61.5 | Low | 142 Ų | 142 | 109.2 Ų | 109.2 | 66% | 0.664 | 61% | 0.606 | S | S | * | * | H | α-helix | trans | -66.6 | -36.8 | 178.6 | -163.3 | 173.4 | -163 | 0 | 0 | 111.7 | L126 | E122-L126 WeakPolarHBondContact O-CB 3.39Å; E122-L126 PolarHBondContact O-N 2.98Å |
| 123 | T | 58.5 | Low | 63.1 | Low | 93 Ų | 93 | 105.3 Ų | 105.3 | 57% | 0.571 | 59% | 0.594 | S | S | * | * | H | α-helix | trans | -76.6 | -34.3 | 177.4 | 61.1 | 0 | 0 | 0 | 0 | 113 | I120 D121 N127 | I120-T123 PolarHBondContact O-OG1 3.35Å; I120-T123 VanDerWaalsContact O-OG1 3.06Å; D121-T123 VanDerWaalsContact C-N 3.35Å; D121-T123 PolarHBondContact O-N 3.26Å; T123-N127 WeakPolarHBondContact O-CB 3.33Å; T123-N127 PolarHBondContact O-N 3.43Å |
| 124 | L | 66.9 | Low | 65.2 | Low | 106 Ų | 106 | 102.2 Ų | 102.2 | 56% | 0.555 | 57% | 0.573 | S | S | * | * | H | α-helix | trans | -69.5 | -42.1 | 172.6 | -84.3 | 166.6 | 0 | 0 | 0 | 111.7 | I120 D121 N127 S128 | I120-L124 HydrophobicContact CG2-CD1 4.01Å; I120-L124 PolarHBondContact O-N 3.22Å; D121-L124 PolarHBondContact O-N 3.5Å; L124-N127 PolarHBondContact O-N 2.94Å; L124-S128 WeakPolarHBondContact O-CB 3.46Å; L124-S128 PolarHBondContact O-N 3.32Å; L124-S128 PolarHBondContact O-OG 3.42Å |
| 125 | Q | 68.5 | Low | 66.9 | Low | 98 Ų | 98 | 104.5 Ų | 104.5 | 46% | 0.458 | 57% | 0.566 | S | S | . | * | H | α-helix | trans | -64.1 | -44.9 | 172.5 | -73.6 | -174.7 | 26.5 | 0 | 0 | 110.8 | D121 N127 S128 N129 | D121-Q125 VanDerWaalsContact O-CB 3.23Å; D121-Q125 WeakPolarHBondContact O-CB 3.48Å; D121-Q125 VanDerWaalsContact O-CG 3.23Å; D121-Q125 WeakPolarHBondContact O-CG 3.48Å; D121-Q125 PolarHBondContact O-N 2.92Å; D121-Q125 PolarHBondContact OD2-NE2 3.24Å; Q125-N127 VanDerWaalsContact C-N 3.3Å; Q125-N127 PolarHBondContact O-N 3.1Å; Q125-S128 WeakPolarHBondContact CA-OG 3.48Å; Q125-S128 PolarHBondContact O-N 3.01Å; Q125-S128 PolarHBondContact O-OG 3.29Å; Q125-N129 VanDerWaalsContact O-CB 3.26Å; Q125-N129 WeakPolarHBondContact O-CB 3.43Å; Q125-N129 PolarHBondContact O-N 3.12Å; Q125-N129 PolarHBondContact O-ND2 3.04Å |
| 126 | L | 71.6 | Confident | 68.7 | Low | 108 Ų | 108 | 98.9 Ų | 98.9 | 57% | 0.565 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -61.7 | -39.1 | 175.1 | -158.8 | 94.1 | 0 | 0 | 0 | 111.4 | E122 N129 L130 | E122-L126 WeakPolarHBondContact O-CB 3.39Å; E122-L126 PolarHBondContact O-N 2.98Å; L126-N129 PolarHBondContact O-N 3.41Å; L126-L130 HydrophobicContact CD2-CD1 4.47Å; L126-L130 VanDerWaalsContact O-CB 3.23Å; L126-L130 WeakPolarHBondContact O-CB 3.44Å; L126-L130 PolarHBondContact O-N 2.99Å |
| 127 | N | 76.3 | Confident | 70.1 | Confident | 97 Ų | 97 | 97.1 Ų | 97.1 | 52% | 0.519 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -65.7 | -44.1 | 175.5 | -167.3 | -79.9 | 0 | 0 | 0 | 111.2 | T123 L124 Q125 L130 N131 | T123-N127 WeakPolarHBondContact O-CB 3.33Å; T123-N127 PolarHBondContact O-N 3.43Å; L124-N127 PolarHBondContact O-N 2.94Å; Q125-N127 VanDerWaalsContact C-N 3.3Å; Q125-N127 PolarHBondContact O-N 3.1Å; N127-L130 WeakPolarHBondContact O-CB 3.34Å; N127-L130 PolarHBondContact O-N 3.14Å; N127-N131 WeakPolarHBondContact O-CB 3.48Å; N127-N131 PolarHBondContact O-N 3.4Å |
| 128 | S | 78.9 | Confident | 72.3 | Confident | 51 Ų | 51 | 96.3 Ų | 96.3 | 36% | 0.357 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -64.4 | -40.1 | 176.4 | 76.3 | 0 | 0 | 0 | 0 | 112.1 | L124 Q125 N131 N132 | L124-S128 WeakPolarHBondContact O-CB 3.46Å; L124-S128 PolarHBondContact O-N 3.32Å; L124-S128 PolarHBondContact O-OG 3.42Å; Q125-S128 WeakPolarHBondContact CA-OG 3.48Å; Q125-S128 PolarHBondContact O-N 3.01Å; Q125-S128 PolarHBondContact O-OG 3.29Å; S128-N131 PolarHBondContact O-N 3.3Å; S128-N132 WeakPolarHBondContact O-CB 3.29Å; S128-N132 VanDerWaalsContact O-CG 3.26Å; S128-N132 PolarHBondContact O-N 2.92Å; S128-N132 PolarHBondContact O-ND2 3.26Å |
| 129 | N | 77.5 | Confident | 74.3 | Confident | 95 Ų | 95 | 95.8 Ų | 95.8 | 51% | 0.508 | 51% | 0.514 | S | S | . | . | H | α-helix | trans | -69.2 | -38.1 | 175.5 | -70.2 | -20.1 | 0 | 0 | 0 | 111.2 | Q125 L126 A133 | Q125-N129 VanDerWaalsContact O-CB 3.26Å; Q125-N129 WeakPolarHBondContact O-CB 3.43Å; Q125-N129 PolarHBondContact O-N 3.12Å; Q125-N129 PolarHBondContact O-ND2 3.04Å; L126-N129 PolarHBondContact O-N 3.41Å; N129-A133 WeakPolarHBondContact O-CB 3.41Å; N129-A133 PolarHBondContact O-N 3.45Å |
| 130 | L | 81.9 | Confident | 75.5 | Confident | 102 Ų | 102 | 97.3 Ų | 97.3 | 53% | 0.534 | 52% | 0.516 | S | S | . | . | H | α-helix | trans | -63.8 | -42.3 | 170.9 | -102.9 | 164.4 | 0 | 0 | 0 | 111.2 | L126 N127 A133 H134 | L126-L130 HydrophobicContact CD2-CD1 4.47Å; L126-L130 VanDerWaalsContact O-CB 3.23Å; L126-L130 WeakPolarHBondContact O-CB 3.44Å; L126-L130 PolarHBondContact O-N 2.99Å; N127-L130 WeakPolarHBondContact O-CB 3.34Å; N127-L130 PolarHBondContact O-N 3.14Å; L130-A133 PolarHBondContact O-N 2.81Å; L130-H134 VanDerWaalsContact O-CB 3.29Å; L130-H134 WeakPolarHBondContact O-CB 3.45Å; L130-H134 PolarHBondContact O-N 3.41Å |
| 131 | N | 85.7 | Confident | 77.1 | Confident | 76 Ų | 76 | 97.7 Ų | 97.7 | 41% | 0.406 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -66.3 | -42.8 | 178.7 | -138.6 | -49.8 | 0 | 0 | 0 | 110.7 | N127 S128 H134 R135 | N127-N131 WeakPolarHBondContact O-CB 3.48Å; N127-N131 PolarHBondContact O-N 3.4Å; S128-N131 PolarHBondContact O-N 3.3Å; N131-H134 PolarHBondContact O-N 2.83Å; N131-R135 WeakPolarHBondContact O-CG 3.37Å; N131-R135 PolarHBondContact O-N 3.44Å |
| 132 | N | 80.5 | Confident | 78.5 | Confident | 94 Ų | 94 | 94.8 Ų | 94.8 | 50% | 0.503 | 51% | 0.513 | S | S | . | . | H | α-helix | trans | -66 | -40.2 | 174.2 | -73.5 | -18.5 | 0 | 0 | 0 | 112 | S128 R135 G136 | S128-N132 WeakPolarHBondContact O-CB 3.29Å; S128-N132 VanDerWaalsContact O-CG 3.26Å; S128-N132 PolarHBondContact O-N 2.92Å; S128-N132 PolarHBondContact O-ND2 3.26Å; N132-R135 PolarHBondContact O-N 2.85Å; N132-G136 PolarHBondContact O-N 3.13Å |
| 133 | A | 81.6 | Confident | 79.4 | Confident | 61 Ų | 61 | 91 Ų | 91 | 50% | 0.504 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -66.1 | -37.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | N129 L130 G136 M137 | N129-A133 WeakPolarHBondContact O-CB 3.41Å; N129-A133 PolarHBondContact O-N 3.45Å; L130-A133 PolarHBondContact O-N 2.81Å; A133-G136 PolarHBondContact O-N 2.85Å; A133-M137 VanDerWaalsContact O-CB 3.27Å; A133-M137 WeakPolarHBondContact O-CB 3.33Å; A133-M137 PolarHBondContact O-N 3.41Å |
| 134 | H | 85 | Confident | 80.6 | Confident | 101 Ų | 101 | 88.3 Ų | 88.3 | 47% | 0.468 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -64.9 | -45.9 | 175.7 | -146.1 | 96.3 | 0 | 0 | 0 | 110.7 | L130 N131 M137 D138 | L130-H134 VanDerWaalsContact O-CB 3.29Å; L130-H134 WeakPolarHBondContact O-CB 3.45Å; L130-H134 PolarHBondContact O-N 3.41Å; N131-H134 PolarHBondContact O-N 2.83Å; H134-M137 PolarHBondContact O-N 2.79Å; H134-D138 IonicContact CD2-OD2 3.61Å; H134-D138 WeakPolarHBondContact O-CB 3.36Å; H134-D138 PolarHBondContact O-N 3.42Å |
| 135 | R | 84.9 | Confident | 81.5 | Confident | 154 Ų | 154 | 86.6 Ų | 86.6 | 58% | 0.581 | 49% | 0.49 | S | S | * | . | H | α-helix | trans | -62 | -43.3 | 174.3 | -70.7 | 178.9 | -160.1 | -175.2 | 4.9 | 112.2 | N131 N132 M137 D138 D139 | N131-R135 WeakPolarHBondContact O-CG 3.37Å; N131-R135 PolarHBondContact O-N 3.44Å; N132-R135 PolarHBondContact O-N 2.85Å; R135-M137 VanDerWaalsContact C-N 3.3Å; R135-M137 PolarHBondContact O-N 3.36Å; R135-D138 PolarHBondContact O-N 3.25Å; R135-D139 WeakPolarHBondContact O-CB 3.42Å; R135-D139 PolarHBondContact O-N 2.83Å |
| 136 | G | 82.7 | Confident | 81.8 | Confident | 34 Ų | 34 | 85.4 Ų | 85.4 | 35% | 0.351 | 49% | 0.493 | S | S | . | . | H | α-helix | trans | -62.5 | -37.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | N132 A133 L140 | N132-G136 PolarHBondContact O-N 3.13Å; A133-G136 PolarHBondContact O-N 2.85Å; G136-L140 WeakPolarHBondContact O-CB 3.32Å; G136-L140 VanDerWaalsContact O-CG 3.23Å; G136-L140 WeakPolarHBondContact O-CG 3.37Å; G136-L140 PolarHBondContact O-N 3.04Å |
| 137 | M | 84.4 | Confident | 82.3 | Confident | 94 Ų | 94 | 85.4 Ų | 85.4 | 46% | 0.463 | 49% | 0.492 | S | S | . | . | H | α-helix | trans | -70.8 | -38.2 | 175.2 | -167 | 178.1 | 68 | 0 | 0 | 112 | A133 H134 R135 L140 L141 | A133-M137 VanDerWaalsContact O-CB 3.27Å; A133-M137 WeakPolarHBondContact O-CB 3.33Å; A133-M137 PolarHBondContact O-N 3.41Å; H134-M137 PolarHBondContact O-N 2.79Å; R135-M137 VanDerWaalsContact C-N 3.3Å; R135-M137 PolarHBondContact O-N 3.36Å; M137-L140 PolarHBondContact O-N 3.3Å; M137-L141 HydrophobicContact CG-CD1 4.38Å; M137-L141 WeakPolarHBondContact O-CB 3.44Å; M137-L141 WeakPolarHBondContact O-CG 3.33Å; M137-L141 PolarHBondContact O-N 2.98Å |
| 138 | D | 87.9 | Confident | 82.8 | Confident | 83 Ų | 83 | 86.6 Ų | 86.6 | 44% | 0.444 | 50% | 0.498 | S | S | . | . | H | α-helix | trans | -65.7 | -39.7 | 174 | -77.5 | -18.8 | 0 | 0 | 0 | 111.7 | H134 R135 L141 G142 | H134-D138 IonicContact CD2-OD2 3.61Å; H134-D138 WeakPolarHBondContact O-CB 3.36Å; H134-D138 PolarHBondContact O-N 3.42Å; R135-D138 PolarHBondContact O-N 3.25Å; D138-L141 PolarHBondContact O-N 2.89Å; D138-G142 PolarHBondContact O-N 3.46Å |
| 139 | D | 84.6 | Confident | 83.1 | Confident | 120 Ų | 120 | 87.5 Ų | 87.5 | 64% | 0.642 | 50% | 0.501 | S | S | * | . | H | α-helix | trans | -65.3 | -38.5 | 173.2 | -91.6 | -7.1 | 0 | 0 | 0 | 111.7 | R135 S143 | R135-D139 WeakPolarHBondContact O-CB 3.42Å; R135-D139 PolarHBondContact O-N 2.83Å; D139-S143 WeakPolarHBondContact O-CB 3.4Å; D139-S143 PolarHBondContact O-N 3.42Å; D139-S143 PolarHBondContact O-OG 2.79Å |
| 140 | L | 80.4 | Confident | 83.3 | Confident | 130 Ų | 130 | 84.4 Ų | 84.4 | 68% | 0.681 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -68.4 | -38.3 | 174 | -73.7 | 171.9 | 0 | 0 | 0 | 112.1 | G136 M137 G144 | G136-L140 WeakPolarHBondContact O-CB 3.32Å; G136-L140 VanDerWaalsContact O-CG 3.23Å; G136-L140 WeakPolarHBondContact O-CG 3.37Å; G136-L140 PolarHBondContact O-N 3.04Å; M137-L140 PolarHBondContact O-N 3.3Å; L140-G144 PolarHBondContact O-N 2.81Å |
| 141 | L | 85.3 | Confident | 83.1 | Confident | 110 Ų | 110 | 84.2 Ų | 84.2 | 58% | 0.576 | 49% | 0.491 | S | S | * | . | H | α-helix | trans | -68.7 | -41.5 | 174.9 | -79.2 | 167.7 | 0 | 0 | 0 | 111.6 | M137 D138 G144 S145 | M137-L141 HydrophobicContact CG-CD1 4.38Å; M137-L141 WeakPolarHBondContact O-CB 3.44Å; M137-L141 WeakPolarHBondContact O-CG 3.33Å; M137-L141 PolarHBondContact O-N 2.98Å; D138-L141 PolarHBondContact O-N 2.89Å; L141-G144 PolarHBondContact O-N 2.97Å; L141-S145 WeakPolarHBondContact O-CB 3.22Å; L141-S145 PolarHBondContact O-N 3.41Å |
| 142 | G | 85 | Confident | 82.9 | Confident | 42 Ų | 42 | 90 Ų | 90 | 43% | 0.433 | 51% | 0.507 | S | S | . | . | H | α-helix | trans | -62.8 | -45.1 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | D138 S145 S146 | D138-G142 PolarHBondContact O-N 3.46Å; G142-S145 PolarHBondContact O-N 3.13Å; G142-S146 PolarHBondContact O-N 3.1Å; G142-S146 PolarHBondContact O-OG 2.94Å |
| 143 | S | 78.8 | Confident | 82.7 | Confident | 61 Ų | 61 | 90.4 Ų | 90.4 | 43% | 0.427 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -63 | -43 | 173.7 | -61.8 | 0 | 0 | 0 | 0 | 111.5 | D139 S145 S146 I147 | D139-S143 WeakPolarHBondContact O-CB 3.4Å; D139-S143 PolarHBondContact O-N 3.42Å; D139-S143 PolarHBondContact O-OG 2.79Å; S143-S145 PolarHBondContact O-N 3.11Å; S143-S146 PolarHBondContact O-N 3.32Å; S143-S146 PolarHBondContact O-OG 3.37Å; S143-I147 WeakPolarHBondContact O-CB 2.91Å; S143-I147 WeakPolarHBondContact O-CD1 3.33Å; S143-I147 WeakPolarHBondContact O-CG1 3.29Å; S143-I147 PolarHBondContact O-N 2.81Å |
| 144 | G | 84.3 | Confident | 81.9 | Confident | 37 Ų | 37 | 93.2 Ų | 93.2 | 38% | 0.381 | 51% | 0.512 | S | S | . | . | H | α-helix | trans | -63.2 | -40.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113.1 | L140 L141 I147 L148 | L140-G144 PolarHBondContact O-N 2.81Å; L141-G144 PolarHBondContact O-N 2.97Å; G144-I147 PolarHBondContact O-N 3.38Å; G144-L148 WeakPolarHBondContact O-CB 3.25Å; G144-L148 PolarHBondContact O-N 3.31Å |
| 145 | S | 85.6 | Confident | 81.4 | Confident | 71 Ų | 71 | 96.6 Ų | 96.6 | 50% | 0.497 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -65.7 | -44 | 175.8 | -177.6 | 0 | 0 | 0 | 0 | 112.2 | L141 G142 S143 L148 T149 | L141-S145 WeakPolarHBondContact O-CB 3.22Å; L141-S145 PolarHBondContact O-N 3.41Å; G142-S145 PolarHBondContact O-N 3.13Å; S143-S145 PolarHBondContact O-N 3.11Å; S145-L148 PolarHBondContact O-N 3.47Å; S145-T149 WeakPolarHBondContact O-CB 3.49Å; S145-T149 PolarHBondContact O-N 3.05Å; S145-T149 PolarHBondContact O-OG1 3.07Å |
| 146 | S | 75.6 | Confident | 80.8 | Confident | 73 Ų | 73 | 91.5 Ų | 91.5 | 51% | 0.51 | 52% | 0.515 | S | S | . | . | H | α-helix | trans | -66.7 | -38.1 | 176.7 | 67.1 | 0 | 0 | 0 | 0 | 112.5 | G142 S143 T149 G150 | G142-S146 PolarHBondContact O-N 3.1Å; G142-S146 PolarHBondContact O-OG 2.94Å; S143-S146 PolarHBondContact O-N 3.32Å; S143-S146 PolarHBondContact O-OG 3.37Å; S146-T149 PolarHBondContact O-N 2.87Å; S146-G150 PolarHBondContact O-N 3.31Å |
| 147 | I | 80.8 | Confident | 80.3 | Confident | 107 Ų | 107 | 94.3 Ų | 94.3 | 55% | 0.549 | 53% | 0.526 | S | S | . | . | H | α-helix | trans | -63.9 | -46.3 | 173.2 | -69.4 | 165 | 0 | 0 | 0 | 110.4 | S143 G144 T149 G150 L151 | S143-I147 WeakPolarHBondContact O-CB 2.91Å; S143-I147 WeakPolarHBondContact O-CD1 3.33Å; S143-I147 WeakPolarHBondContact O-CG1 3.29Å; S143-I147 PolarHBondContact O-N 2.81Å; G144-I147 PolarHBondContact O-N 3.38Å; I147-T149 VanDerWaalsContact C-N 3.3Å; I147-T149 PolarHBondContact O-N 2.79Å; I147-G150 PolarHBondContact O-N 3.47Å; I147-L151 HydrophobicContact CG2-CD1 4.11Å; I147-L151 HydrophobicContact CG2-CG 4.43Å; I147-L151 VanDerWaalsContact O-CG 3.31Å; I147-L151 WeakPolarHBondContact O-CG 3.23Å; I147-L151 PolarHBondContact O-N 3.07Å |
| 148 | L | 87.4 | Confident | 79.3 | Confident | 122 Ų | 122 | 95.6 Ų | 95.6 | 64% | 0.639 | 53% | 0.534 | S | S | * | . | H | α-helix | trans | -62.7 | -38.8 | 178.5 | -173.1 | 64.8 | 0 | 0 | 0 | 112 | G144 S145 L151 R152 | G144-L148 WeakPolarHBondContact O-CB 3.25Å; G144-L148 PolarHBondContact O-N 3.31Å; S145-L148 PolarHBondContact O-N 3.47Å; L148-L151 PolarHBondContact O-N 3.41Å; L148-R152 WeakPolarHBondContact O-CB 3.32Å; L148-R152 PolarHBondContact O-N 2.94Å |
| 149 | T | 85.3 | Confident | 78.7 | Confident | 70 Ų | 70 | 98.1 Ų | 98.1 | 43% | 0.429 | 54% | 0.541 | S | S | . | . | H | α-helix | trans | -67 | -44 | 175.3 | -56.4 | 0 | 0 | 0 | 0 | 110.9 | S145 S146 I147 L151 R152 D153 | S145-T149 WeakPolarHBondContact O-CB 3.49Å; S145-T149 PolarHBondContact O-N 3.05Å; S145-T149 PolarHBondContact O-OG1 3.07Å; S146-T149 PolarHBondContact O-N 2.87Å; I147-T149 VanDerWaalsContact C-N 3.3Å; I147-T149 PolarHBondContact O-N 2.79Å; T149-L151 VanDerWaalsContact C-N 3.35Å; T149-L151 PolarHBondContact O-N 2.84Å; T149-R152 WeakPolarHBondContact O-CB 3.45Å; T149-R152 PolarHBondContact O-N 3.44Å; T149-R152 VanDerWaalsContact O-N 3.13Å; T149-D153 PolarHBondContact O-N 3.36Å |
| 150 | G | 80.7 | Confident | 78 | Confident | 30 Ų | 30 | 94.1 Ų | 94.1 | 31% | 0.309 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -60.3 | -40.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | S146 I147 D153 Q154 | S146-G150 PolarHBondContact O-N 3.31Å; I147-G150 PolarHBondContact O-N 3.47Å; G150-D153 PolarHBondContact O-N 2.91Å; G150-Q154 WeakPolarHBondContact O-CB 3.3Å; G150-Q154 VanDerWaalsContact O-CG 3.32Å; G150-Q154 WeakPolarHBondContact O-CG 3.45Å; G150-Q154 PolarHBondContact O-N 2.89Å |
| 151 | L | 79 | Confident | 77.4 | Confident | 99 Ų | 99 | 91.9 Ų | 91.9 | 52% | 0.518 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -66.3 | -37.3 | 174.1 | -71.3 | 173.1 | 0 | 0 | 0 | 112 | I147 L148 T149 R155 | I147-L151 HydrophobicContact CG2-CD1 4.11Å; I147-L151 HydrophobicContact CG2-CG 4.43Å; I147-L151 VanDerWaalsContact O-CG 3.31Å; I147-L151 WeakPolarHBondContact O-CG 3.23Å; I147-L151 PolarHBondContact O-N 3.07Å; L148-L151 PolarHBondContact O-N 3.41Å; T149-L151 VanDerWaalsContact C-N 3.35Å; T149-L151 PolarHBondContact O-N 2.84Å; L151-R155 PolarHBondContact O-N 3.47Å |
| 152 | R | 81.1 | Confident | 76.4 | Confident | 198 Ų | 198 | 92.9 Ų | 92.9 | 75% | 0.747 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -66.7 | -42.3 | 174.8 | -173.9 | 177 | 175.3 | 94.5 | -1.6 | 111.7 | L148 T149 R155 G156 | L148-R152 WeakPolarHBondContact O-CB 3.32Å; L148-R152 PolarHBondContact O-N 2.94Å; T149-R152 WeakPolarHBondContact O-CB 3.45Å; T149-R152 PolarHBondContact O-N 3.44Å; T149-R152 VanDerWaalsContact O-N 3.13Å; R152-R155 WeakPolarHBondContact O-CB 3.44Å; R152-R155 PolarHBondContact O-N 3.13Å; R152-G156 PolarHBondContact O-N 3.13Å; R152-G156 VanDerWaalsContact O-N 3.13Å |
| 153 | D | 77 | Confident | 75.8 | Confident | 102 Ų | 102 | 97.5 Ų | 97.5 | 55% | 0.545 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -71.2 | -35.4 | 177.1 | -75.2 | -11.3 | 0 | 0 | 0 | 112.3 | T149 G150 R155 G156 T157 | T149-D153 PolarHBondContact O-N 3.36Å; G150-D153 PolarHBondContact O-N 2.91Å; D153-R155 VanDerWaalsContact C-N 3.33Å; D153-R155 PolarHBondContact O-N 3.4Å; D153-G156 PolarHBondContact O-N 3.06Å; D153-T157 PolarHBondContact O-N 3.45Å; D153-T157 PolarHBondContact O-OG1 3.35Å |
| 154 | Q | 63.8 | Low | 75.5 | Confident | 120 Ų | 120 | 101.9 Ų | 101.9 | 56% | 0.561 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -61.1 | -40.8 | 169.9 | -83.3 | -178.2 | 12.7 | 0 | 0 | 111.5 | G150 G156 T157 L158 | G150-Q154 WeakPolarHBondContact O-CB 3.3Å; G150-Q154 VanDerWaalsContact O-CG 3.32Å; G150-Q154 WeakPolarHBondContact O-CG 3.45Å; G150-Q154 PolarHBondContact O-N 2.89Å; Q154-G156 VanDerWaalsContact C-N 3.31Å; Q154-G156 PolarHBondContact O-N 3.41Å; Q154-T157 PolarHBondContact O-N 3.03Å; Q154-L158 WeakPolarHBondContact O-CB 3.3Å; Q154-L158 PolarHBondContact O-N 3.18Å |
| 155 | R | 74.8 | Confident | 74.6 | Confident | 172 Ų | 172 | 106.7 Ų | 106.7 | 65% | 0.649 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -63 | -38.2 | 174.2 | -172.7 | 179.3 | -178.7 | -176.3 | -0.6 | 112 | L151 R152 D153 K159 | L151-R155 PolarHBondContact O-N 3.47Å; R152-R155 WeakPolarHBondContact O-CB 3.44Å; R152-R155 PolarHBondContact O-N 3.13Å; D153-R155 VanDerWaalsContact C-N 3.33Å; D153-R155 PolarHBondContact O-N 3.4Å; R155-K159 WeakPolarHBondContact O-CG 3.44Å; R155-K159 PolarHBondContact O-N 2.67Å; R155-K159 VanDerWaalsContact O-N 3.13Å |
| 156 | G | 72.9 | Confident | 74 | Confident | 46 Ų | 46 | 107.7 Ų | 107.7 | 47% | 0.474 | 56% | 0.555 | S | S | . | * | H | α-helix | trans | -62.7 | -45.5 | 173.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | R152 D153 Q154 K159 G160 | R152-G156 PolarHBondContact O-N 3.13Å; R152-G156 VanDerWaalsContact O-N 3.13Å; D153-G156 PolarHBondContact O-N 3.06Å; Q154-G156 VanDerWaalsContact C-N 3.31Å; Q154-G156 PolarHBondContact O-N 3.41Å; G156-K159 PolarHBondContact O-N 3.14Å; G156-G160 PolarHBondContact O-N 3.41Å |
| 157 | T | 71.2 | Confident | 74 | Confident | 94 Ų | 94 | 108.2 Ų | 108.2 | 58% | 0.577 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -66.3 | -45.9 | 179.6 | -55.9 | 0 | 0 | 0 | 0 | 112 | D153 Q154 K159 G160 T161 | D153-T157 PolarHBondContact O-N 3.45Å; D153-T157 PolarHBondContact O-OG1 3.35Å; Q154-T157 PolarHBondContact O-N 3.03Å; T157-K159 VanDerWaalsContact C-N 3.33Å; T157-K159 PolarHBondContact O-N 3.25Å; T157-G160 CarbonylContact O-C 3.57Å; T157-G160 WeakPolarHBondContact O-CA 3.4Å; T157-G160 PolarHBondContact O-N 3.45Å; T157-T161 PolarHBondContact O-N 3.43Å; T157-T161 PolarHBondContact O-OG1 2.88Å; T157-T161 VanDerWaalsContact O-OG1 3.07Å |
| 158 | L | 64.9 | Low | 73.5 | Confident | 121 Ų | 121 | 106.1 Ų | 106.1 | 63% | 0.634 | 54% | 0.544 | S | S | * | . | H | α-helix | trans | -60.2 | -39.8 | 175.8 | -90.8 | 153.6 | 0 | 0 | 0 | 112.5 | Q154 T161 H162 | Q154-L158 WeakPolarHBondContact O-CB 3.3Å; Q154-L158 PolarHBondContact O-N 3.18Å; L158-T161 PolarHBondContact O-N 3.4Å; L158-H162 WeakPolarHBondContact O-CB 3.44Å; L158-H162 PolarHBondContact O-N 3.47Å |
| 159 | K | 74.5 | Confident | 72.4 | Confident | 136 Ų | 136 | 103 Ų | 103 | 59% | 0.591 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -63.8 | -40.6 | 172.4 | -80.2 | -175.9 | 174.7 | -173.2 | 0 | 112 | R155 G156 T157 K163 | R155-K159 WeakPolarHBondContact O-CG 3.44Å; R155-K159 PolarHBondContact O-N 2.67Å; R155-K159 VanDerWaalsContact O-N 3.13Å; G156-K159 PolarHBondContact O-N 3.14Å; T157-K159 VanDerWaalsContact C-N 3.33Å; T157-K159 PolarHBondContact O-N 3.25Å; K159-K163 PolarHBondContact O-N 3Å; K159-K163 VanDerWaalsContact O-N 3.08Å |
| 160 | G | 70.6 | Confident | 71.7 | Confident | 36 Ų | 36 | 104 Ų | 104 | 37% | 0.371 | 54% | 0.538 | S | S | . | . | H | α-helix | trans | -63.2 | -42.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.8 | G156 T157 K163 K164 | G156-G160 PolarHBondContact O-N 3.41Å; T157-G160 CarbonylContact O-C 3.57Å; T157-G160 WeakPolarHBondContact O-CA 3.4Å; T157-G160 PolarHBondContact O-N 3.45Å; G160-K163 PolarHBondContact O-N 3.33Å; G160-K164 WeakPolarHBondContact O-CG 3.46Å; G160-K164 PolarHBondContact O-N 2.94Å |
| 161 | T | 67.7 | Low | 71 | Confident | 82 Ų | 82 | 107.9 Ų | 107.9 | 50% | 0.503 | 55% | 0.55 | S | S | . | . | H | α-helix | trans | -68.3 | -41.9 | 177.7 | -55 | 0 | 0 | 0 | 0 | 111.8 | T157 L158 K163 K164 M165 | T157-T161 PolarHBondContact O-N 3.43Å; T157-T161 PolarHBondContact O-OG1 2.88Å; T157-T161 VanDerWaalsContact O-OG1 3.07Å; L158-T161 PolarHBondContact O-N 3.4Å; T161-K163 VanDerWaalsContact C-N 3.35Å; T161-K163 PolarHBondContact O-N 2.92Å; T161-K164 PolarHBondContact O-N 3.34Å; T161-M165 VanDerWaalsContact O-CB 3.3Å; T161-M165 WeakPolarHBondContact O-CB 3.46Å; T161-M165 PolarHBondContact O-N 3.19Å |
| 162 | H | 63.8 | Low | 70.1 | Confident | 132 Ų | 132 | 108.3 Ų | 108.3 | 61% | 0.611 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -61.6 | -42.7 | 175.2 | -174.9 | -84.9 | 0 | 0 | 0 | 111.7 | L158 M165 L166 | L158-H162 WeakPolarHBondContact O-CB 3.44Å; L158-H162 PolarHBondContact O-N 3.47Å; H162-M165 PolarHBondContact O-N 3.48Å; H162-L166 WeakPolarHBondContact O-CB 3.4Å; H162-L166 PolarHBondContact O-N 2.95Å |
| 163 | K | 72.9 | Confident | 69.1 | Low | 138 Ų | 138 | 100.9 Ų | 100.9 | 60% | 0.6 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -62.5 | -46.5 | 175.5 | -171.6 | 174.7 | 178.9 | -179.3 | 0 | 111.5 | K159 G160 T161 M165 L166 D167 | K159-K163 PolarHBondContact O-N 3Å; K159-K163 VanDerWaalsContact O-N 3.08Å; G160-K163 PolarHBondContact O-N 3.33Å; T161-K163 VanDerWaalsContact C-N 3.35Å; T161-K163 PolarHBondContact O-N 2.92Å; K163-M165 VanDerWaalsContact C-N 3.34Å; K163-M165 PolarHBondContact O-N 3.41Å; K163-L166 PolarHBondContact O-N 2.9Å; K163-D167 PolarHBondContact O-N 3.38Å |
| 164 | K | 71.9 | Confident | 68.1 | Low | 153 Ų | 153 | 101.4 Ų | 101.4 | 67% | 0.665 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -63.3 | -37.6 | 176 | -73.7 | -179.6 | 179.9 | -177.6 | 0 | 112.7 | G160 T161 D167 V168 | G160-K164 WeakPolarHBondContact O-CG 3.46Å; G160-K164 PolarHBondContact O-N 2.94Å; T161-K164 PolarHBondContact O-N 3.34Å; K164-D167 PolarHBondContact O-N 3.49Å; K164-V168 WeakPolarHBondContact O-CB 3.28Å; K164-V168 WeakPolarHBondContact O-CG2 3.26Å; K164-V168 PolarHBondContact O-N 3.39Å |
| 165 | M | 66.1 | Low | 67.7 | Low | 139 Ų | 139 | 99 Ų | 99 | 69% | 0.685 | 54% | 0.535 | S | S | * | . | H | α-helix | trans | -67.7 | -40.6 | 176.8 | -175.7 | 177.3 | 174.3 | 0 | 0 | 111.4 | T161 H162 K163 V168 A169 | T161-M165 VanDerWaalsContact O-CB 3.3Å; T161-M165 WeakPolarHBondContact O-CB 3.46Å; T161-M165 PolarHBondContact O-N 3.19Å; H162-M165 PolarHBondContact O-N 3.48Å; K163-M165 VanDerWaalsContact C-N 3.34Å; K163-M165 PolarHBondContact O-N 3.41Å; M165-V168 PolarHBondContact O-N 3.15Å; M165-A169 VanDerWaalsContact O-CB 3.3Å; M165-A169 WeakPolarHBondContact O-CB 3.36Å; M165-A169 PolarHBondContact O-N 3.24Å |
| 166 | L | 72.9 | Confident | 67 | Low | 92 Ų | 92 | 96 Ų | 96 | 48% | 0.482 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -62.8 | -43.6 | 173.4 | -167.7 | 80.9 | 0 | 0 | 0 | 111.2 | H162 K163 A169 N170 | H162-L166 WeakPolarHBondContact O-CB 3.4Å; H162-L166 PolarHBondContact O-N 2.95Å; K163-L166 PolarHBondContact O-N 2.9Å; L166-A169 PolarHBondContact O-N 3.05Å; L166-N170 WeakPolarHBondContact O-CB 3.28Å; L166-N170 VanDerWaalsContact O-CG 3.28Å; L166-N170 PolarHBondContact O-N 2.79Å; L166-N170 PolarHBondContact O-ND2 3.49Å |
| 167 | D | 75.8 | Confident | 66.6 | Low | 84 Ų | 84 | 97.3 Ų | 97.3 | 45% | 0.449 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -65 | -39.1 | 177.2 | -67.2 | -23.8 | 0 | 0 | 0 | 111.6 | K163 K164 N170 M171 | K163-D167 PolarHBondContact O-N 3.38Å; K164-D167 PolarHBondContact O-N 3.49Å; D167-N170 PolarHBondContact O-N 2.89Å; D167-M171 VanDerWaalsContact O-CB 3.28Å; D167-M171 WeakPolarHBondContact O-CB 3.44Å; D167-M171 PolarHBondContact O-N 2.82Å |
| 168 | V | 69.2 | Low | 66.3 | Low | 62 Ų | 62 | 96.4 Ų | 96.4 | 38% | 0.376 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -68.7 | -41 | 174.3 | 168.9 | 0 | 0 | 0 | 0 | 111.6 | K164 M165 N170 M171 L172 | K164-V168 WeakPolarHBondContact O-CB 3.28Å; K164-V168 WeakPolarHBondContact O-CG2 3.26Å; K164-V168 PolarHBondContact O-N 3.39Å; M165-V168 PolarHBondContact O-N 3.15Å; V168-N170 VanDerWaalsContact C-N 3.35Å; V168-M171 PolarHBondContact O-N 3.27Å; V168-L172 HydrophobicContact CG1-CD1 3.66Å; V168-L172 HydrophobicContact CG1-CG 4.18Å; V168-L172 WeakPolarHBondContact O-CB 3.35Å; V168-L172 VanDerWaalsContact O-CG 3.23Å; V168-L172 WeakPolarHBondContact O-CG 3.36Å; V168-L172 PolarHBondContact O-N 2.88Å |
| 169 | A | 65.1 | Low | 66.6 | Low | 56 Ų | 56 | 96.1 Ų | 96.1 | 46% | 0.463 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.5 | -41.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | M165 L166 L172 G173 | M165-A169 VanDerWaalsContact O-CB 3.3Å; M165-A169 WeakPolarHBondContact O-CB 3.36Å; M165-A169 PolarHBondContact O-N 3.24Å; L166-A169 PolarHBondContact O-N 3.05Å; A169-L172 PolarHBondContact O-N 3.5Å; A169-G173 PolarHBondContact O-N 3.34Å |
| 170 | N | 70.8 | Confident | 66.4 | Low | 92 Ų | 92 | 98.8 Ų | 98.8 | 49% | 0.492 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -63.6 | -41.7 | 173.2 | -75.6 | -24.4 | 0 | 0 | 0 | 111.8 | L166 D167 V168 L174 | L166-N170 WeakPolarHBondContact O-CB 3.28Å; L166-N170 VanDerWaalsContact O-CG 3.28Å; L166-N170 PolarHBondContact O-N 2.79Å; L166-N170 PolarHBondContact O-ND2 3.49Å; D167-N170 PolarHBondContact O-N 2.89Å; V168-N170 VanDerWaalsContact C-N 3.35Å; N170-L174 WeakPolarHBondContact O-CB 3.19Å; N170-L174 WeakPolarHBondContact O-CG 3.38Å; N170-L174 PolarHBondContact O-N 3.43Å |
| 171 | M | 65.1 | Low | 66.4 | Low | 112 Ų | 112 | 102 Ų | 102 | 55% | 0.552 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -69.7 | -37.1 | 178.5 | -172.5 | 175.8 | 162.4 | 0 | 0 | 112.8 | D167 V168 S175 | D167-M171 VanDerWaalsContact O-CB 3.28Å; D167-M171 WeakPolarHBondContact O-CB 3.44Å; D167-M171 PolarHBondContact O-N 2.82Å; V168-M171 PolarHBondContact O-N 3.27Å; M171-S175 WeakPolarHBondContact O-CB 3.48Å; M171-S175 PolarHBondContact O-N 2.9Å |
| 172 | L | 59.3 | Low | 66.6 | Low | 108 Ų | 108 | 103.2 Ų | 103.2 | 57% | 0.565 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -73.2 | -36.2 | 175.5 | -70.2 | 171.3 | 0 | 0 | 0 | 112.1 | V168 A169 L174 S175 N176 | V168-L172 HydrophobicContact CG1-CD1 3.66Å; V168-L172 HydrophobicContact CG1-CG 4.18Å; V168-L172 WeakPolarHBondContact O-CB 3.35Å; V168-L172 VanDerWaalsContact O-CG 3.23Å; V168-L172 WeakPolarHBondContact O-CG 3.36Å; V168-L172 PolarHBondContact O-N 2.88Å; A169-L172 PolarHBondContact O-N 3.5Å; L172-L174 VanDerWaalsContact C-N 3.32Å; L172-S175 PolarHBondContact O-N 2.94Å; L172-N176 PolarHBondContact O-N 2.92Å |
| 173 | G | 61.5 | Low | 67.1 | Low | 42 Ų | 42 | 102.7 Ų | 102.7 | 43% | 0.433 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -63.4 | -37.7 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | A169 T177 | A169-G173 PolarHBondContact O-N 3.34Å; G173-T177 WeakPolarHBondContact O-CG2 3.37Å; G173-T177 PolarHBondContact O-N 2.99Å; G173-T177 PolarHBondContact O-OG1 2.88Å |
| 174 | L | 55.3 | Low | 67.3 | Low | 113 Ų | 113 | 102.7 Ų | 102.7 | 59% | 0.592 | 54% | 0.537 | S | S | * | . | H | α-helix | trans | -75.6 | -36.6 | 174 | -71.9 | 170.7 | 0 | 0 | 0 | 112.8 | N170 L172 T177 V178 | N170-L174 WeakPolarHBondContact O-CB 3.19Å; N170-L174 WeakPolarHBondContact O-CG 3.38Å; N170-L174 PolarHBondContact O-N 3.43Å; L172-L174 VanDerWaalsContact C-N 3.32Å; L174-T177 WeakPolarHBondContact CA-OG1 3.36Å; L174-T177 PolarHBondContact O-N 3.46Å; L174-T177 PolarHBondContact O-OG1 3.33Å; L174-T177 VanDerWaalsContact O-OG1 3.05Å; L174-V178 VanDerWaalsContact O-CB 3.27Å; L174-V178 WeakPolarHBondContact O-CB 3.37Å; L174-V178 WeakPolarHBondContact O-CG2 3.49Å; L174-V178 PolarHBondContact O-N 3.08Å |
| 175 | S | 55.3 | Low | 67.7 | Low | 68 Ų | 68 | 104.6 Ų | 104.6 | 48% | 0.476 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -64.2 | -43.8 | -179.4 | -176.8 | 0 | 0 | 0 | 0 | 112.7 | M171 L172 M179 | M171-S175 WeakPolarHBondContact O-CB 3.48Å; M171-S175 PolarHBondContact O-N 2.9Å; L172-S175 PolarHBondContact O-N 2.94Å; S175-M179 VanDerWaalsContact O-CB 3.26Å; S175-M179 WeakPolarHBondContact O-CB 3.48Å; S175-M179 PolarHBondContact O-N 3.3Å |
| 176 | N | 59.8 | Low | 68.2 | Low | 111 Ų | 111 | 101.1 Ų | 101.1 | 59% | 0.594 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -69.8 | -34.1 | 177.1 | -87.5 | -23.2 | 0 | 0 | 0 | 113.1 | L172 R180 | L172-N176 PolarHBondContact O-N 2.92Å; N176-R180 WeakPolarHBondContact O-CG 3.13Å; N176-R180 PolarHBondContact O-N 3.39Å; N176-R180 VanDerWaalsContact O-N 3.15Å |
| 177 | T | 65.5 | Low | 68.4 | Low | 73 Ų | 73 | 100.4 Ų | 100.4 | 45% | 0.448 | 53% | 0.533 | S | S | . | . | H | α-helix | trans | -75.2 | -41.4 | 177.7 | 46.3 | 0 | 0 | 0 | 0 | 111.7 | G173 L174 R180 L181 | G173-T177 WeakPolarHBondContact O-CG2 3.37Å; G173-T177 PolarHBondContact O-N 2.99Å; G173-T177 PolarHBondContact O-OG1 2.88Å; L174-T177 WeakPolarHBondContact CA-OG1 3.36Å; L174-T177 PolarHBondContact O-N 3.46Å; L174-T177 PolarHBondContact O-OG1 3.33Å; L174-T177 VanDerWaalsContact O-OG1 3.05Å; T177-R180 PolarHBondContact O-N 3.03Å; T177-L181 WeakPolarHBondContact O-CB 3.38Å; T177-L181 VanDerWaalsContact O-CG 3.23Å; T177-L181 WeakPolarHBondContact O-CG 3.41Å; T177-L181 PolarHBondContact O-N 3.35Å |
| 178 | V | 64.3 | Low | 68.7 | Low | 74 Ų | 74 | 101.9 Ų | 101.9 | 45% | 0.448 | 54% | 0.537 | S | S | . | . | H | α-helix | trans | -62.4 | -42.4 | 172.8 | 171.6 | 0 | 0 | 0 | 0 | 111 | L174 R180 L181 I182 | L174-V178 VanDerWaalsContact O-CB 3.27Å; L174-V178 WeakPolarHBondContact O-CB 3.37Å; L174-V178 WeakPolarHBondContact O-CG2 3.49Å; L174-V178 PolarHBondContact O-N 3.08Å; V178-R180 PolarHBondContact O-N 3.23Å; V178-L181 PolarHBondContact O-N 3.46Å; V178-I182 HydrophobicContact CG1-CD1 3.92Å; V178-I182 VanDerWaalsContact O-CG1 3.32Å; V178-I182 WeakPolarHBondContact O-CG1 3.32Å; V178-I182 PolarHBondContact O-N 2.96Å |
| 179 | M | 71.1 | Confident | 69.5 | Low | 115 Ų | 115 | 104.2 Ų | 104.2 | 57% | 0.567 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -62.2 | -44.3 | 177.7 | -165.6 | 156.9 | -158.5 | 0 | 0 | 112.2 | S175 L181 I182 E183 | S175-M179 VanDerWaalsContact O-CB 3.26Å; S175-M179 WeakPolarHBondContact O-CB 3.48Å; S175-M179 PolarHBondContact O-N 3.3Å; M179-L181 PolarHBondContact O-N 3.28Å; M179-I182 PolarHBondContact O-N 2.97Å; M179-E183 PolarHBondContact O-N 3.18Å; M179-E183 VanDerWaalsContact O-N 3.13Å |
| 180 | R | 70.4 | Confident | 70.5 | Confident | 192 Ų | 192 | 108.2 Ų | 108.2 | 73% | 0.725 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -64.7 | -36 | 174.1 | -76 | 180 | 177 | -179.2 | 0.1 | 113.3 | N176 T177 V178 I182 K184 | N176-R180 WeakPolarHBondContact O-CG 3.13Å; N176-R180 PolarHBondContact O-N 3.39Å; N176-R180 VanDerWaalsContact O-N 3.15Å; T177-R180 PolarHBondContact O-N 3.03Å; V178-R180 PolarHBondContact O-N 3.23Å; R180-I182 VanDerWaalsContact C-N 3.31Å; R180-K184 WeakPolarHBondContact O-CB 3.27Å; R180-K184 PolarHBondContact O-N 3.44Å |
| 181 | L | 71.6 | Confident | 71.2 | Confident | 105 Ų | 105 | 111.4 Ų | 111.4 | 55% | 0.55 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -67.6 | -32.3 | 176.8 | -73.8 | 171 | 0 | 0 | 0 | 112.2 | T177 V178 M179 R185 | T177-L181 WeakPolarHBondContact O-CB 3.38Å; T177-L181 VanDerWaalsContact O-CG 3.23Å; T177-L181 WeakPolarHBondContact O-CG 3.41Å; T177-L181 PolarHBondContact O-N 3.35Å; V178-L181 PolarHBondContact O-N 3.46Å; M179-L181 PolarHBondContact O-N 3.28Å; L181-R185 WeakPolarHBondContact O-CG 3.3Å; L181-R185 PolarHBondContact O-N 3.03Å |
| 182 | I | 71.4 | Confident | 72.4 | Confident | 107 Ų | 107 | 111.4 Ų | 111.4 | 55% | 0.549 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -71.1 | -46.7 | 175.2 | -67 | 165.4 | 0 | 0 | 0 | 110.7 | V178 M179 R180 K184 R185 A186 | V178-I182 HydrophobicContact CG1-CD1 3.92Å; V178-I182 VanDerWaalsContact O-CG1 3.32Å; V178-I182 WeakPolarHBondContact O-CG1 3.32Å; V178-I182 PolarHBondContact O-N 2.96Å; M179-I182 PolarHBondContact O-N 2.97Å; R180-I182 VanDerWaalsContact C-N 3.31Å; I182-K184 VanDerWaalsContact C-N 3.29Å; I182-K184 PolarHBondContact O-N 3.36Å; I182-R185 PolarHBondContact O-N 3.13Å; I182-A186 PolarHBondContact O-N 3.1Å; I182-A186 VanDerWaalsContact O-N 3.15Å |
| 183 | E | 73 | Confident | 73.9 | Confident | 121 Ų | 121 | 112.6 Ų | 112.6 | 57% | 0.565 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -61.4 | -36.7 | 176.5 | -74 | 179.6 | 169.8 | 0 | 0 | 112.6 | M179 A186 T187 | M179-E183 PolarHBondContact O-N 3.18Å; M179-E183 VanDerWaalsContact O-N 3.13Å; E183-A186 PolarHBondContact O-N 3.23Å; E183-T187 PolarHBondContact O-N 3.28Å; E183-T187 VanDerWaalsContact O-N 3.1Å; E183-T187 PolarHBondContact O-OG1 3.23Å |
| 184 | K | 77.1 | Confident | 75.3 | Confident | 138 Ų | 138 | 114.5 Ų | 114.5 | 60% | 0.6 | 57% | 0.569 | S | S | * | * | H | α-helix | trans | -66.3 | -37.1 | 175.7 | -166.5 | 177.2 | 179.7 | -177.4 | 0 | 112.6 | R180 I182 T187 Q188 | R180-K184 WeakPolarHBondContact O-CB 3.27Å; R180-K184 PolarHBondContact O-N 3.44Å; I182-K184 VanDerWaalsContact C-N 3.29Å; I182-K184 PolarHBondContact O-N 3.36Å; K184-T187 WeakPolarHBondContact CA-OG1 3.23Å; K184-T187 PolarHBondContact O-OG1 2.94Å; K184-Q188 VanDerWaalsContact O-CB 3.3Å; K184-Q188 WeakPolarHBondContact O-CB 3.42Å; K184-Q188 PolarHBondContact O-N 2.84Å |
| 185 | R | 82.1 | Confident | 77.2 | Confident | 192 Ų | 192 | 111 Ų | 111 | 73% | 0.725 | 56% | 0.56 | S | S | * | * | H | α-helix | trans | -67.2 | -41.4 | 176.3 | -74.9 | 179.4 | -177.9 | -147.4 | 1.1 | 111.8 | L181 I182 Q188 D189 | L181-R185 WeakPolarHBondContact O-CG 3.3Å; L181-R185 PolarHBondContact O-N 3.03Å; I182-R185 PolarHBondContact O-N 3.13Å; R185-Q188 PolarHBondContact O-N 3.05Å; R185-D189 WeakPolarHBondContact O-CB 3.18Å; R185-D189 PolarHBondContact O-N 3.42Å |
| 186 | A | 75.1 | Confident | 79 | Confident | 67 Ų | 67 | 109.4 Ų | 109.4 | 55% | 0.554 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -65.7 | -38.8 | 178.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | I182 E183 K190 | I182-A186 PolarHBondContact O-N 3.1Å; I182-A186 VanDerWaalsContact O-N 3.15Å; E183-A186 PolarHBondContact O-N 3.23Å; A186-K190 PolarHBondContact O-N 3.15Å |
| 187 | T | 78.5 | Confident | 80.6 | Confident | 77 Ų | 77 | 110.2 Ų | 110.2 | 47% | 0.472 | 56% | 0.556 | S | S | . | * | H | α-helix | trans | -69.4 | -41.1 | 175.6 | 45 | 0 | 0 | 0 | 0 | 112 | E183 K184 K190 F191 | E183-T187 PolarHBondContact O-N 3.28Å; E183-T187 VanDerWaalsContact O-N 3.1Å; E183-T187 PolarHBondContact O-OG1 3.23Å; K184-T187 WeakPolarHBondContact CA-OG1 3.23Å; K184-T187 PolarHBondContact O-OG1 2.94Å; T187-K190 WeakPolarHBondContact O-CB 3.33Å; T187-K190 PolarHBondContact O-N 3.03Å; T187-F191 WeakPolarHBondContact O-CD2 3.41Å; T187-F191 PolarHBondContact O-N 3.47Å |
| 188 | Q | 81.1 | Confident | 82 | Confident | 114 Ų | 114 | 112 Ų | 112 | 53% | 0.533 | 56% | 0.563 | S | S | . | * | H | α-helix | trans | -65.4 | -39.7 | 177.9 | -162.8 | 171.7 | 0.6 | 0 | 0 | 112.3 | K184 R185 K190 F191 I192 | K184-Q188 VanDerWaalsContact O-CB 3.3Å; K184-Q188 WeakPolarHBondContact O-CB 3.42Å; K184-Q188 PolarHBondContact O-N 2.84Å; R185-Q188 PolarHBondContact O-N 3.05Å; Q188-K190 VanDerWaalsContact C-N 3.33Å; Q188-K190 PolarHBondContact O-N 3.14Å; Q188-F191 PolarHBondContact O-N 3.39Å; Q188-I192 HydrophobicContact CG-CD1 4.48Å; Q188-I192 WeakPolarHBondContact O-CG1 3.45Å; Q188-I192 PolarHBondContact O-N 3.1Å |
| 189 | D | 85.9 | Confident | 83.5 | Confident | 112 Ų | 112 | 114 Ų | 114 | 60% | 0.599 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -61.6 | -40.5 | 175.9 | -165.5 | 41.5 | 0 | 0 | 0 | 111.9 | R185 F191 I192 M193 | R185-D189 WeakPolarHBondContact O-CB 3.18Å; R185-D189 PolarHBondContact O-N 3.42Å; D189-F191 VanDerWaalsContact C-N 3.34Å; D189-F191 PolarHBondContact O-N 2.94Å; D189-I192 PolarHBondContact O-N 2.92Å; D189-M193 WeakPolarHBondContact O-CB 3.47Å; D189-M193 PolarHBondContact O-N 3.25Å |
| 190 | K | 85.9 | Confident | 84.5 | Confident | 140 Ų | 140 | 113 Ų | 113 | 61% | 0.609 | 57% | 0.57 | S | S | * | * | H | α-helix | trans | -61 | -39.7 | 174.4 | -170 | 177.8 | -179.1 | -180 | 0 | 112.8 | A186 T187 Q188 I194 | A186-K190 PolarHBondContact O-N 3.15Å; T187-K190 WeakPolarHBondContact O-CB 3.33Å; T187-K190 PolarHBondContact O-N 3.03Å; Q188-K190 VanDerWaalsContact C-N 3.33Å; Q188-K190 PolarHBondContact O-N 3.14Å; K190-I194 HydrophobicContact CG-CD1 4.13Å; K190-I194 WeakPolarHBondContact O-CD1 3.42Å; K190-I194 WeakPolarHBondContact O-CG1 3.39Å; K190-I194 PolarHBondContact O-N 3.39Å; K190-I194 VanDerWaalsContact O-N 3.14Å |
| 191 | F | 86.3 | Confident | 85.5 | Confident | 158 Ų | 158 | 107.2 Ų | 107.2 | 69% | 0.693 | 56% | 0.559 | S | S | * | * | H | α-helix | trans | -68.8 | -40.3 | 176.3 | -79 | -70.6 | 0 | 0 | 0 | 112.2 | T187 Q188 D189 M193 I194 G195 | T187-F191 WeakPolarHBondContact O-CD2 3.41Å; T187-F191 PolarHBondContact O-N 3.47Å; Q188-F191 PolarHBondContact O-N 3.39Å; D189-F191 VanDerWaalsContact C-N 3.34Å; D189-F191 PolarHBondContact O-N 2.94Å; F191-M193 VanDerWaalsContact C-N 3.35Å; F191-I194 PolarHBondContact O-N 3.2Å; F191-G195 PolarHBondContact O-N 2.97Å |
| 192 | I | 89.8 | Confident | 86.5 | Confident | 112 Ų | 112 | 105.9 Ų | 105.9 | 57% | 0.574 | 56% | 0.555 | S | S | * | * | H | α-helix | trans | -63.6 | -42.7 | 176.6 | -67.6 | 170.9 | 0 | 0 | 0 | 110.5 | Q188 D189 G195 G196 | Q188-I192 HydrophobicContact CG-CD1 4.48Å; Q188-I192 WeakPolarHBondContact O-CG1 3.45Å; Q188-I192 PolarHBondContact O-N 3.1Å; D189-I192 PolarHBondContact O-N 2.92Å; I192-G195 PolarHBondContact O-N 2.95Å; I192-G196 PolarHBondContact O-N 3.41Å |
| 193 | M | 90.1 | Very high | 87.6 | Confident | 133 Ų | 133 | 104.5 Ų | 104.5 | 66% | 0.655 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -59.2 | -48.7 | 176.3 | -179.6 | -167.1 | 147.5 | 0 | 0 | 112 | D189 F191 G196 M197 | D189-M193 WeakPolarHBondContact O-CB 3.47Å; D189-M193 PolarHBondContact O-N 3.25Å; F191-M193 VanDerWaalsContact C-N 3.35Å; M193-G196 PolarHBondContact O-N 3.04Å; M193-M197 PolarHBondContact O-N 3.27Å; M193-M197 VanDerWaalsContact O-N 3.09Å |
| 194 | I | 91.7 | Very high | 88.4 | Confident | 83 Ų | 83 | 105.8 Ų | 105.8 | 43% | 0.426 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -65.5 | -41.5 | 179.9 | -72.5 | 163.1 | 0 | 0 | 0 | 111.1 | K190 F191 M197 L198 | K190-I194 HydrophobicContact CG-CD1 4.13Å; K190-I194 WeakPolarHBondContact O-CD1 3.42Å; K190-I194 WeakPolarHBondContact O-CG1 3.39Å; K190-I194 PolarHBondContact O-N 3.39Å; K190-I194 VanDerWaalsContact O-N 3.14Å; F191-I194 PolarHBondContact O-N 3.2Å; I194-M197 PolarHBondContact O-N 3.2Å; I194-L198 HydrophobicContact CG2-CD1 4.49Å; I194-L198 PolarHBondContact O-N 3.45Å; I194-L198 VanDerWaalsContact O-N 3.1Å |
| 195 | G | 94.9 | Very high | 89.2 | Confident | 39 Ų | 39 | 105.9 Ų | 105.9 | 40% | 0.402 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -61.7 | -42.7 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | F191 I192 L198 L199 | F191-G195 PolarHBondContact O-N 2.97Å; I192-G195 PolarHBondContact O-N 2.95Å; G195-L198 PolarHBondContact O-N 3.48Å; G195-L199 WeakPolarHBondContact O-CB 3.44Å; G195-L199 PolarHBondContact O-N 3.28Å |
| 196 | G | 93.6 | Very high | 89.6 | Confident | 35 Ų | 35 | 100.7 Ų | 100.7 | 36% | 0.361 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -62 | -42.4 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | I192 M193 L199 T200 | I192-G196 PolarHBondContact O-N 3.41Å; M193-G196 PolarHBondContact O-N 3.04Å; G196-L199 PolarHBondContact O-N 2.96Å; G196-T200 WeakPolarHBondContact O-CG2 3.34Å; G196-T200 PolarHBondContact O-N 3.38Å; G196-T200 VanDerWaalsContact O-N 3.09Å; G196-T200 PolarHBondContact O-OG1 2.95Å |
| 197 | M | 92.9 | Very high | 90.3 | Very high | 127 Ų | 127 | 101.1 Ų | 101.1 | 63% | 0.626 | 54% | 0.541 | S | S | * | . | H | α-helix | trans | -64.9 | -41.3 | 177.6 | -171.5 | 178.2 | 179.5 | 0 | 0 | 112.4 | M193 I194 T200 C201 | M193-M197 PolarHBondContact O-N 3.27Å; M193-M197 VanDerWaalsContact O-N 3.09Å; I194-M197 PolarHBondContact O-N 3.2Å; M197-T200 PolarHBondContact O-OG1 3.47Å; M197-C201 PolarHBondContact O-N 3.09Å; M197-C201 PolarHBondContact O-SG 2.91Å |
| 198 | L | 95.2 | Very high | 90.8 | Very high | 112 Ų | 112 | 102.4 Ų | 102.4 | 59% | 0.586 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -66.6 | -42.2 | 176.1 | -89 | 166.7 | 0 | 0 | 0 | 112 | I194 G195 T200 C201 V202 | I194-L198 HydrophobicContact CG2-CD1 4.49Å; I194-L198 PolarHBondContact O-N 3.45Å; I194-L198 VanDerWaalsContact O-N 3.1Å; G195-L198 PolarHBondContact O-N 3.48Å; L198-T200 PolarHBondContact O-N 3.09Å; L198-C201 PolarHBondContact O-N 2.98Å; L198-V202 WeakPolarHBondContact O-CG2 3.38Å; L198-V202 PolarHBondContact O-N 3.15Å |
| 199 | L | 95.1 | Very high | 91.1 | Very high | 116 Ų | 116 | 103.3 Ų | 103.3 | 61% | 0.607 | 55% | 0.551 | S | S | * | * | H | α-helix | trans | -60.8 | -45.1 | 179.7 | -176.8 | 67.5 | 0 | 0 | 0 | 111.3 | G195 G196 C201 V202 V203 | G195-L199 WeakPolarHBondContact O-CB 3.44Å; G195-L199 PolarHBondContact O-N 3.28Å; G196-L199 PolarHBondContact O-N 2.96Å; L199-C201 VanDerWaalsContact C-N 3.35Å; L199-C201 PolarHBondContact O-N 3.4Å; L199-V202 PolarHBondContact O-N 3.36Å; L199-V203 WeakPolarHBondContact O-CG2 3.36Å; L199-V203 PolarHBondContact O-N 3.29Å |
| 200 | T | 92.5 | Very high | 90.9 | Very high | 92 Ų | 92 | 106.4 Ų | 106.4 | 56% | 0.564 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -64.9 | -38.9 | 178.1 | 55.3 | 0 | 0 | 0 | 0 | 112 | G196 M197 L198 V203 M204 | G196-T200 WeakPolarHBondContact O-CG2 3.34Å; G196-T200 PolarHBondContact O-N 3.38Å; G196-T200 VanDerWaalsContact O-N 3.09Å; G196-T200 PolarHBondContact O-OG1 2.95Å; M197-T200 PolarHBondContact O-OG1 3.47Å; L198-T200 PolarHBondContact O-N 3.09Å; T200-V203 PolarHBondContact O-N 3.37Å; T200-M204 PolarHBondContact O-N 3.29Å |
| 201 | C | 92.1 | Very high | 90.1 | Very high | 72 Ų | 72 | 107 Ų | 107 | 49% | 0.486 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -61.3 | -44.4 | 173.2 | -71 | 0 | 0 | 0 | 0 | 112.6 | M197 L198 L199 M204 F205 | M197-C201 PolarHBondContact O-N 3.09Å; M197-C201 PolarHBondContact O-SG 2.91Å; L198-C201 PolarHBondContact O-N 2.98Å; L199-C201 VanDerWaalsContact C-N 3.35Å; L199-C201 PolarHBondContact O-N 3.4Å; C201-M204 PolarHBondContact O-N 3Å; C201-F205 WeakPolarHBondContact O-CB 3.42Å; C201-F205 PolarHBondContact O-N 3.4Å |
| 202 | V | 93.5 | Very high | 88.5 | Confident | 76 Ų | 76 | 104.8 Ų | 104.8 | 46% | 0.461 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -64.3 | -42.7 | 178.5 | 171.3 | 0 | 0 | 0 | 0 | 111.3 | L198 L199 F205 L206 | L198-V202 WeakPolarHBondContact O-CG2 3.38Å; L198-V202 PolarHBondContact O-N 3.15Å; L199-V202 PolarHBondContact O-N 3.36Å; V202-F205 PolarHBondContact O-N 3.4Å; V202-L206 HydrophobicContact CG1-CD1 4.07Å; V202-L206 HydrophobicContact CG1-CG 4.42Å; V202-L206 WeakPolarHBondContact O-CG 3.37Å; V202-L206 PolarHBondContact O-N 3.37Å |
| 203 | V | 93.3 | Very high | 88.4 | Confident | 79 Ų | 79 | 104.5 Ų | 104.5 | 48% | 0.479 | 59% | 0.588 | S | S | . | * | H | α-helix | trans | -62.6 | -46.4 | 176.9 | 172.2 | 0 | 0 | 0 | 0 | 110.7 | L199 T200 F205 L206 V207 | L199-V203 WeakPolarHBondContact O-CG2 3.36Å; L199-V203 PolarHBondContact O-N 3.29Å; T200-V203 PolarHBondContact O-N 3.37Å; V203-F205 VanDerWaalsContact C-N 3.31Å; V203-F205 PolarHBondContact O-N 3.29Å; V203-L206 PolarHBondContact O-N 2.98Å; V203-V207 HydrophobicContact CG1-CG2 4.47Å; V203-V207 VanDerWaalsContact O-CG2 3.32Å; V203-V207 WeakPolarHBondContact O-CG2 3.43Å; V203-V207 PolarHBondContact O-N 3.44Å |
| 204 | M | 90.4 | Very high | 88.3 | Confident | 148 Ų | 148 | 102.9 Ų | 102.9 | 73% | 0.729 | 58% | 0.584 | S | S | * | * | H | α-helix | trans | -58.3 | -43.9 | 175.1 | -106.2 | -153.4 | 172.9 | 0 | 0 | 112 | T200 C201 V207 V208 | T200-M204 PolarHBondContact O-N 3.29Å; C201-M204 PolarHBondContact O-N 3Å; M204-V207 PolarHBondContact O-N 3.02Å; M204-V208 WeakPolarHBondContact O-CG2 3.32Å; M204-V208 PolarHBondContact O-N 3.45Å |
| 205 | F | 92.4 | Very high | 88.2 | Confident | 139 Ų | 139 | 104.1 Ų | 104.1 | 61% | 0.61 | 59% | 0.593 | S | S | * | * | H | α-helix | trans | -62.6 | -44.5 | 178.4 | 179.6 | -96.7 | 0 | 0 | 0 | 112.5 | C201 V202 V203 V208 K209 | C201-F205 WeakPolarHBondContact O-CB 3.42Å; C201-F205 PolarHBondContact O-N 3.4Å; V202-F205 PolarHBondContact O-N 3.4Å; V203-F205 VanDerWaalsContact C-N 3.31Å; V203-F205 PolarHBondContact O-N 3.29Å; F205-V208 PolarHBondContact O-N 2.98Å; F205-K209 WeakPolarHBondContact O-CB 3.4Å; F205-K209 PolarHBondContact O-N 3.02Å |
| 206 | L | 91 | Very high | 87.8 | Confident | 83 Ų | 83 | 107.9 Ų | 107.9 | 44% | 0.435 | 60% | 0.604 | S | S | . | * | H | α-helix | trans | -64 | -40.9 | 177.4 | -72.7 | 173.7 | 0 | 0 | 0 | 111.8 | V202 V203 K209 Y210 | V202-L206 HydrophobicContact CG1-CD1 4.07Å; V202-L206 HydrophobicContact CG1-CG 4.42Å; V202-L206 WeakPolarHBondContact O-CG 3.37Å; V202-L206 PolarHBondContact O-N 3.37Å; V203-L206 PolarHBondContact O-N 2.98Å; L206-K209 PolarHBondContact O-N 3.4Å; L206-Y210 HydrophobicContact CD2-CD2 4.29Å; L206-Y210 HydrophobicContact CD2-CE2 3.99Å; L206-Y210 WeakPolarHBondContact O-CB 3.5Å; L206-Y210 WeakPolarHBondContact O-CD2 3.41Å; L206-Y210 PolarHBondContact O-N 3.31Å |
| 207 | V | 90.6 | Very high | 87.4 | Confident | 76 Ų | 76 | 112.4 Ų | 112.4 | 46% | 0.461 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -60.9 | -46.6 | 175.8 | 171.6 | 0 | 0 | 0 | 0 | 110.7 | V203 M204 K209 Y210 L211 | V203-V207 HydrophobicContact CG1-CG2 4.47Å; V203-V207 VanDerWaalsContact O-CG2 3.32Å; V203-V207 WeakPolarHBondContact O-CG2 3.43Å; V203-V207 PolarHBondContact O-N 3.44Å; M204-V207 PolarHBondContact O-N 3.02Å; V207-K209 VanDerWaalsContact C-N 3.33Å; V207-K209 PolarHBondContact O-N 2.97Å; V207-Y210 PolarHBondContact O-N 2.91Å; V207-L211 WeakPolarHBondContact O-CB 3.38Å; V207-L211 PolarHBondContact O-N 2.91Å |
| 208 | V | 89.2 | Confident | 87 | Confident | 105 Ų | 105 | 111.5 Ų | 111.5 | 64% | 0.636 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -62.8 | -38.2 | 178.5 | 172 | 0 | 0 | 0 | 0 | 112.1 | M204 F205 G212 | M204-V208 WeakPolarHBondContact O-CG2 3.32Å; M204-V208 PolarHBondContact O-N 3.45Å; F205-V208 PolarHBondContact O-N 2.98Å; V208-G212 WeakPolarHBondContact O-CA 3.41Å; V208-G212 PolarHBondContact O-N 3.33Å; V208-G212 VanDerWaalsContact O-N 3.15Å |
| 209 | K | 87.1 | Confident | 86.5 | Confident | 133 Ų | 133 | 111.4 Ų | 111.4 | 58% | 0.578 | 62% | 0.621 | S | S | * | * | H | α-helix | trans | -76.9 | -30.7 | -178.4 | -163.6 | -152.5 | 169.9 | 175.1 | 0 | 113.9 | F205 L206 V207 | F205-K209 WeakPolarHBondContact O-CB 3.4Å; F205-K209 PolarHBondContact O-N 3.02Å; L206-K209 PolarHBondContact O-N 3.4Å; V207-K209 VanDerWaalsContact C-N 3.33Å; V207-K209 PolarHBondContact O-N 2.97Å |
| 210 | Y | 80.7 | Confident | 85.8 | Confident | 176 Ų | 176 | 111.1 Ų | 111.1 | 69% | 0.69 | 62% | 0.622 | S | S | * | * | H | α-helix | trans | -100.2 | -23.8 | -174.8 | -82.2 | -87.3 | 0 | 0 | 0 | 113.7 | L206 V207 | L206-Y210 HydrophobicContact CD2-CD2 4.29Å; L206-Y210 HydrophobicContact CD2-CE2 3.99Å; L206-Y210 WeakPolarHBondContact O-CB 3.5Å; L206-Y210 WeakPolarHBondContact O-CD2 3.41Å; L206-Y210 PolarHBondContact O-N 3.31Å; V207-Y210 PolarHBondContact O-N 2.91Å |
| 211 | L | 69.3 | Low | 85.2 | Confident | 152 Ų | 152 | 112.7 Ų | 112.7 | 80% | 0.796 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -107.2 | -7.6 | 175.5 | -86.4 | 78.4 | 0 | 0 | 0 | 113.7 | V207 | V207-L211 WeakPolarHBondContact O-CB 3.38Å; V207-L211 PolarHBondContact O-N 2.91Å |
| 212 | G | 53.2 | Low | 84.6 | Confident | 113 Ų | 113 | 116.4 Ų | 116.4 | 100% | 1.165 | 64% | 0.64 | S | S | * | * | trans | -108.7 | 0 | 171.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | V208 | V208-G212 WeakPolarHBondContact O-CA 3.41Å; V208-G212 PolarHBondContact O-N 3.33Å; V208-G212 VanDerWaalsContact O-N 3.15Å |
Retrieved 212 of 212 residues in 144.7 ms
(Link to these results)