| 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 | 39.9 | Very low | 44.9 | Very low | 215 Ų | 215 | 86.2 Ų | 86.2 | 100% | 1.059 | 47% | 0.466 | S | S | * | . | 0 | 100.5 | 0 | -156.4 | 166.4 | 168.1 | 0 | 0 | 107.1 | |||||
| 2 | S | 39.3 | Very low | 44.7 | Very low | 63 Ų | 63 | 84.4 Ų | 84.4 | 44% | 0.441 | 46% | 0.464 | S | S | . | . | trans | -72.6 | 148.4 | -162.4 | 56.9 | 0 | 0 | 0 | 0 | 113.1 | N4 L5 | S2-N4 PolarHBondContact O-N 2.87Å; S2-L5 PolarHBondContact O-N 3.4Å | ||
| 3 | P | 50.1 | Low | 44.6 | Very low | 93 Ų | 93 | 85.2 Ų | 85.2 | 60% | 0.604 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -56 | -29.5 | 174.7 | 21.3 | -31.6 | 0 | 0 | 0 | 112.9 | L5 K6 | P3-L5 VanDerWaalsContact C-N 3.3Å; P3-L5 PolarHBondContact O-N 2.87Å; P3-K6 PolarHBondContact O-N 2.74Å |
| 4 | N | 43.8 | Very low | 44.2 | Very low | 24 Ų | 24 | 82.8 Ų | 82.8 | 13% | 0.128 | 45% | 0.452 | C | S | . | . | H | α-helix | trans | -62.2 | -32.4 | 179.3 | -60.4 | -6.2 | 0 | 0 | 0 | 113.2 | S2 Y224 T228 | S2-N4 PolarHBondContact O-N 2.87Å; N4-Y224 PolarHBondContact OD1-OH 3.14Å; N4-T228 PolarHBondContact ND2-OG1 2.77Å |
| 5 | L | 49.9 | Very low | 43.9 | Very low | 109 Ų | 109 | 78.3 Ų | 78.3 | 57% | 0.571 | 43% | 0.431 | S | S | * | . | H | α-helix | trans | -74.2 | -27.4 | 179.2 | -153.1 | 75 | 0 | 0 | 0 | 112.4 | S2 P3 S9 | S2-L5 PolarHBondContact O-N 3.4Å; P3-L5 VanDerWaalsContact C-N 3.3Å; P3-L5 PolarHBondContact O-N 2.87Å; L5-S9 WeakPolarHBondContact O-CB 3.47Å; L5-S9 PolarHBondContact O-N 2.81Å |
| 6 | K | 49.4 | Very low | 43.9 | Very low | 150 Ų | 150 | 81.4 Ų | 81.4 | 65% | 0.652 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -71.9 | -36 | 179.1 | -67 | -177 | 179.4 | 178.3 | 0 | 112.1 | P3 S9 F10 | P3-K6 PolarHBondContact O-N 2.74Å; K6-S9 PolarHBondContact O-N 3.1Å; K6-F10 WeakPolarHBondContact O-CB 3.27Å; K6-F10 PolarHBondContact O-N 3.39Å |
| 7 | V | 49.7 | Very low | 43.4 | Very low | 43 Ų | 43 | 82.5 Ų | 82.5 | 26% | 0.261 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -66.1 | -44.8 | 176.8 | 180 | 0 | 0 | 0 | 0 | 110.9 | S9 F10 A11 Y224 | V7-S9 PolarHBondContact O-N 3.13Å; V7-F10 PolarHBondContact O-N 3.04Å; V7-A11 WeakPolarHBondContact O-CB 3.3Å; V7-A11 PolarHBondContact O-N 3.06Å; V7-Y224 HydrophobicContact CG1-CD1 4.43Å; V7-Y224 HydrophobicContact CG2-CE1 4.11Å |
| 8 | C | 41.4 | Very low | 43.3 | Very low | 40 Ų | 40 | 79.4 Ų | 79.4 | 27% | 0.27 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -65.6 | -38.8 | 176 | -162.5 | 0 | 0 | 0 | 0 | 111.9 | C12 | C8-C12 WeakPolarHBondContact O-CB 3.32Å; C8-C12 PolarHBondContact O-N 3.28Å |
| 9 | S | 42.1 | Very low | 43.1 | Very low | 78 Ų | 78 | 80.3 Ų | 80.3 | 55% | 0.545 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -63.1 | -42.1 | 173.9 | -172.7 | 0 | 0 | 0 | 0 | 112 | L5 K6 V7 C12 L13 | L5-S9 WeakPolarHBondContact O-CB 3.47Å; L5-S9 PolarHBondContact O-N 2.81Å; K6-S9 PolarHBondContact O-N 3.1Å; V7-S9 PolarHBondContact O-N 3.13Å; S9-C12 PolarHBondContact O-N 2.72Å; S9-L13 VanDerWaalsContact O-CB 3.31Å; S9-L13 WeakPolarHBondContact O-CB 3.35Å; S9-L13 PolarHBondContact O-N 2.84Å |
| 10 | F | 45.5 | Very low | 42.7 | Very low | 129 Ų | 129 | 82.6 Ų | 82.6 | 57% | 0.566 | 44% | 0.441 | S | S | * | . | H | α-helix | trans | -66.3 | -45.1 | 176.7 | -177.7 | -99.3 | 0 | 0 | 0 | 112.5 | K6 V7 C12 L13 L14 | K6-F10 WeakPolarHBondContact O-CB 3.27Å; K6-F10 PolarHBondContact O-N 3.39Å; V7-F10 PolarHBondContact O-N 3.04Å; F10-C12 VanDerWaalsContact C-N 3.3Å; F10-C12 PolarHBondContact O-N 2.84Å; F10-L13 WeakPolarHBondContact O-CB 3.49Å; F10-L13 PolarHBondContact O-N 2.77Å; F10-L14 HydrophobicContact CE1-CD1 4.45Å; F10-L14 HydrophobicContact CZ-CD1 4.28Å; F10-L14 WeakPolarHBondContact O-CB 3.46Å; F10-L14 PolarHBondContact O-N 3.38Å |
| 11 | A | 42.9 | Very low | 42.1 | Very low | 4 Ų | 4 | 84.7 Ų | 84.7 | 3% | 0.033 | 45% | 0.45 | C | S | . | . | H | α-helix | trans | -62.6 | -38.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | V7 L14 A15 M217 L218 | V7-A11 WeakPolarHBondContact O-CB 3.3Å; V7-A11 PolarHBondContact O-N 3.06Å; A11-L14 PolarHBondContact O-N 3.19Å; A11-A15 WeakPolarHBondContact O-CB 3.47Å; A11-A15 PolarHBondContact O-N 3.3Å; A11-M217 HydrophobicContact CB-CE 4.18Å; A11-L218 HydrophobicContact CB-CD2 3.72Å |
| 12 | C | 42.3 | Very low | 41.6 | Very low | 65 Ų | 65 | 80.2 Ų | 80.2 | 44% | 0.439 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -70 | -35.1 | 174.6 | -159 | 0 | 0 | 0 | 0 | 112.3 | C8 S9 F10 K16 | C8-C12 WeakPolarHBondContact O-CB 3.32Å; C8-C12 PolarHBondContact O-N 3.28Å; S9-C12 PolarHBondContact O-N 2.72Å; F10-C12 VanDerWaalsContact C-N 3.3Å; F10-C12 PolarHBondContact O-N 2.84Å; C12-K16 WeakPolarHBondContact O-CG 3.29Å; C12-K16 PolarHBondContact O-N 3.26Å |
| 13 | L | 43.3 | Very low | 41.7 | Very low | 95 Ų | 95 | 82.6 Ų | 82.6 | 50% | 0.497 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -67.1 | -41.8 | 173.1 | -165.3 | 84.5 | 0 | 0 | 0 | 111.4 | S9 F10 K16 L17 | S9-L13 VanDerWaalsContact O-CB 3.31Å; S9-L13 WeakPolarHBondContact O-CB 3.35Å; S9-L13 PolarHBondContact O-N 2.84Å; F10-L13 WeakPolarHBondContact O-CB 3.49Å; F10-L13 PolarHBondContact O-N 2.77Å; L13-K16 WeakPolarHBondContact O-CB 3.3Å; L13-K16 PolarHBondContact O-N 3.1Å; L13-L17 HydrophobicContact CD2-CD1 4.26Å; L13-L17 HydrophobicContact CG-CD1 4.15Å; L13-L17 WeakPolarHBondContact O-CB 3.5Å; L13-L17 PolarHBondContact O-N 2.97Å |
| 14 | L | 38.9 | Very low | 40.6 | Very low | 51 Ų | 51 | 89.1 Ų | 89.1 | 27% | 0.267 | 45% | 0.452 | S | S | . | . | H | α-helix | trans | -64 | -43.1 | 176.6 | -153.8 | 86.6 | 0 | 0 | 0 | 110.8 | F10 A11 K16 L17 I18 M217 | F10-L14 HydrophobicContact CE1-CD1 4.45Å; F10-L14 HydrophobicContact CZ-CD1 4.28Å; F10-L14 WeakPolarHBondContact O-CB 3.46Å; F10-L14 PolarHBondContact O-N 3.38Å; A11-L14 PolarHBondContact O-N 3.19Å; L14-K16 VanDerWaalsContact C-N 3.35Å; L14-K16 PolarHBondContact O-N 3.28Å; L14-L17 PolarHBondContact O-N 2.9Å; L14-I18 HydrophobicContact CD2-CD1 4.42Å; L14-I18 HydrophobicContact CG-CD1 4.37Å; L14-I18 WeakPolarHBondContact O-CB 3.37Å; L14-I18 VanDerWaalsContact O-CG1 3.25Å; L14-I18 WeakPolarHBondContact O-CG1 3.35Å; L14-I18 PolarHBondContact O-N 2.66Å; L14-M217 HydrophobicContact CB-CE 4.48Å; L14-M217 HydrophobicContact CD2-CE 3.92Å; L14-M217 HydrophobicContact CD2-SD 3.85Å |
| 15 | A | 39.7 | Very low | 40.2 | Very low | 15 Ų | 15 | 91.2 Ų | 91.2 | 12% | 0.124 | 47% | 0.467 | C | S | . | . | H | α-helix | trans | -60.7 | -42 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | A11 I18 L19 V214 | A11-A15 WeakPolarHBondContact O-CB 3.47Å; A11-A15 PolarHBondContact O-N 3.3Å; A15-I18 PolarHBondContact O-N 2.79Å; A15-L19 WeakPolarHBondContact O-CB 3.24Å; A15-L19 WeakPolarHBondContact O-CD1 3.39Å; A15-L19 VanDerWaalsContact O-CG 3.28Å; A15-L19 WeakPolarHBondContact O-CG 3.5Å; A15-L19 PolarHBondContact O-N 2.87Å; A15-V214 HydrophobicContact CB-CG1 3.99Å |
| 16 | K | 43.4 | Very low | 39.3 | Very low | 128 Ų | 128 | 97 Ų | 97 | 56% | 0.557 | 48% | 0.482 | S | S | * | . | H | α-helix | trans | -63.5 | -44.4 | 173 | -78.5 | 179 | 179.4 | -179.2 | 0 | 112.4 | C12 L13 L14 I18 L19 I20 | C12-K16 WeakPolarHBondContact O-CG 3.29Å; C12-K16 PolarHBondContact O-N 3.26Å; L13-K16 WeakPolarHBondContact O-CB 3.3Å; L13-K16 PolarHBondContact O-N 3.1Å; L14-K16 VanDerWaalsContact C-N 3.35Å; L14-K16 PolarHBondContact O-N 3.28Å; K16-I18 VanDerWaalsContact C-N 3.32Å; K16-I18 PolarHBondContact O-N 2.71Å; K16-L19 PolarHBondContact O-N 3.17Å; K16-I20 HydrophobicContact CB-CD1 4.4Å; K16-I20 WeakPolarHBondContact O-CB 3.48Å; K16-I20 VanDerWaalsContact O-CD1 3.26Å; K16-I20 WeakPolarHBondContact O-CD1 3.31Å; K16-I20 WeakPolarHBondContact O-CG1 3.43Å; K16-I20 PolarHBondContact O-N 3.23Å |
| 17 | L | 36.4 | Very low | 38.5 | Very low | 101 Ų | 101 | 97.9 Ų | 97.9 | 53% | 0.529 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -61.1 | -39.7 | 177.5 | -88.7 | 152.9 | 0 | 0 | 0 | 112 | L13 L14 I20 M21 | L13-L17 HydrophobicContact CD2-CD1 4.26Å; L13-L17 HydrophobicContact CG-CD1 4.15Å; L13-L17 WeakPolarHBondContact O-CB 3.5Å; L13-L17 PolarHBondContact O-N 2.97Å; L14-L17 PolarHBondContact O-N 2.9Å; L17-I20 PolarHBondContact O-N 3.12Å; L17-M21 PolarHBondContact O-N 3.1Å; L17-M21 VanDerWaalsContact O-N 3.11Å |
| 18 | I | 40.7 | Very low | 37.4 | Very low | 27 Ų | 27 | 101.1 Ų | 101.1 | 14% | 0.138 | 51% | 0.507 | C | S | . | . | H | α-helix | trans | -68.3 | -39.3 | 176.1 | -68.7 | 166.5 | 0 | 0 | 0 | 111.1 | L14 A15 K16 I20 L210 M211 V214 V367 | L14-I18 HydrophobicContact CD2-CD1 4.42Å; L14-I18 HydrophobicContact CG-CD1 4.37Å; L14-I18 WeakPolarHBondContact O-CB 3.37Å; L14-I18 VanDerWaalsContact O-CG1 3.25Å; L14-I18 WeakPolarHBondContact O-CG1 3.35Å; L14-I18 PolarHBondContact O-N 2.66Å; A15-I18 PolarHBondContact O-N 2.79Å; K16-I18 VanDerWaalsContact C-N 3.32Å; K16-I18 PolarHBondContact O-N 2.71Å; I18-I20 VanDerWaalsContact C-N 3.25Å; I18-I20 PolarHBondContact O-N 2.96Å; I18-L210 HydrophobicContact CG2-CD1 4.49Å; I18-L210 HydrophobicContact CG2-CD2 3.54Å; I18-L210 HydrophobicContact CG2-CG 4.05Å; I18-M211 HydrophobicContact CG2-CE 4.45Å; I18-V214 HydrophobicContact CD1-CG2 3.9Å; I18-V367 HydrophobicContact CD1-CG1 4.34Å |
| 19 | L | 39.8 | Very low | 36.8 | Very low | 95 Ų | 95 | 104.4 Ų | 104.4 | 50% | 0.497 | 53% | 0.528 | S | S | . | . | H | α-helix | trans | -67.9 | -22.7 | 174 | -73.9 | 166 | 0 | 0 | 0 | 113.4 | A15 K16 M211 | A15-L19 WeakPolarHBondContact O-CB 3.24Å; A15-L19 WeakPolarHBondContact O-CD1 3.39Å; A15-L19 VanDerWaalsContact O-CG 3.28Å; A15-L19 WeakPolarHBondContact O-CG 3.5Å; A15-L19 PolarHBondContact O-N 2.87Å; K16-L19 PolarHBondContact O-N 3.17Å; L19-M211 HydrophobicContact CD2-CE 3.69Å; L19-M211 HydrophobicContact CD2-SD 4.4Å; L19-M211 HydrophobicContact CG-CE 4.17Å |
| 20 | I | 35.5 | Very low | 36.2 | Very low | 127 Ų | 127 | 109 Ų | 109 | 65% | 0.651 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -97.8 | -9.8 | -176.9 | -65.3 | 163.8 | 0 | 0 | 0 | 112.3 | K16 L17 I18 P22 | K16-I20 HydrophobicContact CB-CD1 4.4Å; K16-I20 WeakPolarHBondContact O-CB 3.48Å; K16-I20 VanDerWaalsContact O-CD1 3.26Å; K16-I20 WeakPolarHBondContact O-CD1 3.31Å; K16-I20 WeakPolarHBondContact O-CG1 3.43Å; K16-I20 PolarHBondContact O-N 3.23Å; L17-I20 PolarHBondContact O-N 3.12Å; I18-I20 VanDerWaalsContact C-N 3.25Å; I18-I20 PolarHBondContact O-N 2.96Å; I20-P22 VanDerWaalsContact O-CD 3.3Å; I20-P22 WeakPolarHBondContact O-CD 3.32Å; I20-P22 VanDerWaalsContact O-N 3.14Å |
| 21 | M | 30.3 | Very low | 35.4 | Very low | 127 Ų | 127 | 107.5 Ų | 107.5 | 63% | 0.626 | 55% | 0.551 | S | S | * | * | trans | -59.1 | 120.4 | 180 | -85.3 | -153.3 | 175.9 | 0 | 0 | 111.4 | L17 F23 | L17-M21 PolarHBondContact O-N 3.1Å; L17-M21 VanDerWaalsContact O-N 3.11Å; M21-F23 HydrophobicContact CB-CD2 4.5Å; M21-F23 HydrophobicContact CB-CE2 4.37Å; M21-F23 PolarHBondContact O-N 3.01Å | ||
| 22 | P | 29.1 | Very low | 34.8 | Very low | 120 Ų | 120 | 112.6 Ų | 112.6 | 78% | 0.779 | 59% | 0.587 | S | S | * | * | trans | -73.4 | 98 | 175.2 | 29.1 | -30.8 | 0 | 0 | 0 | 108.5 | I20 R24 | I20-P22 VanDerWaalsContact O-CD 3.3Å; I20-P22 WeakPolarHBondContact O-CD 3.32Å; I20-P22 VanDerWaalsContact O-N 3.14Å; P22-R24 VanDerWaalsContact C-N 3.3Å; P22-R24 PolarHBondContact O-N 3.31Å | ||
| 23 | F | 41.5 | Very low | 34.1 | Very low | 114 Ų | 114 | 117.7 Ų | 117.7 | 50% | 0.5 | 61% | 0.609 | S | S | . | * | trans | -68 | 89.1 | 171 | -86.2 | -88.9 | 0 | 0 | 0 | 109.7 | M21 P25 L203 | M21-F23 HydrophobicContact CB-CD2 4.5Å; M21-F23 HydrophobicContact CB-CE2 4.37Å; M21-F23 PolarHBondContact O-N 3.01Å; F23-P25 WeakPolarHBondContact O-CD 3.34Å; F23-L203 HydrophobicContact CB-CD2 4.35Å; F23-L203 HydrophobicContact CD1-CD1 3.7Å; F23-L203 HydrophobicContact CE1-CD1 3.95Å; F23-L203 HydrophobicContact CG-CD1 4.3Å | ||
| 24 | R | 27.5 | Very low | 33.4 | Very low | 230 Ų | 230 | 120.8 Ų | 120.8 | 87% | 0.868 | 62% | 0.624 | S | S | * | * | trans | -84 | 113.4 | 173.5 | -138.5 | -179.3 | -164.1 | -174.7 | 4.5 | 108.3 | P22 R26 | P22-R24 VanDerWaalsContact C-N 3.3Å; P22-R24 PolarHBondContact O-N 3.31Å; R24-R26 PolarHBondContact O-N 3.21Å | ||
| 25 | P | 33.9 | Very low | 32.7 | Very low | 68 Ų | 68 | 126.7 Ų | 126.7 | 44% | 0.442 | 65% | 0.652 | S | S | . | * | trans | -65.9 | 123.7 | 172.2 | 25.1 | -30.4 | 0 | 0 | 0 | 109 | F23 H27 | F23-P25 WeakPolarHBondContact O-CD 3.34Å; P25-H27 PolarHBondContact O-N 3.39Å | ||
| 26 | R | 31.2 | Very low | 32.1 | Very low | 231 Ų | 231 | 133.4 Ų | 133.4 | 87% | 0.872 | 69% | 0.686 | S | S | * | * | trans | -73.9 | 94.2 | 168.7 | -74.3 | -173.5 | -170.6 | -172.6 | 3.4 | 108.3 | R24 T28 | R24-R26 PolarHBondContact O-N 3.21Å; R26-T28 PolarHBondContact O-N 3.07Å | ||
| 27 | H | 32.5 | Very low | 31.4 | Very low | 168 Ų | 168 | 132.1 Ų | 132.1 | 78% | 0.778 | 69% | 0.691 | S | S | * | * | trans | -80.5 | 97.2 | 154.4 | -74.8 | -75.7 | 0 | 0 | 0 | 107.5 | P25 | P25-H27 PolarHBondContact O-N 3.39Š| ||
| 28 | T | 28.3 | Very low | 30.9 | Very low | 110 Ų | 110 | 135.4 Ų | 135.4 | 68% | 0.675 | 71% | 0.709 | S | S | * | * | trans | -99 | 110.2 | 155.8 | 41.5 | 0 | 0 | 0 | 0 | 106.8 | R26 L30 | R26-T28 PolarHBondContact O-N 3.07Å; T28-L30 PolarHBondContact O-N 2.99Å; T28-L30 VanDerWaalsContact O-N 3.13Å | ||
| 29 | P | 28.7 | Very low | 30.1 | Very low | 109 Ų | 109 | 141.8 Ų | 141.8 | 71% | 0.708 | 74% | 0.744 | S | S | * | * | trans | -70.9 | 107.1 | 168.2 | 27.5 | -28.1 | 0 | 0 | 0 | 107.9 | S31 | P29-S31 PolarHBondContact O-N 3.39Å; P29-S31 VanDerWaalsContact O-N 3.1Å | ||
| 30 | L | 28.7 | Very low | 29.6 | Very low | 175 Ų | 175 | 145.4 Ų | 145.4 | 92% | 0.916 | 76% | 0.758 | S | S | * | * | trans | -80.7 | 77.3 | 170.7 | -146.3 | 100.6 | 0 | 0 | 0 | 107.8 | T28 | T28-L30 PolarHBondContact O-N 2.99Å; T28-L30 VanDerWaalsContact O-N 3.13Å | ||
| 31 | S | 29.8 | Very low | 29.3 | Very low | 98 Ų | 98 | 144.7 Ų | 144.7 | 69% | 0.685 | 76% | 0.759 | S | S | * | * | trans | -157.3 | 74.5 | 173.4 | 57.7 | 0 | 0 | 0 | 0 | 110.1 | P29 | P29-S31 PolarHBondContact O-N 3.39Å; P29-S31 VanDerWaalsContact O-N 3.1Å | ||
| 32 | S | 29.3 | Very low | 29.1 | Very low | 111 Ų | 111 | 147.6 Ų | 147.6 | 78% | 0.776 | 77% | 0.769 | S | S | * | * | trans | -177.8 | 75.7 | 157.7 | 40.2 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 33 | L | 28 | Very low | 29 | Very low | 171 Ų | 171 | 150.7 Ų | 150.7 | 90% | 0.895 | 77% | 0.77 | S | S | * | * | trans | -163.3 | 64 | 160 | -104.4 | 155.2 | 0 | 0 | 0 | 107.4 | ||||
| 34 | I | 27.7 | Very low | 28.3 | Very low | 160 Ų | 160 | 151.4 Ų | 151.4 | 82% | 0.821 | 78% | 0.784 | S | S | * | * | trans | -114.3 | 104.9 | 153 | -63.5 | 178 | 0 | 0 | 0 | 103.7 | D36 | I34-D36 PolarHBondContact O-N 3.03Š| ||
| 35 | M | 25.4 | Very low | 29.2 | Very low | 175 Ų | 175 | 145.9 Ų | 145.9 | 86% | 0.862 | 78% | 0.777 | S | S | * | * | trans | -68.8 | 114.8 | 165.2 | -91.4 | -171.5 | 159.9 | 0 | 0 | 107.3 | ||||
| 36 | D | 25.6 | Very low | 28.8 | Very low | 156 Ų | 156 | 148.8 Ų | 148.8 | 83% | 0.834 | 79% | 0.794 | S | S | * | * | trans | -94.4 | 111.7 | 156.7 | -110.6 | -33.4 | 0 | 0 | 0 | 107.2 | I34 | I34-D36 PolarHBondContact O-N 3.03Š| ||
| 37 | P | 30.2 | Very low | 28.7 | Very low | 102 Ų | 102 | 145 Ų | 145 | 66% | 0.662 | 79% | 0.791 | S | S | * | * | trans | -96 | 97 | 170 | 33.1 | -21.3 | 0 | 0 | 0 | 107.5 | ||||
| 38 | N | 25.2 | Very low | 28.5 | Very low | 169 Ų | 169 | 144.4 Ų | 144.4 | 90% | 0.904 | 79% | 0.792 | S | S | * | * | trans | -179.7 | 92.2 | 148.9 | -91.2 | -20.7 | 0 | 0 | 0 | 109.8 | ||||
| 39 | N | 24.4 | Very low | 28.8 | Very low | 162 Ų | 162 | 144.4 Ų | 144.4 | 87% | 0.866 | 79% | 0.794 | S | S | * | * | trans | -134.7 | 100.7 | 151.9 | -163.3 | 12 | 0 | 0 | 0 | 108 | ||||
| 40 | E | 29.3 | Very low | 28.8 | Very low | 171 Ų | 171 | 145.3 Ų | 145.3 | 80% | 0.799 | 80% | 0.798 | S | S | * | * | trans | -118.9 | 118.6 | 161.1 | -96.9 | -155.3 | 157.3 | 0 | 0 | 110.3 | ||||
| 41 | T | 28.9 | Very low | 30 | Very low | 111 Ų | 111 | 142.1 Ų | 142.1 | 68% | 0.681 | 79% | 0.787 | S | S | * | * | trans | 92.4 | 139.4 | 139.2 | 65.4 | 0 | 0 | 0 | 0 | 121.7 | ||||
| 42 | K | 27 | Very low | 29.9 | Very low | 189 Ų | 189 | 143.9 Ų | 143.9 | 82% | 0.822 | 79% | 0.794 | S | S | * | * | trans | 83.3 | 142.9 | 163 | -67.6 | 178.4 | -179.7 | 174.4 | 0 | 117.7 | ||||
| 43 | K | 26.6 | Very low | 29.9 | Very low | 185 Ų | 185 | 146.5 Ų | 146.5 | 80% | 0.804 | 79% | 0.794 | S | S | * | * | cis | -177.5 | 144.9 | -27.8 | -120.6 | -175.9 | -175.4 | -174.2 | 0 | 104.6 | ||||
| 44 | T | 27.3 | Very low | 29.9 | Very low | 129 Ų | 129 | 145.9 Ų | 145.9 | 79% | 0.791 | 79% | 0.791 | S | S | * | * | trans | 79.3 | 135.2 | 154.4 | 0.2 | 0 | 0 | 0 | 0 | 121.3 | ||||
| 45 | P | 45.2 | Very low | 30.5 | Very low | 113 Ų | 113 | 142.6 Ų | 142.6 | 73% | 0.734 | 78% | 0.78 | S | S | * | * | trans | -112.2 | 147.3 | 176.6 | 38.9 | -27.8 | 0 | 0 | 0 | 113.9 | ||||
| 46 | T | 26.5 | Very low | 30.5 | Very low | 129 Ų | 129 | 141 Ų | 141 | 79% | 0.791 | 78% | 0.775 | S | S | * | * | trans | -157.9 | 117.5 | 164.8 | -16.2 | 0 | 0 | 0 | 0 | 115.2 | ||||
| 47 | L | 28.1 | Very low | 30.7 | Very low | 153 Ų | 153 | 140.2 Ų | 140.2 | 80% | 0.801 | 77% | 0.771 | S | S | * | * | trans | 45.2 | 121.8 | 137.7 | -60.2 | 168.7 | 0 | 0 | 0 | 123.9 | ||||
| 48 | L | 27.6 | Very low | 30.6 | Very low | 154 Ų | 154 | 144 Ų | 144 | 81% | 0.806 | 78% | 0.779 | S | S | * | * | trans | 15.6 | 165.1 | 131.8 | -81.3 | 143.9 | 0 | 0 | 0 | 121.5 | ||||
| 49 | P | 35.8 | Very low | 30.9 | Very low | 111 Ų | 111 | 141.1 Ų | 141.1 | 72% | 0.721 | 78% | 0.779 | S | S | * | * | cis | -139 | 178.3 | -3.9 | 32.6 | -8.5 | 0 | 0 | 0 | 116.5 | ||||
| 50 | T | 28.9 | Very low | 31 | Very low | 127 Ų | 127 | 138.1 Ų | 138.1 | 78% | 0.779 | 77% | 0.771 | S | S | * | * | trans | -65.6 | -174.8 | 160.2 | 13.8 | 0 | 0 | 0 | 0 | 112.8 | ||||
| 51 | P | 53.8 | Low | 31 | Very low | 108 Ų | 108 | 138.9 Ų | 138.9 | 70% | 0.701 | 77% | 0.774 | S | S | * | * | cis | -139.3 | 173.8 | -16 | 33.6 | -13.6 | 0 | 0 | 0 | 114.7 | ||||
| 52 | T | 28.1 | Very low | 30.8 | Very low | 135 Ų | 135 | 139.7 Ų | 139.7 | 83% | 0.828 | 78% | 0.779 | S | S | * | * | trans | -161.8 | 114 | 151.5 | 35.3 | 0 | 0 | 0 | 0 | 113.8 | ||||
| 53 | H | 27.8 | Very low | 31 | Very low | 166 Ų | 166 | 139 Ų | 139 | 77% | 0.769 | 78% | 0.779 | S | S | * | * | 28.7 | 130.5 | 128.2 | -80.5 | -74.9 | 0 | 0 | 0 | 119.3 | |||||
| 54 | L | 29.1 | Very low | 31 | Very low | 158 Ų | 158 | 141 Ų | 141 | 83% | 0.827 | 78% | 0.781 | S | S | * | * | cis | -174.7 | -178.1 | 48.7 | -105.3 | 157 | 0 | 0 | 0 | 109.4 | ||||
| 55 | P | 39.9 | Very low | 31.4 | Very low | 91 Ų | 91 | 143 Ų | 143 | 59% | 0.591 | 79% | 0.786 | S | S | * | * | trans | -103.6 | 162.7 | -140.3 | 42.3 | -31.6 | 0 | 0 | 0 | 114.3 | ||||
| 56 | D | 24.5 | Very low | 30.8 | Very low | 141 Ų | 141 | 142.6 Ų | 142.6 | 75% | 0.754 | 78% | 0.782 | S | S | * | * | 162.8 | 131.6 | 119.8 | -90.4 | -30.6 | 0 | 0 | 0 | 112 | |||||
| 57 | N | 30.7 | Very low | 31.1 | Very low | 140 Ų | 140 | 141.3 Ų | 141.3 | 75% | 0.749 | 78% | 0.776 | S | S | * | * | trans | 31.3 | 96.3 | 147.6 | -73.8 | -25.9 | 0 | 0 | 0 | 118.4 | ||||
| 58 | H | 29 | Very low | 31.6 | Very low | 181 Ų | 181 | 140.1 Ų | 140.1 | 84% | 0.838 | 78% | 0.777 | S | S | * | * | -149.4 | 113.7 | 124.4 | -94 | -65.7 | 0 | 0 | 0 | 109 | S60 | H58-S60 VanDerWaalsContact C-N 3.32Å; H58-S60 PolarHBondContact O-N 3.2Å | |||
| 59 | A | 30.9 | Very low | 32.3 | Very low | 110 Ų | 110 | 141.5 Ų | 141.5 | 91% | 0.909 | 78% | 0.777 | S | S | * | * | trans | -55.9 | 97.8 | 162.7 | 0 | 0 | 0 | 0 | 0 | 108.6 | ||||
| 60 | S | 25.9 | Very low | 32.8 | Very low | 98 Ų | 98 | 139 Ų | 139 | 69% | 0.685 | 77% | 0.771 | S | S | * | * | trans | -109.4 | 92.2 | 160.3 | 42.4 | 0 | 0 | 0 | 0 | 105.7 | H58 T62 | H58-S60 VanDerWaalsContact C-N 3.32Å; H58-S60 PolarHBondContact O-N 3.2Å; S60-T62 PolarHBondContact O-N 3.44Å | ||
| 61 | E | 28.5 | Very low | 33.7 | Very low | 187 Ų | 187 | 136.3 Ų | 136.3 | 87% | 0.874 | 76% | 0.756 | S | S | * | * | trans | -40 | 103 | 164.8 | -160.6 | 170 | -169.8 | 0 | 0 | 108 | Q63 | E61-Q63 PolarHBondContact O-N 3.42Š| ||
| 62 | T | 26.5 | Very low | 33.6 | Very low | 129 Ų | 129 | 133.4 Ų | 133.4 | 79% | 0.791 | 75% | 0.746 | S | S | * | * | trans | -69.9 | 85.9 | 175.9 | -30.7 | 0 | 0 | 0 | 0 | 105.1 | S60 R64 | S60-T62 PolarHBondContact O-N 3.44Å; T62-R64 PolarHBondContact O-N 3.41Å | ||
| 63 | Q | 30.8 | Very low | 35.1 | Very low | 175 Ų | 175 | 128.6 Ų | 128.6 | 82% | 0.818 | 72% | 0.717 | S | S | * | * | trans | -58.3 | 96.6 | 172 | -155.7 | 167.5 | 11.3 | 0 | 0 | 104.9 | E61 L65 | E61-Q63 PolarHBondContact O-N 3.42Å; Q63-L65 VanDerWaalsContact C-N 3.29Å; Q63-L65 PolarHBondContact O-N 3.17Å | ||
| 64 | R | 27.1 | Very low | 37.5 | Very low | 225 Ų | 225 | 121.7 Ų | 121.7 | 85% | 0.849 | 69% | 0.688 | S | S | * | * | trans | -55.1 | 104 | 170.7 | -70.2 | -175.9 | -152.9 | -162.2 | 4.9 | 104.6 | T62 T66 | T62-R64 PolarHBondContact O-N 3.41Å; R64-T66 PolarHBondContact O-N 2.94Å | ||
| 65 | L | 35 | Very low | 40 | Very low | 171 Ų | 171 | 123 Ų | 123 | 90% | 0.895 | 68% | 0.682 | S | S | * | * | trans | -58.5 | 87.6 | 159.3 | -90.4 | 132.1 | 0 | 0 | 0 | 105.6 | Q63 | Q63-L65 VanDerWaalsContact C-N 3.29Å; Q63-L65 PolarHBondContact O-N 3.17Å | ||
| 66 | T | 33.4 | Very low | 42.2 | Very low | 105 Ų | 105 | 119.4 Ų | 119.4 | 64% | 0.644 | 66% | 0.657 | S | S | * | * | trans | -54.7 | 128.3 | 164.9 | 49.4 | 0 | 0 | 0 | 0 | 105.8 | R64 | R64-T66 PolarHBondContact O-N 2.94Š| ||
| 67 | P | 32.3 | Very low | 45.2 | Very low | 102 Ų | 102 | 112.7 Ų | 112.7 | 66% | 0.662 | 62% | 0.622 | S | S | * | * | trans | -54.2 | 143.7 | 176.5 | 24 | -33 | 0 | 0 | 0 | 108.3 | K69 | P67-K69 PolarHBondContact O-N 3.47Š| ||
| 68 | P | 37.8 | Very low | 47.9 | Very low | 128 Ų | 128 | 109.1 Ų | 109.1 | 83% | 0.831 | 61% | 0.605 | S | S | * | * | trans | -53.7 | 111.2 | -177.5 | 20.5 | -31.1 | 0 | 0 | 0 | 108.5 | G70 | P68-G70 PolarHBondContact O-N 3.32Š| ||
| 69 | K | 42.5 | Very low | 50.7 | Low | 183 Ų | 183 | 104.3 Ų | 104.3 | 80% | 0.796 | 59% | 0.585 | S | S | * | * | trans | -55.1 | 119 | 174 | -84.9 | 179.2 | 177.2 | 172.2 | 0 | 106.3 | P67 R280 | P67-K69 PolarHBondContact O-N 3.47Å; K69-R280 PolarHBondContact O-NH2 3.37Å | ||
| 70 | G | 45.8 | Very low | 53.5 | Low | 58 Ų | 58 | 99.1 Ų | 99.1 | 60% | 0.598 | 54% | 0.541 | S | S | * | . | trans | -48.4 | 152.2 | -178 | 0 | 0 | 0 | 0 | 0 | 111.6 | P68 G72 | P68-G70 PolarHBondContact O-N 3.32Å; G70-G72 PolarHBondContact O-N 3.45Å | ||
| 71 | P | 49 | Very low | 56.5 | Low | 71 Ų | 71 | 94.4 Ų | 94.4 | 46% | 0.461 | 51% | 0.509 | S | S | . | . | trans | -62.9 | 97.4 | -173.8 | 24.6 | -31.9 | 0 | 0 | 0 | 110.4 | C73 | P71-C73 PolarHBondContact O-N 2.65Å; P71-C73 VanDerWaalsContact O-N 3.1Å | ||
| 72 | G | 51.2 | Low | 59.5 | Low | 48 Ų | 48 | 87.8 Ų | 87.8 | 50% | 0.495 | 48% | 0.481 | S | S | . | . | trans | -68.5 | 103.4 | 171.1 | 0 | 0 | 0 | 0 | 0 | 108.2 | G70 S74 | G70-G72 PolarHBondContact O-N 3.45Å; G72-S74 PolarHBondContact O-N 2.94Å; G72-S74 VanDerWaalsContact O-N 3.07Å | ||
| 73 | C | 60 | Low | 62.6 | Low | 34 Ų | 34 | 82.1 Ų | 82.1 | 23% | 0.23 | 45% | 0.446 | C | S | . | . | trans | -68.3 | 105.1 | 165 | -170.1 | 0 | 0 | 0 | 0 | 106.7 | P71 W75 | P71-C73 PolarHBondContact O-N 2.65Å; P71-C73 VanDerWaalsContact O-N 3.1Å; C73-W75 PolarHBondContact O-N 3.31Å | ||
| 74 | S | 77 | Confident | 65.5 | Low | 21 Ų | 21 | 73.8 Ų | 73.8 | 15% | 0.147 | 41% | 0.407 | C | S | . | . | trans | -57.6 | 138.4 | 176.2 | -173.7 | 0 | 0 | 0 | 0 | 109.3 | G72 L76 V77 M277 | G72-S74 PolarHBondContact O-N 2.94Å; G72-S74 VanDerWaalsContact O-N 3.07Å; S74-L76 PolarHBondContact O-N 3.18Å; S74-V77 WeakPolarHBondContact O-CB 3.49Å; S74-V77 PolarHBondContact O-N 3.06Å; S74-M277 WeakPolarHBondContact CB-O 3.47Å | ||
| 75 | W | 82.8 | Confident | 68.6 | Low | 184 Ų | 184 | 63.1 Ų | 63.1 | 70% | 0.697 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -51.4 | -29 | 174.5 | 67.3 | -85.4 | 0 | 0 | 0 | 112 | C73 V77 V78 I79 | C73-W75 PolarHBondContact O-N 3.31Å; W75-V77 PolarHBondContact O-N 3.47Å; W75-V78 PolarHBondContact O-N 3.14Å; W75-I79 HydrophobicContact CE3-CD1 3.31Å; W75-I79 HydrophobicContact CE3-CG1 4.22Å; W75-I79 HydrophobicContact CZ3-CD1 3.34Å; W75-I79 WeakPolarHBondContact O-CG1 3.22Å; W75-I79 PolarHBondContact O-N 3.46Å |
| 76 | L | 85.9 | Confident | 71.4 | Confident | 16 Ų | 16 | 56.1 Ų | 56.1 | 8% | 0.084 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -60.2 | -39.6 | 175.2 | -173.6 | 65 | 0 | 0 | 0 | 113 | S74 V78 A80 L254 R276 M277 | S74-L76 PolarHBondContact O-N 3.18Å; L76-V78 VanDerWaalsContact C-N 3.34Å; L76-A80 VanDerWaalsContact O-CB 3.24Å; L76-A80 WeakPolarHBondContact O-CB 3.43Å; L76-A80 PolarHBondContact O-N 3.12Å; L76-L254 HydrophobicContact CD1-CD2 4.06Å; L76-R276 HydrophobicContact CD2-CG 4Å; L76-M277 HydrophobicContact CD2-CG 4.36Å |
| 77 | V | 86.6 | Confident | 74.3 | Confident | 1 Ų | 1 | 51.1 Ų | 51.1 | 1% | 0.006 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -67.5 | -39.6 | 178.6 | 176 | 0 | 0 | 0 | 0 | 110.4 | S74 W75 A80 A81 L204 M277 | S74-V77 WeakPolarHBondContact O-CB 3.49Å; S74-V77 PolarHBondContact O-N 3.06Å; W75-V77 PolarHBondContact O-N 3.47Å; V77-A80 PolarHBondContact O-N 3.2Å; V77-A81 VanDerWaalsContact O-CB 3.32Å; V77-A81 WeakPolarHBondContact O-CB 3.47Å; V77-A81 PolarHBondContact O-N 2.9Å; V77-L204 HydrophobicContact CG1-CD1 3.89Å; V77-M277 HydrophobicContact CG2-CB 4.1Å; V77-M277 HydrophobicContact CG2-CE 4.22Å; V77-M277 WeakPolarHBondContact CG2-O 3.38Å |
| 78 | V | 86.8 | Confident | 77.2 | Confident | 65 Ų | 65 | 46.2 Ų | 46.2 | 39% | 0.394 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -65.5 | -46.8 | 178.6 | -179.5 | 0 | 0 | 0 | 0 | 110.2 | W75 L76 A80 A81 V82 | W75-V78 PolarHBondContact O-N 3.14Å; L76-V78 VanDerWaalsContact C-N 3.34Å; V78-A80 VanDerWaalsContact C-N 3.34Å; V78-A80 PolarHBondContact O-N 2.66Å; V78-A81 PolarHBondContact O-N 3.5Å; V78-V82 HydrophobicContact CG1-CG2 4.29Å; V78-V82 WeakPolarHBondContact O-CB 3.42Å; V78-V82 VanDerWaalsContact O-CG2 3.27Å; V78-V82 WeakPolarHBondContact O-CG2 3.37Å; V78-V82 PolarHBondContact O-N 2.94Å |
| 79 | I | 89.4 | Confident | 80 | Confident | 80 Ų | 80 | 41.6 Ų | 41.6 | 41% | 0.41 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -62.3 | -42.7 | 176.4 | -68.7 | -175.8 | 0 | 0 | 0 | 111.5 | W75 A81 V82 S83 | W75-I79 HydrophobicContact CE3-CD1 3.31Å; W75-I79 HydrophobicContact CE3-CG1 4.22Å; W75-I79 HydrophobicContact CZ3-CD1 3.34Å; W75-I79 WeakPolarHBondContact O-CG1 3.22Å; W75-I79 PolarHBondContact O-N 3.46Å; I79-A81 VanDerWaalsContact C-N 3.32Å; I79-A81 PolarHBondContact O-N 3.24Å; I79-V82 PolarHBondContact O-N 3.47Å; I79-S83 VanDerWaalsContact O-CB 3.3Å; I79-S83 WeakPolarHBondContact O-CB 3.14Å; I79-S83 PolarHBondContact O-N 3.41Å; I79-S83 PolarHBondContact O-OG 3.25Å |
| 80 | A | 89.3 | Confident | 82.5 | Confident | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -61.4 | -41.4 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | L76 V77 V78 S83 A84 Y191 I195 L254 M277 | L76-A80 VanDerWaalsContact O-CB 3.24Å; L76-A80 WeakPolarHBondContact O-CB 3.43Å; L76-A80 PolarHBondContact O-N 3.12Å; V77-A80 PolarHBondContact O-N 3.2Å; V78-A80 VanDerWaalsContact C-N 3.34Å; V78-A80 PolarHBondContact O-N 2.66Å; A80-S83 WeakPolarHBondContact CA-OG 3.49Å; A80-S83 PolarHBondContact O-OG 2.9Å; A80-A84 VanDerWaalsContact O-CB 3.31Å; A80-A84 WeakPolarHBondContact O-CB 3.26Å; A80-A84 PolarHBondContact O-N 3.44Å; A80-Y191 HydrophobicContact CB-CE1 4.14Å; A80-I195 HydrophobicContact CB-CD1 3.47Å; A80-I195 VanDerWaalsContact CB-CD1 3.47Å; A80-L254 HydrophobicContact CB-CD1 4.25Å; A80-L254 HydrophobicContact CB-CD2 3.79Å; A80-M277 HydrophobicContact CB-CE 4.44Å |
| 81 | A | 89.2 | Confident | 84.8 | Confident | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -69.6 | -44.1 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | V77 V78 I79 A84 S85 I192 L204 | V77-A81 VanDerWaalsContact O-CB 3.32Å; V77-A81 WeakPolarHBondContact O-CB 3.47Å; V77-A81 PolarHBondContact O-N 2.9Å; V78-A81 PolarHBondContact O-N 3.5Å; I79-A81 VanDerWaalsContact C-N 3.32Å; I79-A81 PolarHBondContact O-N 3.24Å; A81-A84 PolarHBondContact O-N 3.39Å; A81-S85 VanDerWaalsContact O-CB 3.3Å; A81-S85 WeakPolarHBondContact O-CB 3.5Å; A81-S85 PolarHBondContact O-N 2.99Å; A81-S85 PolarHBondContact O-OG 3.04Å; A81-I192 HydrophobicContact CB-CG1 4.49Å; A81-I192 HydrophobicContact CB-CG2 4.43Å; A81-L204 HydrophobicContact CB-CD2 3.91Å |
| 82 | V | 90.7 | Very high | 86.9 | Confident | 48 Ų | 48 | 27.6 Ų | 27.6 | 29% | 0.291 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -63.5 | -46.9 | 178 | 171.1 | 0 | 0 | 0 | 0 | 110.7 | V78 I79 A84 S85 L86 L207 | V78-V82 HydrophobicContact CG1-CG2 4.29Å; V78-V82 WeakPolarHBondContact O-CB 3.42Å; V78-V82 VanDerWaalsContact O-CG2 3.27Å; V78-V82 WeakPolarHBondContact O-CG2 3.37Å; V78-V82 PolarHBondContact O-N 2.94Å; I79-V82 PolarHBondContact O-N 3.47Å; V82-A84 PolarHBondContact O-N 3.3Å; V82-S85 PolarHBondContact O-N 3.02Å; V82-S85 VanDerWaalsContact O-N 3.12Å; V82-L86 WeakPolarHBondContact O-CD1 3.36Å; V82-L86 PolarHBondContact O-N 3.19Å; V82-L207 HydrophobicContact CG2-CD2 3.94Å |
| 83 | S | 91.8 | Very high | 89 | Confident | 9 Ų | 9 | 26 Ų | 26 | 6% | 0.063 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -64.3 | -37.2 | 178.3 | 58.1 | 0 | 0 | 0 | 0 | 113 | I79 A80 S85 L86 L254 | I79-S83 VanDerWaalsContact O-CB 3.3Å; I79-S83 WeakPolarHBondContact O-CB 3.14Å; I79-S83 PolarHBondContact O-N 3.41Å; I79-S83 PolarHBondContact O-OG 3.25Å; A80-S83 WeakPolarHBondContact CA-OG 3.49Å; A80-S83 PolarHBondContact O-OG 2.9Å; S83-S85 VanDerWaalsContact C-N 3.35Å; S83-L86 WeakPolarHBondContact O-CB 3.01Å; S83-L254 WeakPolarHBondContact OG-CD1 3.3Å |
| 84 | A | 92 | Very high | 90.7 | Very high | 0 Ų | 0 | 24.4 Ų | 24.4 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -70.1 | -32.9 | 172.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | A80 A81 V82 L86 S87 L147 A188 Y191 I192 | A80-A84 VanDerWaalsContact O-CB 3.31Å; A80-A84 WeakPolarHBondContact O-CB 3.26Å; A80-A84 PolarHBondContact O-N 3.44Å; A81-A84 PolarHBondContact O-N 3.39Å; V82-A84 PolarHBondContact O-N 3.3Å; A84-L86 PolarHBondContact O-N 2.94Å; A84-S87 VanDerWaalsContact O-CB 3.32Å; A84-S87 WeakPolarHBondContact O-CB 3.47Å; A84-S87 PolarHBondContact O-N 3.46Å; A84-S87 VanDerWaalsContact O-N 3.16Å; A84-S87 PolarHBondContact O-OG 2.99Å; A84-L147 HydrophobicContact CB-CD1 4.49Å; A84-A188 HydrophobicContact CB-CB 4.35Å; A84-A188 WeakPolarHBondContact O-CB 3.5Å; A84-Y191 HydrophobicContact CB-CD1 3.88Å; A84-I192 HydrophobicContact CB-CD1 4.03Å; A84-I192 HydrophobicContact CB-CG1 3.8Å |
| 85 | S | 92.4 | Very high | 91.3 | Very high | 1 Ų | 1 | 25.8 Ų | 25.8 | 1% | 0.007 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -69.8 | -17.6 | 179 | -58.2 | 0 | 0 | 0 | 0 | 113.4 | A81 V82 S83 S87 G88 L89 I192 M211 | A81-S85 VanDerWaalsContact O-CB 3.3Å; A81-S85 WeakPolarHBondContact O-CB 3.5Å; A81-S85 PolarHBondContact O-N 2.99Å; A81-S85 PolarHBondContact O-OG 3.04Å; V82-S85 PolarHBondContact O-N 3.02Å; V82-S85 VanDerWaalsContact O-N 3.12Å; S83-S85 VanDerWaalsContact C-N 3.35Å; S85-S87 PolarHBondContact O-N 3.46Å; S85-G88 WeakPolarHBondContact O-CA 3.35Å; S85-G88 PolarHBondContact O-N 3.38Å; S85-L89 PolarHBondContact O-N 3.1Å; S85-I192 WeakPolarHBondContact OG-CD1 3.48Å; S85-M211 VanDerWaalsContact O-CB 3.28Å; S85-M211 WeakPolarHBondContact O-CB 3.39Å |
| 86 | L | 93.9 | Very high | 91.7 | Very high | 24 Ų | 24 | 17 Ų | 17 | 13% | 0.126 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -56.8 | -27.4 | 169 | -97.7 | 63.6 | 0 | 0 | 0 | 112.4 | V82 S83 A84 G88 L89 M90 L246 Q247 | V82-L86 WeakPolarHBondContact O-CD1 3.36Å; V82-L86 PolarHBondContact O-N 3.19Å; S83-L86 WeakPolarHBondContact O-CB 3.01Å; A84-L86 PolarHBondContact O-N 2.94Å; L86-G88 PolarHBondContact O-N 3.32Å; L86-L89 VanDerWaalsContact O-CB 3.3Å; L86-L89 WeakPolarHBondContact O-CB 3.5Å; L86-L89 PolarHBondContact O-N 2.95Å; L86-L89 VanDerWaalsContact O-N 3.16Å; L86-M90 WeakPolarHBondContact O-CG 3.31Å; L86-M90 PolarHBondContact O-N 3.09Å; L86-L246 HydrophobicContact CD2-CB 4.26Å; L86-L246 HydrophobicContact CD2-CD2 3.88Å; L86-L246 HydrophobicContact CD2-CG 3.98Å; L86-Q247 HydrophobicContact CB-CB 4.21Å; L86-Q247 HydrophobicContact CD2-CB 4.2Å |
| 87 | S | 94.3 | Very high | 92.1 | Very high | 0 Ų | 0 | 16.2 Ų | 16.2 | 0% | 0 | 9% | 0.088 | C | C | . | . | H | α-helix | trans | -62 | -35.2 | 173.6 | -65.7 | 0 | 0 | 0 | 0 | 111.9 | A84 S85 M90 L91 Q247 | A84-S87 VanDerWaalsContact O-CB 3.32Å; A84-S87 WeakPolarHBondContact O-CB 3.47Å; A84-S87 PolarHBondContact O-N 3.46Å; A84-S87 VanDerWaalsContact O-N 3.16Å; A84-S87 PolarHBondContact O-OG 2.99Å; S85-S87 PolarHBondContact O-N 3.46Å; S87-M90 PolarHBondContact O-N 3.4Å; S87-L91 PolarHBondContact O-N 3.11Å; S87-Q247 PolarHBondContact OG-NE2 2.68Å; S87-Q247 PolarHBondContact OG-OE1 3.44Å |
| 88 | G | 93.5 | Very high | 92.3 | Very high | 0 Ų | 0 | 16.5 Ų | 16.5 | 0% | 0 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -64.5 | -46.4 | 173.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | S85 L86 M90 L91 G92 Y208 V212 | S85-G88 WeakPolarHBondContact O-CA 3.35Å; S85-G88 PolarHBondContact O-N 3.38Å; L86-G88 PolarHBondContact O-N 3.32Å; G88-M90 VanDerWaalsContact C-N 3.31Å; G88-M90 PolarHBondContact O-N 3.1Å; G88-L91 PolarHBondContact O-N 3.39Å; G88-G92 PolarHBondContact O-N 3.03Å; G88-Y208 VanDerWaalsContact N-CE2 3.31Å; G88-V212 VanDerWaalsContact CA-CG2 3.46Å; G88-V212 VanDerWaalsContact O-CA 3.26Å; G88-V212 WeakPolarHBondContact O-CA 3.26Å |
| 89 | L | 95.1 | Very high | 92.4 | Very high | 31 Ų | 31 | 13.4 Ų | 13.4 | 16% | 0.162 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -54.3 | -47.3 | 175.6 | -168.3 | 79.2 | 0 | 0 | 0 | 111.9 | S85 L86 G92 Y93 M211 V214 G215 L218 P243 | S85-L89 PolarHBondContact O-N 3.1Å; L86-L89 VanDerWaalsContact O-CB 3.3Å; L86-L89 WeakPolarHBondContact O-CB 3.5Å; L86-L89 PolarHBondContact O-N 2.95Å; L86-L89 VanDerWaalsContact O-N 3.16Å; L89-G92 PolarHBondContact O-N 3.44Å; L89-Y93 VanDerWaalsContact O-CB 3.29Å; L89-Y93 WeakPolarHBondContact O-CB 3.34Å; L89-Y93 PolarHBondContact O-N 2.88Å; L89-M211 VanDerWaalsContact CA-O 3.31Å; L89-M211 WeakPolarHBondContact CA-O 3.38Å; L89-M211 HydrophobicContact CB-CB 4.34Å; L89-M211 HydrophobicContact CD1-SD 4.41Å; L89-V214 HydrophobicContact CD1-CB 4.3Å; L89-V214 HydrophobicContact CD1-CG1 3.88Å; L89-G215 WeakPolarHBondContact O-CA 3.4Å; L89-L218 HydrophobicContact CD1-CD1 3.91Å; L89-P243 HydrophobicContact CD2-CB 4.45Å |
| 90 | M | 95.4 | Very high | 92.2 | Very high | 1 Ų | 1 | 9.7 Ų | 9.7 | 1% | 0.005 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -63 | -46.5 | 178.7 | -65.9 | 167.6 | 61 | 0 | 0 | 111.8 | L86 S87 G88 G92 Y93 E94 V154 V240 P243 A244 | L86-M90 WeakPolarHBondContact O-CG 3.31Å; L86-M90 PolarHBondContact O-N 3.09Å; S87-M90 PolarHBondContact O-N 3.4Å; G88-M90 VanDerWaalsContact C-N 3.31Å; G88-M90 PolarHBondContact O-N 3.1Å; M90-G92 VanDerWaalsContact C-N 3.34Å; M90-G92 PolarHBondContact O-N 3.03Å; M90-Y93 PolarHBondContact O-N 3.47Å; M90-E94 WeakPolarHBondContact O-CG 3.19Å; M90-E94 PolarHBondContact O-N 3.02Å; M90-E94 VanDerWaalsContact O-N 3.1Å; M90-V154 HydrophobicContact CE-CB 3.69Å; M90-V154 HydrophobicContact CE-CG1 3.47Å; M90-V154 VanDerWaalsContact CE-CG1 3.47Å; M90-V154 HydrophobicContact CE-CG2 3.83Å; M90-V240 HydrophobicContact CB-CG2 4.06Å; M90-V240 HydrophobicContact CE-CG2 4.34Å; M90-V240 HydrophobicContact CG-CG2 4Å; M90-P243 HydrophobicContact CG-CB 4.38Å; M90-P243 HydrophobicContact CG-CG 4.41Å; M90-A244 HydrophobicContact CE-CB 3.43Å; M90-A244 VanDerWaalsContact CE-CB 3.43Å; M90-A244 HydrophobicContact SD-CB 4.01Å |
| 91 | L | 94.4 | Very high | 92.3 | Very high | 16 Ų | 16 | 9.8 Ų | 9.8 | 8% | 0.084 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -59.2 | -45.8 | 176.6 | 176.3 | 65.6 | 0 | 0 | 0 | 111.6 | S87 G88 E94 M95 Y208 V212 | S87-L91 PolarHBondContact O-N 3.11Å; G88-L91 PolarHBondContact O-N 3.39Å; L91-E94 PolarHBondContact O-N 2.99Å; L91-M95 HydrophobicContact CD1-CE 3.92Å; L91-M95 HydrophobicContact CD2-CE 4.35Å; L91-M95 HydrophobicContact CG-CE 3.98Å; L91-M95 WeakPolarHBondContact O-CG 3.42Å; L91-M95 PolarHBondContact O-N 2.95Å; L91-Y208 WeakPolarHBondContact CD2-OH 3.09Å; L91-V212 HydrophobicContact CD2-CG2 4.42Å |
| 92 | G | 94.1 | Very high | 92.3 | Very high | 0 Ų | 0 | 10 Ų | 10 | 0% | 0 | 5% | 0.054 | C | C | . | . | H | α-helix | trans | -63.1 | -43.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | G88 L89 M90 E94 M95 G96 V212 G215 V216 | G88-G92 PolarHBondContact O-N 3.03Å; L89-G92 PolarHBondContact O-N 3.44Å; M90-G92 VanDerWaalsContact C-N 3.34Å; M90-G92 PolarHBondContact O-N 3.03Å; G92-E94 PolarHBondContact O-N 2.91Å; G92-M95 WeakPolarHBondContact O-CB 3.31Å; G92-M95 PolarHBondContact O-N 3.36Å; G92-M95 VanDerWaalsContact O-N 3.16Å; G92-G96 PolarHBondContact O-N 3.45Å; G92-V212 VanDerWaalsContact CA-O 3.29Å; G92-V212 WeakPolarHBondContact CA-O 3.24Å; G92-G215 CarbonylContact O-C 3.48Å; G92-V216 VanDerWaalsContact C-N 3.3Å; G92-V216 WeakPolarHBondContact O-CA 3.22Å; G92-V216 WeakPolarHBondContact O-CG2 3.43Å; G92-V216 PolarHBondContact O-N 3.23Å |
| 93 | Y | 95.3 | Very high | 92 | Very high | 16 Ų | 16 | 8.3 Ų | 8.3 | 6% | 0.063 | 4% | 0.043 | C | C | . | . | H | α-helix | trans | -57.5 | -47.8 | 178.4 | -174.7 | -101.4 | 0 | 0 | 0 | 111.6 | L89 M90 M95 G96 L97 G215 L218 C222 T236 L239 V240 | L89-Y93 VanDerWaalsContact O-CB 3.29Å; L89-Y93 WeakPolarHBondContact O-CB 3.34Å; L89-Y93 PolarHBondContact O-N 2.88Å; M90-Y93 PolarHBondContact O-N 3.47Å; Y93-M95 VanDerWaalsContact C-N 3.3Å; Y93-M95 PolarHBondContact O-N 3.22Å; Y93-G96 PolarHBondContact O-N 3.12Å; Y93-L97 HydrophobicContact CD1-CD2 3.42Å; Y93-L97 VanDerWaalsContact CD1-CD2 3.42Å; Y93-L97 HydrophobicContact CE1-CD2 3.29Å; Y93-L97 HydrophobicContact CG-CD2 4.33Å; Y93-L97 WeakPolarHBondContact O-CB 3.38Å; Y93-L97 WeakPolarHBondContact O-CD2 3.49Å; Y93-L97 WeakPolarHBondContact O-CG 3.03Å; Y93-L97 PolarHBondContact O-N 3.14Å; Y93-G215 VanDerWaalsContact CA-O 3.27Å; Y93-G215 WeakPolarHBondContact CA-O 3.28Å; Y93-G215 VanDerWaalsContact N-C 3.32Å; Y93-G215 PolarHBondContact N-O 3.25Å; Y93-L218 HydrophobicContact CD2-CB 4.11Å; Y93-C222 HydrophobicContact CE2-CB 3.97Å; Y93-T236 VanDerWaalsContact CE1-O 3.29Å; Y93-T236 WeakPolarHBondContact CE1-O 3.31Å; Y93-T236 PolarHBondContact OH-O 2.88Å; Y93-L239 HydrophobicContact CE1-CB 4.39Å; Y93-L239 WeakPolarHBondContact OH-CB 3.46Å; Y93-V240 HydrophobicContact CD1-CB 3.95Å; Y93-V240 HydrophobicContact CD1-CG2 4.16Å; Y93-V240 HydrophobicContact CE1-CB 4.17Å |
| 94 | E | 94.5 | Very high | 91.7 | Very high | 0 Ų | 0 | 9 Ų | 9 | 0% | 0 | 5% | 0.045 | C | C | . | . | H | α-helix | trans | -60.7 | -35.7 | 176.4 | -70.2 | -58.6 | 145.2 | 0 | 0 | 113.3 | M90 L91 G92 T98 R174 V177 T181 | M90-E94 WeakPolarHBondContact O-CG 3.19Å; M90-E94 PolarHBondContact O-N 3.02Å; M90-E94 VanDerWaalsContact O-N 3.1Å; L91-E94 PolarHBondContact O-N 2.99Å; G92-E94 PolarHBondContact O-N 2.91Å; E94-T98 PolarHBondContact O-OG1 2.89Å; E94-R174 IonicContact OE2-CZ 2.76Å; E94-R174 IonicContact OE2-NH2 2.65Å; E94-R174 PolarHBondContact OE2-NH2 3.19Å; E94-V177 HydrophobicContact CG-CG1 3.78Å; E94-T181 HydrophobicContact CG-CG2 4.08Å |
| 95 | M | 90.8 | Very high | 91.4 | Very high | 49 Ų | 49 | 9.1 Ų | 9.1 | 24% | 0.241 | 5% | 0.046 | C | C | . | . | H | α-helix | trans | -67.2 | -43.4 | 174.7 | -69.7 | -177.9 | -178 | 0 | 0 | 112.1 | L91 G92 Y93 V216 W530 | L91-M95 HydrophobicContact CD1-CE 3.92Å; L91-M95 HydrophobicContact CD2-CE 4.35Å; L91-M95 HydrophobicContact CG-CE 3.98Å; L91-M95 WeakPolarHBondContact O-CG 3.42Å; L91-M95 PolarHBondContact O-N 2.95Å; G92-M95 WeakPolarHBondContact O-CB 3.31Å; G92-M95 PolarHBondContact O-N 3.36Å; G92-M95 VanDerWaalsContact O-N 3.16Å; Y93-M95 VanDerWaalsContact C-N 3.3Å; Y93-M95 PolarHBondContact O-N 3.22Å; M95-V216 HydrophobicContact CB-CG2 4.22Å; M95-W530 HydrophobicContact CE-CH2 4.38Å |
| 96 | G | 91.1 | Very high | 91 | Very high | 0 Ų | 0 | 11 Ų | 11 | 0% | 0 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -73.8 | -38.4 | -177.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | G92 Y93 T98 F220 | G92-G96 PolarHBondContact O-N 3.45Å; Y93-G96 PolarHBondContact O-N 3.12Å; G96-T98 VanDerWaalsContact C-N 3.33Å; G96-T98 PolarHBondContact O-N 3.44Å; G96-F220 WeakPolarHBondContact O-CD1 3.29Å |
| 97 | L | 93.2 | Very high | 90.4 | Very high | 0 Ų | 0 | 13.9 Ų | 13.9 | 0% | 0 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -71.2 | -28.4 | -174.4 | 74.1 | 87.1 | 0 | 0 | 0 | 113.9 | Y93 S99 G100 V101 S223 T236 F237 | Y93-L97 HydrophobicContact CD1-CD2 3.42Å; Y93-L97 VanDerWaalsContact CD1-CD2 3.42Å; Y93-L97 HydrophobicContact CE1-CD2 3.29Å; Y93-L97 HydrophobicContact CG-CD2 4.33Å; Y93-L97 WeakPolarHBondContact O-CB 3.38Å; Y93-L97 WeakPolarHBondContact O-CD2 3.49Å; Y93-L97 WeakPolarHBondContact O-CG 3.03Å; Y93-L97 PolarHBondContact O-N 3.14Å; L97-S99 PolarHBondContact O-N 2.76Å; L97-S99 VanDerWaalsContact O-N 3.15Å; L97-G100 PolarHBondContact O-N 2.94Å; L97-V101 HydrophobicContact CD1-CG2 4.02Å; L97-V101 WeakPolarHBondContact O-CB 3.36Å; L97-V101 WeakPolarHBondContact O-CG2 3.08Å; L97-V101 PolarHBondContact O-N 3.42Å; L97-S223 WeakPolarHBondContact CA-OG 3.32Å; L97-T236 HydrophobicContact CB-CG2 3.87Å; L97-F237 HydrophobicContact CD1-CD1 3.66Å; L97-F237 HydrophobicContact CD1-CE1 3.4Å; L97-F237 VanDerWaalsContact CD1-CE1 3.4Å; L97-F237 HydrophobicContact CD1-CZ 4.27Å |
| 98 | T | 90.4 | Very high | 89.9 | Confident | 7 Ų | 7 | 18.4 Ų | 18.4 | 4% | 0.043 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -57.5 | -34.7 | -174.7 | -64.6 | 0 | 0 | 0 | 0 | 111.7 | E94 G96 L102 V120 R174 | E94-T98 PolarHBondContact O-OG1 2.89Å; G96-T98 VanDerWaalsContact C-N 3.33Å; G96-T98 PolarHBondContact O-N 3.44Å; T98-L102 VanDerWaalsContact O-CB 3.24Å; T98-L102 WeakPolarHBondContact O-CB 2.88Å; T98-L102 PolarHBondContact O-N 3.47Å; T98-L102 VanDerWaalsContact O-N 3.09Å; T98-V120 HydrophobicContact CG2-CB 4.34Å; T98-V120 HydrophobicContact CG2-CG1 4.13Å; T98-V120 HydrophobicContact CG2-CG2 3.83Å; T98-R174 PolarHBondContact OG1-NH1 2.94Å; T98-R174 PolarHBondContact OG1-NH2 3.17Å |
| 99 | S | 88.9 | Confident | 89.4 | Confident | 0 Ų | 0 | 20.9 Ų | 20.9 | 0% | 0 | 12% | 0.116 | C | C | . | . | H | α-helix | trans | -69 | -44.5 | -177.8 | -162.5 | 0 | 0 | 0 | 0 | 114.4 | L97 L337 S338 A340 S341 | L97-S99 PolarHBondContact O-N 2.76Å; L97-S99 VanDerWaalsContact O-N 3.15Å; S99-L337 WeakPolarHBondContact CB-O 3.36Å; S99-S338 WeakPolarHBondContact CA-O 3.37Å; S99-S338 WeakPolarHBondContact CB-O 3.37Å; S99-S338 PolarHBondContact OG-O 2.65Å; S99-A340 PolarHBondContact OG-N 3.02Å; S99-S341 PolarHBondContact OG-N 3.09Å |
| 100 | G | 86.8 | Confident | 88.8 | Confident | 1 Ų | 1 | 24.3 Ų | 24.3 | 1% | 0.01 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -77.5 | -38.6 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | L97 L102 L103 | L97-G100 PolarHBondContact O-N 2.94Å; G100-L102 VanDerWaalsContact C-N 3.29Å; G100-L102 PolarHBondContact O-N 3.2Å; G100-L103 PolarHBondContact O-N 2.96Å |
| 101 | V | 90.3 | Very high | 88.2 | Confident | 2 Ų | 2 | 24.7 Ų | 24.7 | 1% | 0.012 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -64.6 | -34.5 | 177.7 | 172.3 | 0 | 0 | 0 | 0 | 111.8 | L97 L103 Q104 L105 W233 T236 F237 | L97-V101 HydrophobicContact CD1-CG2 4.02Å; L97-V101 WeakPolarHBondContact O-CB 3.36Å; L97-V101 WeakPolarHBondContact O-CG2 3.08Å; L97-V101 PolarHBondContact O-N 3.42Å; V101-L103 VanDerWaalsContact C-N 3.3Å; V101-L103 PolarHBondContact O-N 3.12Å; V101-Q104 PolarHBondContact O-N 2.9Å; V101-L105 HydrophobicContact CG1-CD1 3.57Å; V101-L105 HydrophobicContact CG1-CG 3.87Å; V101-L105 PolarHBondContact O-N 2.86Å; V101-W233 HydrophobicContact CG1-CB 4.04Å; V101-T236 HydrophobicContact CG2-CG2 3.67Å; V101-F237 HydrophobicContact CG1-CD2 4.44Å; V101-F237 HydrophobicContact CG1-CE2 3.58Å; V101-F237 HydrophobicContact CG1-CZ 3.64Å |
| 102 | L | 88.6 | Confident | 87.8 | Confident | 4 Ų | 4 | 26.6 Ų | 26.6 | 2% | 0.021 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -59.6 | -39 | 177.6 | -177.2 | 64.9 | 0 | 0 | 0 | 112.6 | T98 G100 Q104 R106 Q116 L119 V120 Y339 P342 | T98-L102 VanDerWaalsContact O-CB 3.24Å; T98-L102 WeakPolarHBondContact O-CB 2.88Å; T98-L102 PolarHBondContact O-N 3.47Å; T98-L102 VanDerWaalsContact O-N 3.09Å; G100-L102 VanDerWaalsContact C-N 3.29Å; G100-L102 PolarHBondContact O-N 3.2Å; L102-Q104 VanDerWaalsContact C-N 3.33Å; L102-Q104 PolarHBondContact O-N 3.2Å; L102-R106 WeakPolarHBondContact O-CB 3.33Å; L102-R106 PolarHBondContact O-N 2.85Å; L102-Q116 HydrophobicContact CD1-CB 4.03Å; L102-Q116 HydrophobicContact CD1-CG 3.96Å; L102-L119 HydrophobicContact CD1-CD2 4.3Å; L102-V120 HydrophobicContact CD1-CG2 4.39Å; L102-V120 HydrophobicContact CD2-CG2 4.01Å; L102-Y339 HydrophobicContact CD2-CD1 3.55Å; L102-Y339 HydrophobicContact CD2-CE1 3.47Å; L102-Y339 VanDerWaalsContact CD2-CE1 3.47Å; L102-P342 HydrophobicContact CD2-CG 4.24Å |
| 103 | L | 84.3 | Confident | 87.4 | Confident | 14 Ų | 14 | 27.2 Ų | 27.2 | 7% | 0.073 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -61.8 | -42 | 176.4 | -73.1 | 179.5 | 0 | 0 | 0 | 111.6 | G100 V101 S341 P342 | G100-L103 PolarHBondContact O-N 2.96Å; V101-L103 VanDerWaalsContact C-N 3.3Å; V101-L103 PolarHBondContact O-N 3.12Å; L103-S341 VanDerWaalsContact CD1-CB 3.44Å; L103-P342 HydrophobicContact CD2-CB 4.29Å; L103-P342 HydrophobicContact CD2-CG 3.87Å; L103-P342 HydrophobicContact CG-CG 4.2Å |
| 104 | Q | 86.8 | Confident | 87 | Confident | 22 Ų | 22 | 35.7 Ų | 35.7 | 10% | 0.103 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -72 | -43.8 | 179.5 | -60.9 | 179.5 | 25.8 | 0 | 0 | 112.4 | V101 L102 R106 S107 V108 W233 | V101-Q104 PolarHBondContact O-N 2.9Å; L102-Q104 VanDerWaalsContact C-N 3.33Å; L102-Q104 PolarHBondContact O-N 3.2Å; Q104-R106 VanDerWaalsContact C-N 3.31Å; Q104-R106 PolarHBondContact O-N 3.29Å; Q104-S107 PolarHBondContact O-N 3.16Å; Q104-S107 PolarHBondContact O-OG 3.39Å; Q104-V108 WeakPolarHBondContact O-CG2 3.43Å; Q104-V108 PolarHBondContact O-N 3.38Å; Q104-W233 HydrophobicContact CB-CB 4.35Å |
| 105 | L | 86.1 | Confident | 86.9 | Confident | 3 Ų | 3 | 38.9 Ų | 38.9 | 2% | 0.016 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -69 | -32.3 | -179.1 | -73.5 | 177.7 | 0 | 0 | 0 | 112.4 | V101 S107 V108 L109 L111 L119 L170 W233 F237 | V101-L105 HydrophobicContact CG1-CD1 3.57Å; V101-L105 HydrophobicContact CG1-CG 3.87Å; V101-L105 PolarHBondContact O-N 2.86Å; L105-S107 VanDerWaalsContact C-N 3.33Å; L105-S107 PolarHBondContact O-N 2.78Å; L105-V108 PolarHBondContact O-N 3.07Å; L105-L109 HydrophobicContact CD2-CD1 4.39Å; L105-L109 WeakPolarHBondContact O-CB 3.43Å; L105-L109 PolarHBondContact O-N 3.41Å; L105-L111 HydrophobicContact CB-CD1 4.28Å; L105-L119 HydrophobicContact CD1-CD2 3.77Å; L105-L170 HydrophobicContact CD1-CD1 4.13Å; L105-L170 HydrophobicContact CD2-CD1 4.21Å; L105-W233 HydrophobicContact CD2-CD2 3.97Å; L105-W233 HydrophobicContact CD2-CE3 4.19Å; L105-W233 HydrophobicContact CD2-CG 4.11Å; L105-F237 HydrophobicContact CD1-CE2 4.37Å |
| 106 | R | 83.8 | Confident | 86.8 | Confident | 40 Ų | 40 | 36.7 Ų | 36.7 | 15% | 0.151 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -61.9 | -39.7 | 175.8 | 178.4 | -177.2 | 174.2 | -165.5 | -2.9 | 112.3 | L102 Q104 S110 L414 C415 K416 S417 | L102-R106 WeakPolarHBondContact O-CB 3.33Å; L102-R106 PolarHBondContact O-N 2.85Å; Q104-R106 VanDerWaalsContact C-N 3.31Å; Q104-R106 PolarHBondContact O-N 3.29Å; R106-S110 VanDerWaalsContact O-CA 3.27Å; R106-S110 WeakPolarHBondContact O-CA 3.19Å; R106-S110 PolarHBondContact O-N 3.19Å; R106-L414 VanDerWaalsContact CZ-O 3.27Å; R106-L414 PolarHBondContact NH1-O 3.46Å; R106-L414 PolarHBondContact NH2-O 3.2Å; R106-C415 PolarHBondContact NH2-O 3.4Å; R106-K416 PolarHBondContact NH2-O 3.02Å; R106-S417 VanDerWaalsContact NH2-N 3.14Å |
| 107 | S | 80.3 | Confident | 86.9 | Confident | 86 Ų | 86 | 37 Ų | 37 | 60% | 0.601 | 20% | 0.2 | S | C | * | . | H | α-helix | trans | -74.2 | -35.3 | 179 | 62.6 | 0 | 0 | 0 | 0 | 112.5 | Q104 L105 | Q104-S107 PolarHBondContact O-N 3.16Å; Q104-S107 PolarHBondContact O-OG 3.39Å; L105-S107 VanDerWaalsContact C-N 3.33Å; L105-S107 PolarHBondContact O-N 2.78Å |
| 108 | V | 83.9 | Confident | 86.9 | Confident | 94 Ų | 94 | 40.3 Ų | 40.3 | 57% | 0.57 | 22% | 0.218 | S | C | * | . | H | α-helix | trans | -75.5 | -42.9 | -179.4 | 175.4 | 0 | 0 | 0 | 0 | 112.8 | Q104 L105 | Q104-V108 WeakPolarHBondContact O-CG2 3.43Å; Q104-V108 PolarHBondContact O-N 3.38Å; L105-V108 PolarHBondContact O-N 3.07Å |
| 109 | L | 82.9 | Confident | 87 | Confident | 52 Ų | 52 | 40.2 Ų | 40.2 | 27% | 0.272 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -102.7 | 1.2 | -174 | -68 | 169.2 | 0 | 0 | 0 | 113.4 | L105 L111 L170 | L105-L109 HydrophobicContact CD2-CD1 4.39Å; L105-L109 WeakPolarHBondContact O-CB 3.43Å; L105-L109 PolarHBondContact O-N 3.41Å; L109-L111 HydrophobicContact CB-CD2 3.69Å; L109-L111 HydrophobicContact CB-CG 3.82Å; L109-L111 HydrophobicContact CD1-CD2 4.29Å; L109-L111 PolarHBondContact O-N 3.42Å; L109-L170 HydrophobicContact CD1-CD1 3.74Å |
| 110 | S | 82.6 | Confident | 87.1 | Confident | 104 Ų | 104 | 40.5 Ų | 40.5 | 73% | 0.727 | 22% | 0.219 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 48.7 | 43.7 | -176.6 | 53.5 | 0 | 0 | 0 | 0 | 113.4 | R106 S112 | R106-S110 VanDerWaalsContact O-CA 3.27Å; R106-S110 WeakPolarHBondContact O-CA 3.19Å; R106-S110 PolarHBondContact O-N 3.19Å; S110-S112 PolarHBondContact O-N 2.97Å |
| 111 | L | 83.2 | Confident | 87.5 | Confident | 9 Ų | 9 | 40.5 Ų | 40.5 | 5% | 0.047 | 22% | 0.218 | C | C | . | . | trans | -63.8 | 130.8 | -170.5 | -62.2 | 174 | 0 | 0 | 0 | 112.7 | L105 L109 E115 Q116 L119 L167 | L105-L111 HydrophobicContact CB-CD1 4.28Å; L109-L111 HydrophobicContact CB-CD2 3.69Å; L109-L111 HydrophobicContact CB-CG 3.82Å; L109-L111 HydrophobicContact CD1-CD2 4.29Å; L109-L111 PolarHBondContact O-N 3.42Å; L111-E115 HydrophobicContact CB-CB 4.35Å; L111-E115 HydrophobicContact CD2-CB 4.18Å; L111-Q116 HydrophobicContact CB-CG 3.8Å; L111-Q116 HydrophobicContact CD1-CG 4.37Å; L111-Q116 PolarHBondContact O-NE2 3.39Å; L111-L119 HydrophobicContact CD1-CD2 4.21Å; L111-L167 HydrophobicContact CD2-CD1 4.06Å | ||
| 112 | S | 86.4 | Confident | 87.7 | Confident | 56 Ų | 56 | 40.4 Ų | 40.4 | 39% | 0.392 | 22% | 0.218 | S | C | . | . | trans | -67.2 | 164.7 | 168.9 | 70.6 | 0 | 0 | 0 | 0 | 112 | S110 R114 E115 Q116 | S110-S112 PolarHBondContact O-N 2.97Å; S112-R114 VanDerWaalsContact C-N 3.32Å; S112-R114 PolarHBondContact O-N 3.45Å; S112-E115 VanDerWaalsContact CB-OE2 3.31Å; S112-E115 WeakPolarHBondContact CB-OE2 3.42Å; S112-E115 PolarHBondContact N-OE2 2.91Å; S112-E115 PolarHBondContact O-N 3.23Å; S112-E115 VanDerWaalsContact O-N 3.14Å; S112-E115 WeakPolarHBondContact OG-CG 3.45Å; S112-E115 PolarHBondContact OG-N 3.04Å; S112-E115 PolarHBondContact OG-OE2 3.25Å; S112-Q116 WeakPolarHBondContact O-CG 3.46Å; S112-Q116 PolarHBondContact O-N 2.92Å | ||
| 113 | C | 84.9 | Confident | 88 | Confident | 12 Ų | 12 | 41 Ų | 41 | 8% | 0.081 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -58.3 | -43.4 | -177.6 | -149.1 | 0 | 0 | 0 | 0 | 112.6 | E115 Q116 E117 C415 L541 E545 | C113-E115 VanDerWaalsContact C-N 3.34Å; C113-E115 PolarHBondContact O-N 3.37Å; C113-Q116 PolarHBondContact O-N 3.44Å; C113-E117 WeakPolarHBondContact O-CG 3.34Å; C113-E117 PolarHBondContact O-N 2.71Å; C113-C415 WeakPolarHBondContact CA-SG 3.09Å; C113-C415 HydrophobicContact CB-CB 3.62Å; C113-C415 WeakPolarHBondContact CB-SG 2.96Å; C113-C415 WeakPolarHBondContact SG-CB 3.44Å; C113-C415 CovalentContact SG-SG 2.05Å; C113-C415 PolarHBondContact SG-SG 3.4Å; C113-L541 WeakPolarHBondContact SG-CB 3.4Å; C113-E545 PolarHBondContact SG-OE1 2.96Å; C113-E545 VanDerWaalsContact SG-OE1 3.34Å |
| 114 | R | 88.1 | Confident | 88.5 | Confident | 195 Ų | 195 | 41 Ų | 41 | 74% | 0.736 | 22% | 0.221 | S | C | * | . | H | α-helix | trans | -66.7 | -35.2 | 177.6 | -66.9 | -175.9 | -179.8 | 174.8 | 1.8 | 112.6 | S112 E117 L118 | S112-R114 VanDerWaalsContact C-N 3.32Å; S112-R114 PolarHBondContact O-N 3.45Å; R114-E117 PolarHBondContact O-N 3.39Å; R114-L118 WeakPolarHBondContact O-CB 2.94Å; R114-L118 PolarHBondContact O-N 3.4Å |
| 115 | E | 90.6 | Very high | 89 | Confident | 66 Ų | 66 | 43 Ų | 43 | 31% | 0.308 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -71.4 | -35.6 | 177.9 | -66.9 | 168.3 | 138.7 | 0 | 0 | 111.5 | L111 S112 C113 L118 L119 L167 | L111-E115 HydrophobicContact CB-CB 4.35Å; L111-E115 HydrophobicContact CD2-CB 4.18Å; S112-E115 VanDerWaalsContact CB-OE2 3.31Å; S112-E115 WeakPolarHBondContact CB-OE2 3.42Å; S112-E115 PolarHBondContact N-OE2 2.91Å; S112-E115 PolarHBondContact O-N 3.23Å; S112-E115 VanDerWaalsContact O-N 3.14Å; S112-E115 WeakPolarHBondContact OG-CG 3.45Å; S112-E115 PolarHBondContact OG-N 3.04Å; S112-E115 PolarHBondContact OG-OE2 3.25Å; C113-E115 VanDerWaalsContact C-N 3.34Å; C113-E115 PolarHBondContact O-N 3.37Å; E115-L118 PolarHBondContact O-N 3.36Å; E115-L119 VanDerWaalsContact O-CB 3.31Å; E115-L119 WeakPolarHBondContact O-CB 3.21Å; E115-L119 PolarHBondContact O-N 2.96Å; E115-L167 HydrophobicContact CB-CD1 4.32Å; E115-L167 HydrophobicContact CB-CD2 3.96Å; E115-L167 HydrophobicContact CG-CD2 3.59Å; E115-L167 WeakPolarHBondContact OE1-CD2 3.47Å |
| 116 | Q | 90.2 | Very high | 89.4 | Confident | 3 Ų | 3 | 42.8 Ų | 42.8 | 1% | 0.014 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -64.5 | -44.1 | 171.8 | -67.1 | 177.8 | 44.3 | 0 | 0 | 111.5 | L102 L111 S112 C113 L119 V120 L541 | L102-Q116 HydrophobicContact CD1-CB 4.03Å; L102-Q116 HydrophobicContact CD1-CG 3.96Å; L111-Q116 HydrophobicContact CB-CG 3.8Å; L111-Q116 HydrophobicContact CD1-CG 4.37Å; L111-Q116 PolarHBondContact O-NE2 3.39Å; S112-Q116 WeakPolarHBondContact O-CG 3.46Å; S112-Q116 PolarHBondContact O-N 2.92Å; C113-Q116 PolarHBondContact O-N 3.44Å; Q116-L119 PolarHBondContact O-N 3.27Å; Q116-V120 WeakPolarHBondContact O-CG2 3.19Å; Q116-V120 PolarHBondContact O-N 3.45Å; Q116-L541 HydrophobicContact CB-CD1 3.69Å |
| 117 | E | 91.8 | Very high | 89.9 | Confident | 7 Ų | 7 | 41 Ų | 41 | 3% | 0.033 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -59.8 | -46.2 | 173.8 | -71.7 | 179.4 | 138.6 | 0 | 0 | 111.8 | C113 R114 L119 V120 S121 F540 L541 T542 | C113-E117 WeakPolarHBondContact O-CG 3.34Å; C113-E117 PolarHBondContact O-N 2.71Å; R114-E117 PolarHBondContact O-N 3.39Å; E117-L119 PolarHBondContact O-N 3.37Å; E117-V120 PolarHBondContact O-N 3.08Å; E117-S121 WeakPolarHBondContact O-CB 3.48Å; E117-S121 PolarHBondContact O-N 2.74Å; E117-S121 PolarHBondContact O-OG 3.4Å; E117-F540 PolarHBondContact OE1-N 3.15Å; E117-L541 HydrophobicContact CG-CB 3.73Å; E117-L541 HydrophobicContact CG-CD1 3.87Å; E117-L541 HydrophobicContact CG-CG 3.94Å; E117-L541 WeakPolarHBondContact OE1-CA 3.43Å; E117-L541 PolarHBondContact OE1-N 3.13Å; E117-T542 PolarHBondContact OE1-N 3.36Å; E117-T542 PolarHBondContact OE1-OG1 3.14Å; E117-T542 PolarHBondContact OE2-OG1 3.48Å |
| 118 | L | 93.5 | Very high | 90.5 | Very high | 69 Ų | 69 | 38.3 Ų | 38.3 | 36% | 0.361 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -60.4 | -46.5 | 177.4 | -179.5 | 62.3 | 0 | 0 | 0 | 111 | R114 E115 S121 S122 T171 M538 | R114-L118 WeakPolarHBondContact O-CB 2.94Å; R114-L118 PolarHBondContact O-N 3.4Å; E115-L118 PolarHBondContact O-N 3.36Å; L118-S121 PolarHBondContact O-N 3.05Å; L118-S122 WeakPolarHBondContact O-CB 3.28Å; L118-S122 PolarHBondContact O-N 3.13Å; L118-S122 PolarHBondContact O-OG 2.56Å; L118-T171 HydrophobicContact CD1-CG2 4.45Å; L118-T171 HydrophobicContact CG-CG2 4.25Å; L118-M538 HydrophobicContact CD1-CE 3.95Å |
| 119 | L | 92.6 | Very high | 91 | Very high | 5 Ų | 5 | 38 Ų | 38 | 3% | 0.026 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -60.9 | -48.4 | -179.1 | -177.8 | 65.7 | 0 | 0 | 0 | 111.5 | L102 L105 L111 E115 Q116 E117 S122 L170 R174 | L102-L119 HydrophobicContact CD1-CD2 4.3Å; L105-L119 HydrophobicContact CD1-CD2 3.77Å; L111-L119 HydrophobicContact CD1-CD2 4.21Å; E115-L119 VanDerWaalsContact O-CB 3.31Å; E115-L119 WeakPolarHBondContact O-CB 3.21Å; E115-L119 PolarHBondContact O-N 2.96Å; Q116-L119 PolarHBondContact O-N 3.27Å; E117-L119 PolarHBondContact O-N 3.37Å; L119-S122 PolarHBondContact O-OG 3.11Å; L119-L170 HydrophobicContact CD1-CB 3.8Å; L119-R174 HydrophobicContact CD1-CG 4.29Å; L119-R174 WeakPolarHBondContact O-CD 3.44Å |
| 120 | V | 92.1 | Very high | 91.4 | Very high | 7 Ų | 7 | 36.2 Ų | 36.2 | 4% | 0.042 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -65.5 | -43.2 | 178.8 | 173.2 | 0 | 0 | 0 | 0 | 111.2 | T98 L102 Q116 E117 Y339 | T98-V120 HydrophobicContact CG2-CB 4.34Å; T98-V120 HydrophobicContact CG2-CG1 4.13Å; T98-V120 HydrophobicContact CG2-CG2 3.83Å; L102-V120 HydrophobicContact CD1-CG2 4.39Å; L102-V120 HydrophobicContact CD2-CG2 4.01Å; Q116-V120 WeakPolarHBondContact O-CG2 3.19Å; Q116-V120 PolarHBondContact O-N 3.45Å; E117-V120 PolarHBondContact O-N 3.08Å; V120-Y339 HydrophobicContact CG1-CE2 4.17Å; V120-Y339 HydrophobicContact CG2-CE1 3.93Å |
| 121 | S | 94.3 | Very high | 91.6 | Very high | 0 Ų | 0 | 31.8 Ų | 31.8 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -78.1 | -23.1 | -173.3 | -59.9 | 0 | 0 | 0 | 0 | 114 | E117 L118 Q123 L124 L125 L534 S537 M538 | E117-S121 WeakPolarHBondContact O-CB 3.48Å; E117-S121 PolarHBondContact O-N 2.74Å; E117-S121 PolarHBondContact O-OG 3.4Å; L118-S121 PolarHBondContact O-N 3.05Å; S121-Q123 PolarHBondContact O-N 2.98Å; S121-L124 WeakPolarHBondContact O-CA 3.3Å; S121-L124 WeakPolarHBondContact O-CB 3.5Å; S121-L124 PolarHBondContact O-N 3.38Å; S121-L125 PolarHBondContact O-N 3.05Å; S121-L534 VanDerWaalsContact O-CD1 3.27Å; S121-L534 WeakPolarHBondContact O-CD1 3.41Å; S121-S537 VanDerWaalsContact OG-C 3.22Å; S121-S537 WeakPolarHBondContact OG-CB 3.46Å; S121-M538 WeakPolarHBondContact OG-CA 3.48Å; S121-M538 VanDerWaalsContact OG-CG 3.25Å; S121-M538 WeakPolarHBondContact OG-CG 3.48Å; S121-M538 PolarHBondContact OG-N 3.33Å; S121-M538 VanDerWaalsContact OG-N 3.12Å |
| 122 | S | 95.2 | Very high | 91.9 | Very high | 1 Ų | 1 | 37 Ų | 37 | 1% | 0.007 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -56.8 | -34.3 | -179.9 | 64.8 | 0 | 0 | 0 | 0 | 113.5 | L118 L119 L124 L125 G126 R174 V175 | L118-S122 WeakPolarHBondContact O-CB 3.28Å; L118-S122 PolarHBondContact O-N 3.13Å; L118-S122 PolarHBondContact O-OG 2.56Å; L119-S122 PolarHBondContact O-OG 3.11Å; S122-L124 VanDerWaalsContact C-N 3.35Å; S122-L124 PolarHBondContact O-N 3.25Å; S122-L125 WeakPolarHBondContact O-CB 3.32Å; S122-L125 PolarHBondContact O-N 3.11Å; S122-G126 PolarHBondContact O-N 3.11Å; S122-G126 VanDerWaalsContact O-N 3.15Å; S122-R174 WeakPolarHBondContact OG-CB 3.31Å; S122-V175 VanDerWaalsContact O-CG2 3.31Å; S122-V175 WeakPolarHBondContact O-CG2 3.25Å |
| 123 | Q | 95.1 | Very high | 91.9 | Very high | 15 Ų | 15 | 36.6 Ų | 36.6 | 7% | 0.07 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -63.7 | -40.7 | 173.1 | -179.4 | 170.4 | -67.7 | 0 | 0 | 112.3 | S121 L125 G126 A127 R174 G178 | S121-Q123 PolarHBondContact O-N 2.98Å; Q123-L125 VanDerWaalsContact C-N 3.3Å; Q123-G126 PolarHBondContact O-N 3.09Å; Q123-A127 PolarHBondContact O-N 3.28Å; Q123-R174 WeakPolarHBondContact CA-O 3.34Å; Q123-G178 WeakPolarHBondContact O-CA 3.3Å |
| 124 | L | 94.7 | Very high | 91.6 | Very high | 16 Ų | 16 | 36.3 Ų | 36.3 | 8% | 0.084 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -68.9 | -32.9 | 178.5 | -54.6 | 177.1 | 0 | 0 | 0 | 111.4 | S121 S122 A127 L128 W530 N533 L534 S537 | S121-L124 WeakPolarHBondContact O-CA 3.3Å; S121-L124 WeakPolarHBondContact O-CB 3.5Å; S121-L124 PolarHBondContact O-N 3.38Å; S122-L124 VanDerWaalsContact C-N 3.35Å; S122-L124 PolarHBondContact O-N 3.25Å; L124-A127 PolarHBondContact O-N 3.46Å; L124-L128 WeakPolarHBondContact O-CB 3.48Å; L124-L128 PolarHBondContact O-N 2.87Å; L124-W530 HydrophobicContact CD2-CE3 4.04Å; L124-W530 HydrophobicContact CD2-CZ3 3.81Å; L124-N533 HydrophobicContact CD1-CB 4.28Å; L124-N533 WeakPolarHBondContact CD1-OD1 3.31Å; L124-N533 WeakPolarHBondContact CD2-ND2 3.2Å; L124-L534 HydrophobicContact CB-CB 4.15Å; L124-L534 HydrophobicContact CB-CD1 4.04Å; L124-S537 WeakPolarHBondContact CD1-OG 3.37Å |
| 125 | L | 95.8 | Very high | 91.3 | Very high | 62 Ų | 62 | 28.3 Ų | 28.3 | 33% | 0.325 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -61.7 | -47 | 172.9 | 179.2 | 63.6 | 0 | 0 | 0 | 110.8 | S121 S122 Q123 A127 L128 L129 V175 L534 | S121-L125 PolarHBondContact O-N 3.05Å; S122-L125 WeakPolarHBondContact O-CB 3.32Å; S122-L125 PolarHBondContact O-N 3.11Å; Q123-L125 VanDerWaalsContact C-N 3.3Å; L125-A127 VanDerWaalsContact C-N 3.31Å; L125-A127 PolarHBondContact O-N 3.18Å; L125-L128 PolarHBondContact O-N 3.35Å; L125-L129 WeakPolarHBondContact O-CG 3.14Å; L125-L129 PolarHBondContact O-N 2.97Å; L125-V175 HydrophobicContact CD2-CG2 4.42Å; L125-L534 HydrophobicContact CB-CD1 4.09Å; L125-L534 HydrophobicContact CB-CD2 4.39Å; L125-L534 HydrophobicContact CD1-CD2 3.98Å |
| 126 | G | 95.4 | Very high | 90.9 | Very high | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -58.4 | -43.2 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | S122 Q123 L128 L129 V130 V175 M179 | S122-G126 PolarHBondContact O-N 3.11Å; S122-G126 VanDerWaalsContact O-N 3.15Å; Q123-G126 PolarHBondContact O-N 3.09Å; G126-L128 PolarHBondContact O-N 2.98Å; G126-L129 PolarHBondContact O-N 3.28Å; G126-V130 PolarHBondContact O-N 2.99Å; G126-V130 VanDerWaalsContact O-N 3.13Å; G126-V175 WeakPolarHBondContact CA-O 3.37Å; G126-M179 VanDerWaalsContact O-CG 3.29Å; G126-M179 WeakPolarHBondContact O-CG 3.37Å |
| 127 | A | 93.4 | Very high | 90.7 | Very high | 3 Ų | 3 | 31.4 Ų | 31.4 | 3% | 0.025 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -61.6 | -42.2 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q123 L124 L125 V130 C131 S182 W530 | Q123-A127 PolarHBondContact O-N 3.28Å; L124-A127 PolarHBondContact O-N 3.46Å; L125-A127 VanDerWaalsContact C-N 3.31Å; L125-A127 PolarHBondContact O-N 3.18Å; A127-V130 PolarHBondContact O-N 3.44Å; A127-C131 PolarHBondContact O-N 3.43Å; A127-C131 PolarHBondContact O-SG 3.06Å; A127-C131 VanDerWaalsContact O-SG 3.38Å; A127-S182 PolarHBondContact O-OG 3.39Å; A127-W530 HydrophobicContact CB-CD2 3.81Å; A127-W530 HydrophobicContact CB-CE3 3.72Å; A127-W530 HydrophobicContact CB-CG 4.34Å; A127-W530 HydrophobicContact CB-CH2 4.35Å; A127-W530 HydrophobicContact CB-CZ2 4.41Å; A127-W530 HydrophobicContact CB-CZ3 4.01Å |
| 128 | L | 93.8 | Very high | 90.5 | Very high | 28 Ų | 28 | 31.4 Ų | 31.4 | 15% | 0.147 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -63.1 | -47.7 | 177 | 177.3 | 61 | 0 | 0 | 0 | 112 | L124 L125 G126 V130 C131 L132 A527 W530 A531 L534 | L124-L128 WeakPolarHBondContact O-CB 3.48Å; L124-L128 PolarHBondContact O-N 2.87Å; L125-L128 PolarHBondContact O-N 3.35Å; G126-L128 PolarHBondContact O-N 2.98Å; L128-V130 VanDerWaalsContact C-N 3.29Å; L128-V130 PolarHBondContact O-N 3.28Å; L128-C131 PolarHBondContact O-N 3.31Å; L128-C131 VanDerWaalsContact O-N 3.16Å; L128-L132 HydrophobicContact CD1-CD1 4.47Å; L128-L132 HydrophobicContact CD1-CG 4.49Å; L128-L132 WeakPolarHBondContact O-CG 3.38Å; L128-L132 PolarHBondContact O-N 3.4Å; L128-L132 VanDerWaalsContact O-N 3.14Å; L128-A527 WeakPolarHBondContact CD1-O 3.31Å; L128-W530 HydrophobicContact CB-CB 4.16Å; L128-W530 HydrophobicContact CD1-CB 4.23Å; L128-A531 HydrophobicContact CD1-CB 4.03Å; L128-A531 HydrophobicContact CD2-CB 4.16Å; L128-L534 HydrophobicContact CD2-CD2 4.04Å |
| 129 | L | 93.7 | Very high | 90.1 | Very high | 88 Ų | 88 | 33 Ų | 33 | 46% | 0.461 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -57.8 | -44.3 | 179.1 | -69.6 | 174.8 | 0 | 0 | 0 | 111.4 | L125 G126 L132 A133 | L125-L129 WeakPolarHBondContact O-CG 3.14Å; L125-L129 PolarHBondContact O-N 2.97Å; G126-L129 PolarHBondContact O-N 3.28Å; L129-L132 PolarHBondContact O-N 3.43Å; L129-A133 PolarHBondContact O-N 3.13Å |
| 130 | V | 92.3 | Very high | 89.7 | Confident | 14 Ų | 14 | 41.6 Ų | 41.6 | 9% | 0.085 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -69.5 | -36 | 176.7 | 156 | 0 | 0 | 0 | 0 | 112.6 | G126 A127 L128 L132 A133 G134 M179 L183 | G126-V130 PolarHBondContact O-N 2.99Å; G126-V130 VanDerWaalsContact O-N 3.13Å; A127-V130 PolarHBondContact O-N 3.44Å; L128-V130 VanDerWaalsContact C-N 3.29Å; L128-V130 PolarHBondContact O-N 3.28Å; V130-L132 VanDerWaalsContact C-N 3.27Å; V130-L132 PolarHBondContact O-N 3.1Å; V130-A133 CarbonylContact O-C 3.57Å; V130-A133 PolarHBondContact O-N 2.94Å; V130-G134 WeakPolarHBondContact O-CA 3.26Å; V130-G134 PolarHBondContact O-N 3.13Å; V130-M179 HydrophobicContact CG2-CB 3.48Å; V130-M179 VanDerWaalsContact CG2-CB 3.48Å; V130-M179 HydrophobicContact CG2-CG 3.65Å; V130-M179 HydrophobicContact CG2-SD 4.34Å; V130-L183 HydrophobicContact CG1-CB 3.67Å; V130-L183 HydrophobicContact CG1-CD1 4.28Å |
| 131 | C | 87.6 | Confident | 89.5 | Confident | 12 Ų | 12 | 47.6 Ų | 47.6 | 8% | 0.081 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -63.3 | -35.2 | 176.3 | -78.4 | 0 | 0 | 0 | 0 | 112.5 | A127 L128 S182 W530 | A127-C131 PolarHBondContact O-N 3.43Å; A127-C131 PolarHBondContact O-SG 3.06Å; A127-C131 VanDerWaalsContact O-SG 3.38Å; L128-C131 PolarHBondContact O-N 3.31Å; L128-C131 VanDerWaalsContact O-N 3.16Å; C131-S182 PolarHBondContact SG-OG 3.32Å; C131-S182 VanDerWaalsContact SG-OG 3.33Å; C131-W530 PolarHBondContact SG-NE1 2.76Å |
| 132 | L | 87.6 | Confident | 89.3 | Confident | 119 Ų | 119 | 47.7 Ų | 47.7 | 62% | 0.623 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -70.4 | -37.4 | 175.9 | -63.8 | 174.3 | 0 | 0 | 0 | 112.3 | L128 L129 V130 A527 | L128-L132 HydrophobicContact CD1-CD1 4.47Å; L128-L132 HydrophobicContact CD1-CG 4.49Å; L128-L132 WeakPolarHBondContact O-CG 3.38Å; L128-L132 PolarHBondContact O-N 3.4Å; L128-L132 VanDerWaalsContact O-N 3.14Å; L129-L132 PolarHBondContact O-N 3.43Å; V130-L132 VanDerWaalsContact C-N 3.27Å; V130-L132 PolarHBondContact O-N 3.1Å; L132-A527 HydrophobicContact CD2-CB 3.95Å |
| 133 | A | 87.4 | Confident | 89.1 | Confident | 47 Ų | 47 | 48.5 Ų | 48.5 | 39% | 0.388 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -93.3 | -13.7 | -179 | 0 | 0 | 0 | 0 | 0 | 114.6 | L129 V130 G135 P136 I137 | L129-A133 PolarHBondContact O-N 3.13Å; V130-A133 CarbonylContact O-C 3.57Å; V130-A133 PolarHBondContact O-N 2.94Å; A133-G135 PolarHBondContact O-N 3.34Å; A133-P136 WeakPolarHBondContact O-CD 3.32Å; A133-I137 HydrophobicContact CB-CD1 4.18Å; A133-I137 WeakPolarHBondContact O-CD1 3.43Å; A133-I137 WeakPolarHBondContact O-CG1 3.4Å; A133-I137 PolarHBondContact O-N 3.4Å |
| 134 | G | 78.8 | Confident | 88.9 | Confident | 5 Ų | 5 | 50.9 Ų | 50.9 | 5% | 0.052 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -73.5 | -32.6 | -161.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | V130 I137 L138 | V130-G134 WeakPolarHBondContact O-CA 3.26Å; V130-G134 PolarHBondContact O-N 3.13Å; G134-I137 PolarHBondContact O-N 2.93Å; G134-L138 WeakPolarHBondContact O-CB 3.1Å; G134-L138 WeakPolarHBondContact O-CD1 3.24Å; G134-L138 WeakPolarHBondContact O-CG 3.47Å; G134-L138 PolarHBondContact O-N 3.43Å |
| 135 | G | 81.7 | Confident | 88.8 | Confident | 28 Ų | 28 | 53.2 Ų | 53.2 | 29% | 0.289 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -56.4 | -60.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | A133 I137 L138 D139 | A133-G135 PolarHBondContact O-N 3.34Å; G135-I137 PolarHBondContact O-N 3.02Å; G135-L138 PolarHBondContact O-N 3.49Å; G135-L138 VanDerWaalsContact O-N 3.09Å; G135-D139 PolarHBondContact O-N 3.42Å |
| 136 | P | 82.2 | Confident | 88.6 | Confident | 91 Ų | 91 | 50.3 Ų | 50.3 | 59% | 0.591 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -54 | -37.8 | 175.3 | -28.1 | 34 | 0 | 0 | 0 | 114.1 | A133 R140 | A133-P136 WeakPolarHBondContact O-CD 3.32Å; P136-R140 WeakPolarHBondContact O-CB 3.27Å; P136-R140 PolarHBondContact O-N 2.91Å |
| 137 | I | 86.8 | Confident | 88.5 | Confident | 43 Ų | 43 | 50.3 Ų | 50.3 | 22% | 0.221 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -64.5 | -47 | 177.7 | -66.3 | 168.1 | 0 | 0 | 0 | 110.6 | A133 G134 G135 D139 Y141 L183 | A133-I137 HydrophobicContact CB-CD1 4.18Å; A133-I137 WeakPolarHBondContact O-CD1 3.43Å; A133-I137 WeakPolarHBondContact O-CG1 3.4Å; A133-I137 PolarHBondContact O-N 3.4Å; G134-I137 PolarHBondContact O-N 2.93Å; G135-I137 PolarHBondContact O-N 3.02Å; I137-D139 VanDerWaalsContact C-N 3.34Å; I137-Y141 HydrophobicContact CG2-CD2 4.15Å; I137-Y141 WeakPolarHBondContact O-CB 3.46Å; I137-Y141 WeakPolarHBondContact O-CD2 3.39Å; I137-Y141 PolarHBondContact O-N 3.05Å; I137-L183 HydrophobicContact CG2-CD1 4.4Å |
| 138 | L | 86.3 | Confident | 88.6 | Confident | 7 Ų | 7 | 51.8 Ų | 51.8 | 4% | 0.037 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -67.6 | -33.7 | -179.4 | -73.9 | 163.2 | 0 | 0 | 0 | 112.9 | G134 G135 G142 R143 S146 L183 T186 A187 L190 | G134-L138 WeakPolarHBondContact O-CB 3.1Å; G134-L138 WeakPolarHBondContact O-CD1 3.24Å; G134-L138 WeakPolarHBondContact O-CG 3.47Å; G134-L138 PolarHBondContact O-N 3.43Å; G135-L138 PolarHBondContact O-N 3.49Å; G135-L138 VanDerWaalsContact O-N 3.09Å; L138-G142 VanDerWaalsContact O-CA 3.23Å; L138-G142 WeakPolarHBondContact O-CA 3.46Å; L138-G142 PolarHBondContact O-N 3.22Å; L138-G142 VanDerWaalsContact O-N 3.17Å; L138-R143 PolarHBondContact O-NH1 2.82Å; L138-S146 WeakPolarHBondContact CD2-OG 3.45Å; L138-L183 HydrophobicContact CG-CD1 4.45Å; L138-T186 HydrophobicContact CD1-CG2 3.7Å; L138-A187 HydrophobicContact CD2-CB 3.65Å; L138-L190 HydrophobicContact CD1-CD1 4.15Å |
| 139 | D | 84.6 | Confident | 88.6 | Confident | 102 Ų | 102 | 54.5 Ų | 54.5 | 55% | 0.545 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -78.5 | -36.8 | 178.7 | -70.2 | -22 | 0 | 0 | 0 | 112 | G135 I137 R143 F260 | G135-D139 PolarHBondContact O-N 3.42Å; I137-D139 VanDerWaalsContact C-N 3.34Å; D139-R143 IonicContact OD1-NH1 3.87Å; D139-F260 WeakPolarHBondContact O-CE2 3.3Å |
| 140 | R | 85.8 | Confident | 88.6 | Confident | 186 Ų | 186 | 50.3 Ų | 50.3 | 70% | 0.702 | 26% | 0.264 | S | S | * | . | H | α-helix | trans | -80.4 | -47.2 | -179.2 | -170.5 | 172.6 | -175.2 | 162.3 | 0.6 | 113.2 | P136 | P136-R140 WeakPolarHBondContact O-CB 3.27Å; P136-R140 PolarHBondContact O-N 2.91Å |
| 141 | Y | 87.2 | Confident | 88.8 | Confident | 133 Ų | 133 | 49.7 Ų | 49.7 | 52% | 0.522 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -95.5 | -17.4 | -173.9 | -63.6 | -77.1 | 0 | 0 | 0 | 113.2 | I137 C145 | I137-Y141 HydrophobicContact CG2-CD2 4.15Å; I137-Y141 WeakPolarHBondContact O-CB 3.46Å; I137-Y141 WeakPolarHBondContact O-CD2 3.39Å; I137-Y141 PolarHBondContact O-N 3.05Å; Y141-C145 VanDerWaalsContact O-CB 3.29Å; Y141-C145 WeakPolarHBondContact O-CB 3.46Å; Y141-C145 PolarHBondContact O-SG 3.43Å; Y141-C145 VanDerWaalsContact O-SG 3.4Å |
| 142 | G | 89.6 | Confident | 89.1 | Confident | 2 Ų | 2 | 51.5 Ų | 51.5 | 2% | 0.021 | 28% | 0.276 | C | S | . | . | trans | 79.2 | 162.6 | -177.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | L138 R144 C145 S146 | L138-G142 VanDerWaalsContact O-CA 3.23Å; L138-G142 WeakPolarHBondContact O-CA 3.46Å; L138-G142 PolarHBondContact O-N 3.22Å; L138-G142 VanDerWaalsContact O-N 3.17Å; G142-R144 PolarHBondContact O-N 2.98Å; G142-C145 PolarHBondContact O-N 3.23Å; G142-S146 PolarHBondContact O-N 3.24Å; G142-S146 PolarHBondContact O-OG 2.86Å; G142-S146 VanDerWaalsContact O-OG 3.06Å | ||
| 143 | R | 90.6 | Very high | 89.6 | Confident | 17 Ų | 17 | 48.2 Ų | 48.2 | 6% | 0.064 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -65.4 | -41.4 | -165.9 | -64.8 | 61.9 | 164.8 | 146 | -1.9 | 112.4 | L138 D139 S146 L147 L190 Y191 E194 | L138-R143 PolarHBondContact O-NH1 2.82Å; D139-R143 IonicContact OD1-NH1 3.87Å; R143-S146 PolarHBondContact O-N 3.46Å; R143-L147 WeakPolarHBondContact O-CG 3.43Å; R143-L147 PolarHBondContact O-N 3.28Å; R143-L190 HydrophobicContact CG-CB 4.24Å; R143-Y191 HydrophobicContact CB-CD2 4.03Å; R143-E194 WeakPolarHBondContact CD-OE2 3.12Å; R143-E194 IonicContact CZ-OE1 2.84Å; R143-E194 VanDerWaalsContact CZ-OE1 3.23Å; R143-E194 IonicContact CZ-OE2 2.71Å; R143-E194 VanDerWaalsContact NE-CD 3.29Å; R143-E194 IonicContact NE-OE1 3.89Å; R143-E194 PolarHBondContact NE-OE1 2.93Å; R143-E194 IonicContact NE-OE2 3.9Å; R143-E194 PolarHBondContact NE-OE2 2.96Å; R143-E194 IonicContact NH2-OE1 3.69Å; R143-E194 PolarHBondContact NH2-OE1 3.35Å; R143-E194 IonicContact NH2-OE2 2.92Å |
| 144 | R | 91.4 | Very high | 90 | Very high | 65 Ų | 65 | 46 Ų | 46 | 25% | 0.245 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -61.4 | -47.5 | 178.3 | 177.1 | -177.8 | 164.6 | -172.2 | -11.6 | 111.8 | G142 L147 L148 L251 L252 L254 | G142-R144 PolarHBondContact O-N 2.98Å; R144-L147 PolarHBondContact O-N 3.45Å; R144-L148 HydrophobicContact CG-CD1 4.45Å; R144-L148 WeakPolarHBondContact O-CG 3.4Å; R144-L148 PolarHBondContact O-N 3.36Å; R144-L251 VanDerWaalsContact CZ-O 3.31Å; R144-L251 PolarHBondContact NE-O 3.39Å; R144-L251 PolarHBondContact NH2-O 2.95Å; R144-L252 PolarHBondContact NH2-O 2.94Å; R144-L254 WeakPolarHBondContact CD-O 3.46Å; R144-L254 VanDerWaalsContact CZ-O 3.29Å; R144-L254 PolarHBondContact NE-O 2.73Å; R144-L254 PolarHBondContact NH1-O 3.4Å |
| 145 | C | 92 | Very high | 90.9 | Very high | 65 Ų | 65 | 46.8 Ų | 46.8 | 44% | 0.439 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -67.3 | -39 | 179.8 | -62.9 | 0 | 0 | 0 | 0 | 111.3 | Y141 G142 L147 L148 L149 | Y141-C145 VanDerWaalsContact O-CB 3.29Å; Y141-C145 WeakPolarHBondContact O-CB 3.46Å; Y141-C145 PolarHBondContact O-SG 3.43Å; Y141-C145 VanDerWaalsContact O-SG 3.4Å; G142-C145 PolarHBondContact O-N 3.23Å; C145-L147 VanDerWaalsContact C-N 3.33Å; C145-L147 PolarHBondContact O-N 3.27Å; C145-L148 PolarHBondContact O-N 3.12Å; C145-L149 WeakPolarHBondContact O-CB 3.43Å; C145-L149 PolarHBondContact O-N 3.01Å |
| 146 | S | 93.2 | Very high | 91.6 | Very high | 1 Ų | 1 | 47 Ų | 47 | 1% | 0.007 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -62 | -39.5 | 174 | -57.2 | 0 | 0 | 0 | 0 | 112.4 | L138 G142 R143 L149 S150 | L138-S146 WeakPolarHBondContact CD2-OG 3.45Å; G142-S146 PolarHBondContact O-N 3.24Å; G142-S146 PolarHBondContact O-OG 2.86Å; G142-S146 VanDerWaalsContact O-OG 3.06Å; R143-S146 PolarHBondContact O-N 3.46Å; S146-L149 PolarHBondContact O-N 3.45Å; S146-S150 VanDerWaalsContact O-CB 3.24Å; S146-S150 WeakPolarHBondContact O-CB 3.46Å; S146-S150 PolarHBondContact O-N 2.87Å; S146-S150 PolarHBondContact O-OG 2.94Å |
| 147 | L | 92.9 | Very high | 92.3 | Very high | 0 Ų | 0 | 42.8 Ų | 42.8 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -65.3 | -40.1 | 174.2 | -74.2 | 168.5 | 0 | 0 | 0 | 112.4 | A84 R143 R144 C145 S150 A151 A187 A188 Y191 L251 | A84-L147 HydrophobicContact CB-CD1 4.49Å; R143-L147 WeakPolarHBondContact O-CG 3.43Å; R143-L147 PolarHBondContact O-N 3.28Å; R144-L147 PolarHBondContact O-N 3.45Å; C145-L147 VanDerWaalsContact C-N 3.33Å; C145-L147 PolarHBondContact O-N 3.27Å; L147-S150 WeakPolarHBondContact CA-OG 3.31Å; L147-S150 PolarHBondContact O-N 3.42Å; L147-S150 PolarHBondContact O-OG 2.89Å; L147-A151 PolarHBondContact O-N 3.23Å; L147-A187 HydrophobicContact CD2-CB 3.76Å; L147-A187 HydrophobicContact CG-CB 3.72Å; L147-A188 HydrophobicContact CD2-CB 4.02Å; L147-Y191 HydrophobicContact CD1-CD1 4.38Å; L147-Y191 HydrophobicContact CD1-CG 4.3Å; L147-L251 HydrophobicContact CB-CD1 3.44Å; L147-L251 VanDerWaalsContact CB-CD1 3.44Å; L147-L251 HydrophobicContact CD1-CD1 4.11Å; L147-L251 HydrophobicContact CD1-CD2 3.99Å; L147-L251 HydrophobicContact CG-CD1 4.32Å |
| 148 | L | 94.7 | Very high | 92.8 | Very high | 35 Ų | 35 | 40.7 Ų | 40.7 | 18% | 0.183 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -64.7 | -47.1 | 175.1 | -71.1 | 170.1 | 0 | 0 | 0 | 111.8 | R144 C145 S150 A151 A152 M248 L251 L252 | R144-L148 HydrophobicContact CG-CD1 4.45Å; R144-L148 WeakPolarHBondContact O-CG 3.4Å; R144-L148 PolarHBondContact O-N 3.36Å; C145-L148 PolarHBondContact O-N 3.12Å; L148-S150 VanDerWaalsContact C-N 3.28Å; L148-S150 PolarHBondContact O-N 3.23Å; L148-A151 PolarHBondContact O-N 3.42Å; L148-A152 PolarHBondContact O-N 3.25Å; L148-M248 HydrophobicContact CD2-CB 4.45Å; L148-M248 HydrophobicContact CD2-CG 3.75Å; L148-M248 WeakPolarHBondContact CD2-O 3.28Å; L148-L251 HydrophobicContact CD2-CB 3.86Å; L148-L251 HydrophobicContact CG-CB 4.3Å; L148-L252 HydrophobicContact CD1-CD2 4.12Å; L148-L252 HydrophobicContact CD2-CD2 4.14Å; L148-L252 HydrophobicContact CD2-CG 4.37Å |
| 149 | L | 94.4 | Very high | 93.2 | Very high | 84 Ų | 84 | 44.7 Ų | 44.7 | 44% | 0.44 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -58.2 | -43.2 | 175.4 | 177.7 | 61.6 | 0 | 0 | 0 | 111 | C145 S146 A151 A152 L153 L183 | C145-L149 WeakPolarHBondContact O-CB 3.43Å; C145-L149 PolarHBondContact O-N 3.01Å; S146-L149 PolarHBondContact O-N 3.45Å; L149-A151 PolarHBondContact O-N 2.94Å; L149-A152 PolarHBondContact O-N 3.06Å; L149-L153 HydrophobicContact CG-CD1 4.34Å; L149-L153 WeakPolarHBondContact O-CG 3.32Å; L149-L153 PolarHBondContact O-N 3.44Å; L149-L183 HydrophobicContact CD2-CD2 4.16Å; L149-L183 HydrophobicContact CG-CD2 4.36Å |
| 150 | S | 94.6 | Very high | 93.8 | Very high | 1 Ų | 1 | 42.4 Ų | 42.4 | 1% | 0.007 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -63 | -40.7 | 178.9 | 75.1 | 0 | 0 | 0 | 0 | 112.9 | S146 L147 L148 L153 V154 G180 S184 | S146-S150 VanDerWaalsContact O-CB 3.24Å; S146-S150 WeakPolarHBondContact O-CB 3.46Å; S146-S150 PolarHBondContact O-N 2.87Å; S146-S150 PolarHBondContact O-OG 2.94Å; L147-S150 WeakPolarHBondContact CA-OG 3.31Å; L147-S150 PolarHBondContact O-N 3.42Å; L147-S150 PolarHBondContact O-OG 2.89Å; L148-S150 VanDerWaalsContact C-N 3.28Å; L148-S150 PolarHBondContact O-N 3.23Å; S150-L153 PolarHBondContact O-N 3.4Å; S150-V154 WeakPolarHBondContact O-CG2 3.45Å; S150-V154 PolarHBondContact O-N 2.93Å; S150-G180 WeakPolarHBondContact CB-O 3.37Å; S150-S184 WeakPolarHBondContact OG-CB 3.36Å |
| 151 | A | 94.9 | Very high | 94.2 | Very high | 0 Ų | 0 | 33.5 Ų | 33.5 | 0% | 0 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -65.3 | -40.9 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | L147 L148 L149 V154 V155 M248 | L147-A151 PolarHBondContact O-N 3.23Å; L148-A151 PolarHBondContact O-N 3.42Å; L149-A151 PolarHBondContact O-N 2.94Å; A151-V154 PolarHBondContact O-N 3.23Å; A151-V155 WeakPolarHBondContact O-CG2 3.37Å; A151-V155 PolarHBondContact O-N 3.03Å; A151-M248 HydrophobicContact CB-CB 4.11Å |
| 152 | A | 95.6 | Very high | 94.5 | Very high | 50 Ų | 50 | 29.9 Ų | 29.9 | 41% | 0.413 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -62.3 | -41.5 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | L148 L149 V155 G156 | L148-A152 PolarHBondContact O-N 3.25Å; L149-A152 PolarHBondContact O-N 3.06Å; A152-V155 PolarHBondContact O-N 3.46Å; A152-G156 PolarHBondContact O-N 3.3Å |
| 153 | L | 96.8 | Very high | 94.6 | Very high | 51 Ų | 51 | 33.1 Ų | 33.1 | 27% | 0.267 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -62.7 | -44.9 | 174.4 | -70.8 | 172.7 | 0 | 0 | 0 | 111.7 | L149 S150 G156 G157 V176 M179 | L149-L153 HydrophobicContact CG-CD1 4.34Å; L149-L153 WeakPolarHBondContact O-CG 3.32Å; L149-L153 PolarHBondContact O-N 3.44Å; S150-L153 PolarHBondContact O-N 3.4Å; L153-G156 PolarHBondContact O-N 3.4Å; L153-G157 PolarHBondContact O-N 3.15Å; L153-V176 HydrophobicContact CB-CG1 4.39Å; L153-V176 HydrophobicContact CD2-CG1 4.19Å; L153-V176 WeakPolarHBondContact O-CG1 3.49Å; L153-M179 HydrophobicContact CD1-CB 4.49Å |
| 154 | V | 96.9 | Very high | 94.5 | Very high | 0 Ų | 0 | 36.8 Ų | 36.8 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -63.4 | -45.5 | 178 | 175.2 | 0 | 0 | 0 | 0 | 111.3 | M90 S150 A151 T158 T181 V240 | M90-V154 HydrophobicContact CE-CB 3.69Å; M90-V154 HydrophobicContact CE-CG1 3.47Å; M90-V154 VanDerWaalsContact CE-CG1 3.47Å; M90-V154 HydrophobicContact CE-CG2 3.83Å; S150-V154 WeakPolarHBondContact O-CG2 3.45Å; S150-V154 PolarHBondContact O-N 2.93Å; A151-V154 PolarHBondContact O-N 3.23Å; V154-T158 VanDerWaalsContact O-CB 3.29Å; V154-T158 WeakPolarHBondContact O-CB 3.33Å; V154-T158 PolarHBondContact O-N 2.93Å; V154-T158 PolarHBondContact O-OG1 2.99Å; V154-T181 HydrophobicContact CG2-CG2 3.85Å; V154-V240 HydrophobicContact CG1-CG1 3.99Å; V154-V240 HydrophobicContact CG1-CG2 4.09Å |
| 155 | V | 97.1 | Very high | 94.2 | Very high | 21 Ų | 21 | 38.2 Ų | 38.2 | 13% | 0.127 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -62 | -49.9 | 177.1 | 172.5 | 0 | 0 | 0 | 0 | 110.8 | A151 A152 T158 I159 I241 A244 L245 | A151-V155 WeakPolarHBondContact O-CG2 3.37Å; A151-V155 PolarHBondContact O-N 3.03Å; A152-V155 PolarHBondContact O-N 3.46Å; V155-T158 PolarHBondContact O-N 3.38Å; V155-I159 HydrophobicContact CG1-CD1 3.81Å; V155-I159 HydrophobicContact CG1-CG1 4.48Å; V155-I159 VanDerWaalsContact O-CG1 3.28Å; V155-I159 WeakPolarHBondContact O-CG1 3.38Å; V155-I159 PolarHBondContact O-N 3.23Å; V155-I241 HydrophobicContact CG2-CG2 4.48Å; V155-A244 HydrophobicContact CG2-CB 3.65Å; V155-L245 HydrophobicContact CG2-CD2 4.16Å |
| 156 | G | 96.5 | Very high | 94.1 | Very high | 34 Ų | 34 | 37.8 Ų | 37.8 | 35% | 0.351 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -61.4 | -46 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.8 | A152 L153 T158 I159 V160 | A152-G156 PolarHBondContact O-N 3.3Å; L153-G156 PolarHBondContact O-N 3.4Å; G156-T158 VanDerWaalsContact C-N 3.35Å; G156-T158 PolarHBondContact O-N 3.27Å; G156-I159 PolarHBondContact O-N 2.92Å; G156-V160 WeakPolarHBondContact O-CG2 3.47Å; G156-V160 PolarHBondContact O-N 3.42Å; G156-V160 VanDerWaalsContact O-N 3.14Å |
| 157 | G | 96.9 | Very high | 93.9 | Very high | 1 Ų | 1 | 39.4 Ų | 39.4 | 1% | 0.01 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -62 | -41.6 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | L153 I159 V160 L161 | L153-G157 PolarHBondContact O-N 3.15Å; G157-I159 PolarHBondContact O-N 3.2Å; G157-V160 WeakPolarHBondContact O-CB 3.5Å; G157-V160 PolarHBondContact O-N 3.45Å; G157-L161 WeakPolarHBondContact O-CG 3.37Å; G157-L161 PolarHBondContact O-N 3.28Å |
| 158 | T | 96.3 | Very high | 93.9 | Very high | 0 Ų | 0 | 44 Ų | 44 | 0% | 0 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -65.9 | -38.3 | 177 | -53.1 | 0 | 0 | 0 | 0 | 112.2 | V154 V155 G156 V160 L161 V162 F237 V240 I241 | V154-T158 VanDerWaalsContact O-CB 3.29Å; V154-T158 WeakPolarHBondContact O-CB 3.33Å; V154-T158 PolarHBondContact O-N 2.93Å; V154-T158 PolarHBondContact O-OG1 2.99Å; V155-T158 PolarHBondContact O-N 3.38Å; G156-T158 VanDerWaalsContact C-N 3.35Å; G156-T158 PolarHBondContact O-N 3.27Å; T158-V160 VanDerWaalsContact C-N 3.3Å; T158-V160 PolarHBondContact O-N 3.07Å; T158-L161 WeakPolarHBondContact O-CB 3.43Å; T158-L161 PolarHBondContact O-N 3.29Å; T158-L161 VanDerWaalsContact O-N 3.17Å; T158-V162 HydrophobicContact CG2-CG2 4.36Å; T158-V162 WeakPolarHBondContact O-CG2 3.33Å; T158-V162 PolarHBondContact O-N 3.04Å; T158-F237 HydrophobicContact CG2-CB 4.34Å; T158-F237 VanDerWaalsContact CG2-O 3.25Å; T158-F237 WeakPolarHBondContact CG2-O 3.2Å; T158-V240 HydrophobicContact CG2-CG1 3.85Å; T158-V240 VanDerWaalsContact OG1-CG1 3.23Å; T158-V240 WeakPolarHBondContact OG1-CG1 3.27Å; T158-I241 HydrophobicContact CG2-CD1 3.96Å; T158-I241 HydrophobicContact CG2-CG1 3.88Å |
| 159 | I | 96.2 | Very high | 93.9 | Very high | 91 Ų | 91 | 42.9 Ų | 42.9 | 47% | 0.467 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -60.1 | -43.4 | 174.5 | -70.6 | 164.8 | 0 | 0 | 0 | 110.1 | V155 G156 G157 L161 V162 A163 I241 | V155-I159 HydrophobicContact CG1-CD1 3.81Å; V155-I159 HydrophobicContact CG1-CG1 4.48Å; V155-I159 VanDerWaalsContact O-CG1 3.28Å; V155-I159 WeakPolarHBondContact O-CG1 3.38Å; V155-I159 PolarHBondContact O-N 3.23Å; G156-I159 PolarHBondContact O-N 2.92Å; G157-I159 PolarHBondContact O-N 3.2Å; I159-L161 VanDerWaalsContact C-N 3.34Å; I159-L161 PolarHBondContact O-N 3.42Å; I159-V162 PolarHBondContact O-N 2.99Å; I159-A163 WeakPolarHBondContact O-CB 3.49Å; I159-A163 PolarHBondContact O-N 3.38Å; I159-I241 HydrophobicContact CG1-CD1 4.49Å |
| 160 | V | 95.6 | Very high | 93.8 | Very high | 53 Ų | 53 | 39 Ų | 39 | 32% | 0.321 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | -60.9 | -43.4 | 174.8 | 175.2 | 0 | 0 | 0 | 0 | 111.2 | G156 G157 T158 V162 L164 A169 | G156-V160 WeakPolarHBondContact O-CG2 3.47Å; G156-V160 PolarHBondContact O-N 3.42Å; G156-V160 VanDerWaalsContact O-N 3.14Å; G157-V160 WeakPolarHBondContact O-CB 3.5Å; G157-V160 PolarHBondContact O-N 3.45Å; T158-V160 VanDerWaalsContact C-N 3.3Å; T158-V160 PolarHBondContact O-N 3.07Å; V160-V162 VanDerWaalsContact C-N 3.3Å; V160-V162 PolarHBondContact O-N 3.29Å; V160-L164 PolarHBondContact O-N 3Å; V160-A169 HydrophobicContact CG1-CB 4.44Å; V160-A169 WeakPolarHBondContact CG1-O 3.29Å |
| 161 | L | 93.9 | Very high | 93.8 | Very high | 0 Ų | 0 | 40 Ų | 40 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -60.7 | -37.7 | 178 | -68.5 | 177.3 | 0 | 0 | 0 | 112.9 | G157 T158 I159 L170 R174 V177 W233 F237 | G157-L161 WeakPolarHBondContact O-CG 3.37Å; G157-L161 PolarHBondContact O-N 3.28Å; T158-L161 WeakPolarHBondContact O-CB 3.43Å; T158-L161 PolarHBondContact O-N 3.29Å; T158-L161 VanDerWaalsContact O-N 3.17Å; I159-L161 VanDerWaalsContact C-N 3.34Å; I159-L161 PolarHBondContact O-N 3.42Å; L161-L170 HydrophobicContact CD2-CB 4.43Å; L161-L170 HydrophobicContact CD2-CD2 3.9Å; L161-L170 WeakPolarHBondContact CD2-O 3.45Å; L161-R174 HydrophobicContact CD1-CG 4.46Å; L161-R174 HydrophobicContact CD2-CG 3.87Å; L161-V177 HydrophobicContact CD1-CG2 4.06Å; L161-W233 WeakPolarHBondContact O-CZ3 3.29Å; L161-F237 HydrophobicContact CB-CD2 4.29Å; L161-F237 HydrophobicContact CB-CG 4.26Å; L161-F237 HydrophobicContact CD1-CD1 3.73Å; L161-F237 HydrophobicContact CD1-CE1 3.83Å; L161-F237 HydrophobicContact CD1-CG 4.2Å; L161-F237 HydrophobicContact CD1-CZ 4.39Å |
| 162 | V | 94.1 | Very high | 93.9 | Very high | 57 Ų | 57 | 45 Ų | 45 | 35% | 0.345 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -84.3 | -35.3 | -177.5 | 172.3 | 0 | 0 | 0 | 0 | 112.1 | T158 I159 V160 A234 F237 | T158-V162 HydrophobicContact CG2-CG2 4.36Å; T158-V162 WeakPolarHBondContact O-CG2 3.33Å; T158-V162 PolarHBondContact O-N 3.04Å; I159-V162 PolarHBondContact O-N 2.99Å; V160-V162 VanDerWaalsContact C-N 3.3Å; V160-V162 PolarHBondContact O-N 3.29Å; V162-A234 HydrophobicContact CG1-CB 4.32Å; V162-A234 WeakPolarHBondContact CG2-O 3.49Å; V162-F237 HydrophobicContact CG2-CB 4.04Å |
| 163 | A | 91.1 | Very high | 93.9 | Very high | 69 Ų | 69 | 42.6 Ų | 42.6 | 57% | 0.57 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -80.3 | -28.4 | -171.8 | 0 | 0 | 0 | 0 | 0 | 114 | I159 | I159-A163 WeakPolarHBondContact O-CB 3.49Å; I159-A163 PolarHBondContact O-N 3.38Å |
| 164 | L | 89.2 | Confident | 93.9 | Very high | 95 Ų | 95 | 40.4 Ų | 40.4 | 50% | 0.497 | 25% | 0.249 | S | C | . | . | trans | -126.7 | 117.6 | -169.6 | -61.7 | 177.3 | 0 | 0 | 0 | 111.9 | V160 S166 A169 | V160-L164 PolarHBondContact O-N 3Å; L164-S166 PolarHBondContact O-N 3.42Å; L164-A169 HydrophobicContact CB-CB 3.5Å; L164-A169 HydrophobicContact CD1-CB 3.92Å; L164-A169 HydrophobicContact CG-CB 4.38Å | ||
| 165 | T | 84.8 | Confident | 93.9 | Very high | 94 Ų | 94 | 41.4 Ų | 41.4 | 58% | 0.577 | 26% | 0.256 | S | S | * | . | trans | -91.6 | 68.8 | 176.4 | 51.8 | 0 | 0 | 0 | 0 | 111.2 | W233 | T165-W233 HydrophobicContact CG2-CH2 3.5Å; T165-W233 VanDerWaalsContact CG2-CH2 3.5Å; T165-W233 HydrophobicContact CG2-CZ2 3.55Å | ||
| 166 | S | 90.3 | Very high | 94 | Very high | 56 Ų | 56 | 42.4 Ų | 42.4 | 39% | 0.392 | 26% | 0.262 | S | S | . | . | S | Bend | trans | -138.7 | 142.4 | 173.9 | 171.1 | 0 | 0 | 0 | 0 | 109.8 | L164 V168 A169 L170 | L164-S166 PolarHBondContact O-N 3.42Å; S166-V168 PolarHBondContact O-N 3.45Å; S166-A169 PolarHBondContact O-N 2.85Å; S166-A169 VanDerWaalsContact O-N 3.1Å; S166-L170 WeakPolarHBondContact O-CB 3.49Å; S166-L170 WeakPolarHBondContact O-CG 3.18Å; S166-L170 PolarHBondContact O-N 2.79Å |
| 167 | L | 89.8 | Confident | 94 | Very high | 36 Ų | 36 | 40.8 Ų | 40.8 | 19% | 0.188 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -54.9 | -40.5 | 178.6 | 178.7 | 65.3 | 0 | 0 | 0 | 111.9 | L111 E115 L170 T171 | L111-L167 HydrophobicContact CD2-CD1 4.06Å; E115-L167 HydrophobicContact CB-CD1 4.32Å; E115-L167 HydrophobicContact CB-CD2 3.96Å; E115-L167 HydrophobicContact CG-CD2 3.59Å; E115-L167 WeakPolarHBondContact OE1-CD2 3.47Å; L167-L170 PolarHBondContact O-N 3.32Å; L167-T171 VanDerWaalsContact O-CB 3.28Å; L167-T171 WeakPolarHBondContact O-CB 3.32Å; L167-T171 PolarHBondContact O-N 2.75Å; L167-T171 PolarHBondContact O-OG1 3.37Å |
| 168 | V | 92.9 | Very high | 93.9 | Very high | 97 Ų | 97 | 40.8 Ų | 40.8 | 59% | 0.588 | 25% | 0.245 | S | C | * | . | H | α-helix | trans | -65.7 | -46.2 | 178.7 | 178.3 | 0 | 0 | 0 | 0 | 110.5 | S166 T171 L172 | S166-V168 PolarHBondContact O-N 3.45Å; V168-T171 PolarHBondContact O-N 3.14Å; V168-L172 HydrophobicContact CG1-CD1 3.97Å; V168-L172 HydrophobicContact CG1-CG 4.4Å; V168-L172 WeakPolarHBondContact O-CB 3.24Å; V168-L172 VanDerWaalsContact O-CG 3.3Å; V168-L172 WeakPolarHBondContact O-CG 3.35Å; V168-L172 PolarHBondContact O-N 3.44Å |
| 169 | A | 93.6 | Very high | 93.9 | Very high | 11 Ų | 11 | 43 Ų | 43 | 9% | 0.091 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -64.2 | -41.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | V160 L164 S166 L172 G173 | V160-A169 HydrophobicContact CG1-CB 4.44Å; V160-A169 WeakPolarHBondContact CG1-O 3.29Å; L164-A169 HydrophobicContact CB-CB 3.5Å; L164-A169 HydrophobicContact CD1-CB 3.92Å; L164-A169 HydrophobicContact CG-CB 4.38Å; S166-A169 PolarHBondContact O-N 2.85Å; S166-A169 VanDerWaalsContact O-N 3.1Å; A169-L172 PolarHBondContact O-N 3.4Å; A169-G173 PolarHBondContact O-N 3.45Å |
| 170 | L | 93.3 | Very high | 93.9 | Very high | 2 Ų | 2 | 38.7 Ų | 38.7 | 1% | 0.01 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -62.3 | -46 | 175.6 | -71.2 | 173 | 0 | 0 | 0 | 111.4 | L105 L109 L119 L161 S166 L167 G173 R174 | L105-L170 HydrophobicContact CD1-CD1 4.13Å; L105-L170 HydrophobicContact CD2-CD1 4.21Å; L109-L170 HydrophobicContact CD1-CD1 3.74Å; L119-L170 HydrophobicContact CD1-CB 3.8Å; L161-L170 HydrophobicContact CD2-CB 4.43Å; L161-L170 HydrophobicContact CD2-CD2 3.9Å; L161-L170 WeakPolarHBondContact CD2-O 3.45Å; S166-L170 WeakPolarHBondContact O-CB 3.49Å; S166-L170 WeakPolarHBondContact O-CG 3.18Å; S166-L170 PolarHBondContact O-N 2.79Å; L167-L170 PolarHBondContact O-N 3.32Å; L170-G173 PolarHBondContact O-N 3.09Å; L170-R174 WeakPolarHBondContact O-CB 3.28Å; L170-R174 WeakPolarHBondContact O-CG 3.09Å; L170-R174 PolarHBondContact O-N 2.83Å |
| 171 | T | 94.9 | Very high | 93.8 | Very high | 23 Ų | 23 | 36.3 Ų | 36.3 | 14% | 0.141 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61.7 | -47.7 | 177.7 | -58.4 | 0 | 0 | 0 | 0 | 111 | L118 L167 V168 R174 V175 | L118-T171 HydrophobicContact CD1-CG2 4.45Å; L118-T171 HydrophobicContact CG-CG2 4.25Å; L167-T171 VanDerWaalsContact O-CB 3.28Å; L167-T171 WeakPolarHBondContact O-CB 3.32Å; L167-T171 PolarHBondContact O-N 2.75Å; L167-T171 PolarHBondContact O-OG1 3.37Å; V168-T171 PolarHBondContact O-N 3.14Å; T171-R174 PolarHBondContact O-N 3.26Å; T171-V175 WeakPolarHBondContact O-CG2 3.38Å; T171-V175 PolarHBondContact O-N 2.96Å |
| 172 | L | 96.2 | Very high | 93.8 | Very high | 104 Ų | 104 | 36.5 Ų | 36.5 | 55% | 0.545 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -63.4 | -45.2 | 177.9 | -71.8 | 175 | 0 | 0 | 0 | 111.8 | V168 A169 R174 V175 V176 | V168-L172 HydrophobicContact CG1-CD1 3.97Å; V168-L172 HydrophobicContact CG1-CG 4.4Å; V168-L172 WeakPolarHBondContact O-CB 3.24Å; V168-L172 VanDerWaalsContact O-CG 3.3Å; V168-L172 WeakPolarHBondContact O-CG 3.35Å; V168-L172 PolarHBondContact O-N 3.44Å; A169-L172 PolarHBondContact O-N 3.4Å; L172-R174 VanDerWaalsContact C-N 3.31Å; L172-R174 PolarHBondContact O-N 3.41Å; L172-V175 PolarHBondContact O-N 3.15Å; L172-V176 WeakPolarHBondContact O-CG2 3.49Å; L172-V176 PolarHBondContact O-N 3.43Å |
| 173 | G | 96.4 | Very high | 93.7 | Very high | 0 Ų | 0 | 33.9 Ų | 33.9 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -57.5 | -44.2 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | A169 L170 V176 V177 | A169-G173 PolarHBondContact O-N 3.45Å; L170-G173 PolarHBondContact O-N 3.09Å; G173-V176 PolarHBondContact O-N 3.3Å; G173-V177 WeakPolarHBondContact O-CG2 3.38Å; G173-V177 PolarHBondContact O-N 2.98Å |
| 174 | R | 95.9 | Very high | 93.8 | Very high | 4 Ų | 4 | 30.7 Ų | 30.7 | 2% | 0.015 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -65.7 | -40.4 | 176.8 | -71.4 | -130 | 82.6 | 119.3 | 8.6 | 112.9 | E94 T98 L119 S122 Q123 L161 L170 T171 L172 V176 V177 G178 F237 | E94-R174 IonicContact OE2-CZ 2.76Å; E94-R174 IonicContact OE2-NH2 2.65Å; E94-R174 PolarHBondContact OE2-NH2 3.19Å; T98-R174 PolarHBondContact OG1-NH1 2.94Å; T98-R174 PolarHBondContact OG1-NH2 3.17Å; L119-R174 HydrophobicContact CD1-CG 4.29Å; L119-R174 WeakPolarHBondContact O-CD 3.44Å; S122-R174 WeakPolarHBondContact OG-CB 3.31Å; Q123-R174 WeakPolarHBondContact CA-O 3.34Å; L161-R174 HydrophobicContact CD1-CG 4.46Å; L161-R174 HydrophobicContact CD2-CG 3.87Å; L170-R174 WeakPolarHBondContact O-CB 3.28Å; L170-R174 WeakPolarHBondContact O-CG 3.09Å; L170-R174 PolarHBondContact O-N 2.83Å; T171-R174 PolarHBondContact O-N 3.26Å; L172-R174 VanDerWaalsContact C-N 3.31Å; L172-R174 PolarHBondContact O-N 3.41Å; R174-V176 VanDerWaalsContact C-N 3.31Å; R174-V176 PolarHBondContact O-N 2.92Å; R174-V177 PolarHBondContact O-N 3.19Å; R174-G178 PolarHBondContact O-N 3.14Å; R174-F237 VanDerWaalsContact NH1-CE1 3.29Å |
| 175 | V | 97.5 | Very high | 93.8 | Very high | 22 Ų | 22 | 26.5 Ų | 26.5 | 13% | 0.133 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -59.2 | -45.8 | 173.1 | 173.6 | 0 | 0 | 0 | 0 | 109.8 | S122 L125 G126 T171 L172 G178 M179 | S122-V175 VanDerWaalsContact O-CG2 3.31Å; S122-V175 WeakPolarHBondContact O-CG2 3.25Å; L125-V175 HydrophobicContact CD2-CG2 4.42Å; G126-V175 WeakPolarHBondContact CA-O 3.37Å; T171-V175 WeakPolarHBondContact O-CG2 3.38Å; T171-V175 PolarHBondContact O-N 2.96Å; L172-V175 PolarHBondContact O-N 3.15Å; V175-G178 PolarHBondContact O-N 3.46Å; V175-M179 HydrophobicContact CG1-CE 4.14Å; V175-M179 WeakPolarHBondContact O-CG 3.39Å; V175-M179 PolarHBondContact O-N 3.42Å |
| 176 | V | 97.6 | Very high | 93.9 | Very high | 42 Ų | 42 | 25 Ų | 25 | 26% | 0.255 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -64.7 | -44.2 | 179.2 | 175.7 | 0 | 0 | 0 | 0 | 112.2 | L153 L172 G173 R174 G178 M179 G180 | L153-V176 HydrophobicContact CB-CG1 4.39Å; L153-V176 HydrophobicContact CD2-CG1 4.19Å; L153-V176 WeakPolarHBondContact O-CG1 3.49Å; L172-V176 WeakPolarHBondContact O-CG2 3.49Å; L172-V176 PolarHBondContact O-N 3.43Å; G173-V176 PolarHBondContact O-N 3.3Å; R174-V176 VanDerWaalsContact C-N 3.31Å; R174-V176 PolarHBondContact O-N 2.92Å; V176-G178 VanDerWaalsContact C-N 3.33Å; V176-G178 PolarHBondContact O-N 3.03Å; V176-M179 HydrophobicContact CB-CE 4.26Å; V176-M179 HydrophobicContact CG2-CE 3.85Å; V176-M179 WeakPolarHBondContact O-CB 3.14Å; V176-M179 PolarHBondContact O-N 3.35Å; V176-G180 PolarHBondContact O-N 3.32Å |
| 177 | V | 96.9 | Very high | 93.9 | Very high | 0 Ų | 0 | 22.3 Ų | 22.3 | 0% | 0 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -63.1 | -39.8 | 173.9 | 172.1 | 0 | 0 | 0 | 0 | 111.2 | E94 L161 G173 R174 G180 T181 | E94-V177 HydrophobicContact CG-CG1 3.78Å; L161-V177 HydrophobicContact CD1-CG2 4.06Å; G173-V177 WeakPolarHBondContact O-CG2 3.38Å; G173-V177 PolarHBondContact O-N 2.98Å; R174-V177 PolarHBondContact O-N 3.19Å; V177-G180 PolarHBondContact O-N 2.87Å; V177-T181 HydrophobicContact CG1-CG2 4.16Å; V177-T181 WeakPolarHBondContact O-CB 3.3Å; V177-T181 WeakPolarHBondContact O-CG2 3.29Å; V177-T181 PolarHBondContact O-N 2.61Å; V177-T181 PolarHBondContact O-OG1 3.43Å |
| 178 | G | 96.1 | Very high | 94 | Very high | 0 Ų | 0 | 20.6 Ų | 20.6 | 0% | 0 | 12% | 0.121 | C | C | . | . | H | α-helix | trans | -62 | -42 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | Q123 R174 V175 V176 T181 S182 | Q123-G178 WeakPolarHBondContact O-CA 3.3Å; R174-G178 PolarHBondContact O-N 3.14Å; V175-G178 PolarHBondContact O-N 3.46Å; V176-G178 VanDerWaalsContact C-N 3.33Å; V176-G178 PolarHBondContact O-N 3.03Å; G178-T181 PolarHBondContact O-OG1 3.46Å; G178-S182 VanDerWaalsContact O-CB 3.29Å; G178-S182 WeakPolarHBondContact O-CB 3.27Å; G178-S182 PolarHBondContact O-N 3.21Å; G178-S182 VanDerWaalsContact O-N 3.07Å |
| 179 | M | 95.8 | Very high | 93.8 | Very high | 47 Ų | 47 | 18 Ų | 18 | 23% | 0.232 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -59.8 | -48.9 | 171.9 | -72.8 | -169 | -71.4 | 0 | 0 | 111.1 | G126 V130 L153 V175 V176 L183 | G126-M179 VanDerWaalsContact O-CG 3.29Å; G126-M179 WeakPolarHBondContact O-CG 3.37Å; V130-M179 HydrophobicContact CG2-CB 3.48Å; V130-M179 VanDerWaalsContact CG2-CB 3.48Å; V130-M179 HydrophobicContact CG2-CG 3.65Å; V130-M179 HydrophobicContact CG2-SD 4.34Å; L153-M179 HydrophobicContact CD1-CB 4.49Å; V175-M179 HydrophobicContact CG1-CE 4.14Å; V175-M179 WeakPolarHBondContact O-CG 3.39Å; V175-M179 PolarHBondContact O-N 3.42Å; V176-M179 HydrophobicContact CB-CE 4.26Å; V176-M179 HydrophobicContact CG2-CE 3.85Å; V176-M179 WeakPolarHBondContact O-CB 3.14Å; V176-M179 PolarHBondContact O-N 3.35Å; M179-L183 WeakPolarHBondContact O-CB 3.37Å; M179-L183 PolarHBondContact O-N 3.26Å |
| 180 | G | 95.7 | Very high | 93.5 | Very high | 0 Ų | 0 | 20.6 Ų | 20.6 | 0% | 0 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -60.8 | -52.7 | 179 | 0 | 0 | 0 | 0 | 0 | 112.9 | S150 V176 V177 S182 L183 S184 | S150-G180 WeakPolarHBondContact CB-O 3.37Å; V176-G180 PolarHBondContact O-N 3.32Å; V177-G180 PolarHBondContact O-N 2.87Å; G180-S182 PolarHBondContact O-N 2.97Å; G180-L183 PolarHBondContact O-N 3.47Å; G180-S184 WeakPolarHBondContact O-CB 3.45Å; G180-S184 PolarHBondContact O-N 3.45Å; G180-S184 PolarHBondContact O-OG 3.35Å |
| 181 | T | 93.9 | Very high | 93.4 | Very high | 3 Ų | 3 | 20.5 Ų | 20.5 | 2% | 0.018 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -65.8 | -33.9 | -177.4 | 51.8 | 0 | 0 | 0 | 0 | 113.6 | E94 V154 V177 G178 S184 G185 | E94-T181 HydrophobicContact CG-CG2 4.08Å; V154-T181 HydrophobicContact CG2-CG2 3.85Å; V177-T181 HydrophobicContact CG1-CG2 4.16Å; V177-T181 WeakPolarHBondContact O-CB 3.3Å; V177-T181 WeakPolarHBondContact O-CG2 3.29Å; V177-T181 PolarHBondContact O-N 2.61Å; V177-T181 PolarHBondContact O-OG1 3.43Å; G178-T181 PolarHBondContact O-OG1 3.46Å; T181-S184 WeakPolarHBondContact CA-OG 3.42Å; T181-S184 PolarHBondContact O-OG 3.1Å; T181-G185 PolarHBondContact O-N 3.2Å |
| 182 | S | 93.3 | Very high | 93.1 | Very high | 4 Ų | 4 | 19.4 Ų | 19.4 | 3% | 0.028 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -72.2 | -41.7 | 174.9 | -174.7 | 0 | 0 | 0 | 0 | 112.5 | A127 C131 G178 G180 S184 G185 T186 | A127-S182 PolarHBondContact O-OG 3.39Å; C131-S182 PolarHBondContact SG-OG 3.32Å; C131-S182 VanDerWaalsContact SG-OG 3.33Å; G178-S182 VanDerWaalsContact O-CB 3.29Å; G178-S182 WeakPolarHBondContact O-CB 3.27Å; G178-S182 PolarHBondContact O-N 3.21Å; G178-S182 VanDerWaalsContact O-N 3.07Å; G180-S182 PolarHBondContact O-N 2.97Å; S182-S184 VanDerWaalsContact C-N 3.34Å; S182-G185 PolarHBondContact O-N 3.27Å; S182-T186 PolarHBondContact O-N 3.06Å; S182-T186 PolarHBondContact O-OG1 2.79Å |
| 183 | L | 93.2 | Very high | 92.6 | Very high | 3 Ų | 3 | 15.1 Ų | 15.1 | 2% | 0.016 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -63.1 | -44.8 | 175.9 | -176.4 | 59.3 | 0 | 0 | 0 | 110.3 | V130 I137 L138 L149 M179 G180 A187 | V130-L183 HydrophobicContact CG1-CB 3.67Å; V130-L183 HydrophobicContact CG1-CD1 4.28Å; I137-L183 HydrophobicContact CG2-CD1 4.4Å; L138-L183 HydrophobicContact CG-CD1 4.45Å; L149-L183 HydrophobicContact CD2-CD2 4.16Å; L149-L183 HydrophobicContact CG-CD2 4.36Å; M179-L183 WeakPolarHBondContact O-CB 3.37Å; M179-L183 PolarHBondContact O-N 3.26Å; G180-L183 PolarHBondContact O-N 3.47Å; L183-A187 WeakPolarHBondContact O-CB 3.39Å; L183-A187 PolarHBondContact O-N 2.98Å |
| 184 | S | 92.8 | Very high | 92.2 | Very high | 1 Ų | 1 | 16.2 Ų | 16.2 | 1% | 0.007 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -63.8 | -42.3 | -179.5 | 77.2 | 0 | 0 | 0 | 0 | 111.5 | S150 G180 T181 S182 A187 A188 | S150-S184 WeakPolarHBondContact OG-CB 3.36Å; G180-S184 WeakPolarHBondContact O-CB 3.45Å; G180-S184 PolarHBondContact O-N 3.45Å; G180-S184 PolarHBondContact O-OG 3.35Å; T181-S184 WeakPolarHBondContact CA-OG 3.42Å; T181-S184 PolarHBondContact O-OG 3.1Å; S182-S184 VanDerWaalsContact C-N 3.34Å; S184-A187 PolarHBondContact O-N 3.19Å; S184-A188 WeakPolarHBondContact O-CB 3.46Å; S184-A188 PolarHBondContact O-N 3.41Å |
| 185 | G | 89 | Confident | 91.9 | Very high | 7 Ų | 7 | 16 Ų | 16 | 7% | 0.072 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -62 | -48 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | T181 S182 A188 C189 Y208 | T181-G185 PolarHBondContact O-N 3.2Å; S182-G185 PolarHBondContact O-N 3.27Å; G185-A188 PolarHBondContact O-N 2.95Å; G185-C189 PolarHBondContact O-N 3.28Å; G185-C189 VanDerWaalsContact O-N 3.14Å; G185-C189 PolarHBondContact O-SG 3Å; G185-C189 VanDerWaalsContact O-SG 3.41Å; G185-Y208 WeakPolarHBondContact CA-OH 3.48Å |
| 186 | T | 86.9 | Confident | 91.3 | Very high | 62 Ų | 62 | 15.3 Ų | 15.3 | 38% | 0.38 | 9% | 0.091 | S | C | . | . | H | α-helix | trans | -64.3 | -44.1 | 177.3 | -52.2 | 0 | 0 | 0 | 0 | 111.2 | L138 S182 L190 | L138-T186 HydrophobicContact CD1-CG2 3.7Å; S182-T186 PolarHBondContact O-N 3.06Å; S182-T186 PolarHBondContact O-OG1 2.79Å; T186-L190 HydrophobicContact CG2-CD1 4.26Å; T186-L190 WeakPolarHBondContact O-CG 3.3Å; T186-L190 PolarHBondContact O-N 3.14Å |
| 187 | A | 90.6 | Very high | 90.5 | Very high | 0 Ų | 0 | 13.8 Ų | 13.8 | 0% | 0 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -65.8 | -40.6 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | L138 L147 L183 S184 Y191 | L138-A187 HydrophobicContact CD2-CB 3.65Å; L147-A187 HydrophobicContact CD2-CB 3.76Å; L147-A187 HydrophobicContact CG-CB 3.72Å; L183-A187 WeakPolarHBondContact O-CB 3.39Å; L183-A187 PolarHBondContact O-N 2.98Å; S184-A187 PolarHBondContact O-N 3.19Å; A187-Y191 WeakPolarHBondContact O-CB 3.4Å; A187-Y191 PolarHBondContact O-N 3.3Å |
| 188 | A | 91.8 | Very high | 89.5 | Confident | 0 Ų | 0 | 21.1 Ų | 21.1 | 0% | 0 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -66.3 | -49.2 | -178.8 | 0 | 0 | 0 | 0 | 0 | 111.1 | A84 L147 S184 G185 L190 Y191 I192 Y208 | A84-A188 HydrophobicContact CB-CB 4.35Å; A84-A188 WeakPolarHBondContact O-CB 3.5Å; L147-A188 HydrophobicContact CD2-CB 4.02Å; S184-A188 WeakPolarHBondContact O-CB 3.46Å; S184-A188 PolarHBondContact O-N 3.41Å; G185-A188 PolarHBondContact O-N 2.95Å; A188-L190 VanDerWaalsContact C-N 3.31Å; A188-L190 PolarHBondContact O-N 3.43Å; A188-Y191 PolarHBondContact O-N 3Å; A188-I192 WeakPolarHBondContact O-CB 3.28Å; A188-I192 WeakPolarHBondContact O-CD1 3.18Å; A188-I192 WeakPolarHBondContact O-CG1 3.48Å; A188-I192 PolarHBondContact O-N 3.43Å; A188-Y208 HydrophobicContact CB-CD2 3.89Å; A188-Y208 HydrophobicContact CB-CE2 3.89Å |
| 189 | C | 87.8 | Confident | 88.5 | Confident | 42 Ų | 42 | 27.7 Ų | 27.7 | 28% | 0.284 | 14% | 0.14 | S | C | . | . | H | α-helix | trans | -57.3 | -44.3 | 177.1 | -73 | 0 | 0 | 0 | 0 | 111.9 | G185 A193 Y208 | G185-C189 PolarHBondContact O-N 3.28Å; G185-C189 VanDerWaalsContact O-N 3.14Å; G185-C189 PolarHBondContact O-SG 3Å; G185-C189 VanDerWaalsContact O-SG 3.41Å; C189-A193 WeakPolarHBondContact O-CB 3.39Å; C189-A193 PolarHBondContact O-N 3.09Å; C189-Y208 WeakPolarHBondContact SG-CD1 3.43Å |
| 190 | L | 87.8 | Confident | 87.5 | Confident | 66 Ų | 66 | 29.8 Ų | 29.8 | 35% | 0.346 | 15% | 0.146 | S | C | . | . | H | α-helix | trans | -67.3 | -44.9 | 176.6 | -70.3 | 175 | 0 | 0 | 0 | 112.1 | L138 R143 T186 A188 A193 E194 | L138-L190 HydrophobicContact CD1-CD1 4.15Å; R143-L190 HydrophobicContact CG-CB 4.24Å; T186-L190 HydrophobicContact CG2-CD1 4.26Å; T186-L190 WeakPolarHBondContact O-CG 3.3Å; T186-L190 PolarHBondContact O-N 3.14Å; A188-L190 VanDerWaalsContact C-N 3.31Å; A188-L190 PolarHBondContact O-N 3.43Å; L190-A193 PolarHBondContact O-N 3.43Å; L190-E194 WeakPolarHBondContact O-CB 3.2Å; L190-E194 WeakPolarHBondContact O-CG 3.48Å; L190-E194 PolarHBondContact O-N 3.24Å |
| 191 | Y | 90.8 | Very high | 86.7 | Confident | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -60.5 | -50 | 179.5 | -175.5 | -108.7 | 0 | 0 | 0 | 111.3 | A80 A84 R143 L147 A187 A188 A193 E194 I195 P255 | A80-Y191 HydrophobicContact CB-CE1 4.14Å; A84-Y191 HydrophobicContact CB-CD1 3.88Å; R143-Y191 HydrophobicContact CB-CD2 4.03Å; L147-Y191 HydrophobicContact CD1-CD1 4.38Å; L147-Y191 HydrophobicContact CD1-CG 4.3Å; A187-Y191 WeakPolarHBondContact O-CB 3.4Å; A187-Y191 PolarHBondContact O-N 3.3Å; A188-Y191 PolarHBondContact O-N 3Å; Y191-A193 VanDerWaalsContact C-N 3.33Å; Y191-A193 PolarHBondContact O-N 3.19Å; Y191-E194 PolarHBondContact O-N 3.33Å; Y191-I195 HydrophobicContact CD1-CD1 3.99Å; Y191-I195 HydrophobicContact CD2-CG2 4.27Å; Y191-I195 HydrophobicContact CE1-CD1 3.73Å; Y191-I195 HydrophobicContact CE1-CG2 4.41Å; Y191-I195 HydrophobicContact CE2-CG2 3.97Å; Y191-I195 VanDerWaalsContact O-CG1 3.29Å; Y191-I195 WeakPolarHBondContact O-CG1 3.47Å; Y191-I195 WeakPolarHBondContact O-CG2 3.35Å; Y191-I195 PolarHBondContact O-N 3.44Å; Y191-P255 PolarHBondContact OH-O 3.48Å |
| 192 | I | 89.3 | Confident | 85.6 | Confident | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -58.6 | -46.6 | 177.6 | -66 | 166.4 | 0 | 0 | 0 | 110.3 | A81 A84 S85 A188 E194 I195 S196 L204 V205 | A81-I192 HydrophobicContact CB-CG1 4.49Å; A81-I192 HydrophobicContact CB-CG2 4.43Å; A84-I192 HydrophobicContact CB-CD1 4.03Å; A84-I192 HydrophobicContact CB-CG1 3.8Å; S85-I192 WeakPolarHBondContact OG-CD1 3.48Å; A188-I192 WeakPolarHBondContact O-CB 3.28Å; A188-I192 WeakPolarHBondContact O-CD1 3.18Å; A188-I192 WeakPolarHBondContact O-CG1 3.48Å; A188-I192 PolarHBondContact O-N 3.43Å; I192-E194 VanDerWaalsContact C-N 3.34Å; I192-E194 PolarHBondContact O-N 3.36Å; I192-I195 WeakPolarHBondContact O-CG1 3.3Å; I192-I195 PolarHBondContact O-N 3.01Å; I192-S196 WeakPolarHBondContact O-CB 3.34Å; I192-S196 PolarHBondContact O-N 2.9Å; I192-S196 PolarHBondContact O-OG 3.34Å; I192-S196 VanDerWaalsContact O-OG 3.13Å; I192-L204 HydrophobicContact CG2-CB 3.77Å; I192-L204 WeakPolarHBondContact CG2-O 3.31Å; I192-V205 HydrophobicContact CG2-CG2 4.03Å |
| 193 | A | 86.1 | Confident | 84.9 | Confident | 15 Ų | 15 | 40.7 Ų | 40.7 | 12% | 0.124 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -61.7 | -39.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.9 | C189 L190 Y191 S196 V205 | C189-A193 WeakPolarHBondContact O-CB 3.39Å; C189-A193 PolarHBondContact O-N 3.09Å; L190-A193 PolarHBondContact O-N 3.43Å; Y191-A193 VanDerWaalsContact C-N 3.33Å; Y191-A193 PolarHBondContact O-N 3.19Å; A193-S196 PolarHBondContact O-OG 2.82Å; A193-V205 HydrophobicContact CB-CG2 4.2Å |
| 194 | E | 87.8 | Confident | 84.3 | Confident | 23 Ų | 23 | 41.5 Ų | 41.5 | 11% | 0.107 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -77.3 | -28 | -177.1 | -73.5 | 172.8 | -178.3 | 0 | 0 | 114 | R143 L190 Y191 I192 S257 R259 | R143-E194 WeakPolarHBondContact CD-OE2 3.12Å; R143-E194 IonicContact CZ-OE1 2.84Å; R143-E194 VanDerWaalsContact CZ-OE1 3.23Å; R143-E194 IonicContact CZ-OE2 2.71Å; R143-E194 VanDerWaalsContact NE-CD 3.29Å; R143-E194 IonicContact NE-OE1 3.89Å; R143-E194 PolarHBondContact NE-OE1 2.93Å; R143-E194 IonicContact NE-OE2 3.9Å; R143-E194 PolarHBondContact NE-OE2 2.96Å; R143-E194 IonicContact NH2-OE1 3.69Å; R143-E194 PolarHBondContact NH2-OE1 3.35Å; R143-E194 IonicContact NH2-OE2 2.92Å; L190-E194 WeakPolarHBondContact O-CB 3.2Å; L190-E194 WeakPolarHBondContact O-CG 3.48Å; L190-E194 PolarHBondContact O-N 3.24Å; Y191-E194 PolarHBondContact O-N 3.33Å; I192-E194 VanDerWaalsContact C-N 3.34Å; I192-E194 PolarHBondContact O-N 3.36Å; E194-S257 WeakPolarHBondContact OE2-CB 3.2Å; E194-S257 PolarHBondContact OE2-OG 3.2Å; E194-R259 HydrophobicContact CB-CB 4.49Å; E194-R259 HydrophobicContact CG-CB 4.17Å |
| 195 | I | 88.1 | Confident | 83.8 | Confident | 0 Ų | 0 | 43.7 Ų | 43.7 | 0% | 0 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -90.2 | -24 | 178 | 69.4 | 179.2 | 0 | 0 | 0 | 112.9 | A80 Y191 I192 M277 R278 | A80-I195 HydrophobicContact CB-CD1 3.47Å; A80-I195 VanDerWaalsContact CB-CD1 3.47Å; Y191-I195 HydrophobicContact CD1-CD1 3.99Å; Y191-I195 HydrophobicContact CD2-CG2 4.27Å; Y191-I195 HydrophobicContact CE1-CD1 3.73Å; Y191-I195 HydrophobicContact CE1-CG2 4.41Å; Y191-I195 HydrophobicContact CE2-CG2 3.97Å; Y191-I195 VanDerWaalsContact O-CG1 3.29Å; Y191-I195 WeakPolarHBondContact O-CG1 3.47Å; Y191-I195 WeakPolarHBondContact O-CG2 3.35Å; Y191-I195 PolarHBondContact O-N 3.44Å; I192-I195 WeakPolarHBondContact O-CG1 3.3Å; I192-I195 PolarHBondContact O-N 3.01Å; I195-M277 HydrophobicContact CB-CE 3.44Å; I195-M277 VanDerWaalsContact CB-CE 3.44Å; I195-M277 HydrophobicContact CB-SD 4.05Å; I195-M277 HydrophobicContact CD1-CE 4.12Å; I195-M277 HydrophobicContact CG1-CE 4.26Å; I195-M277 HydrophobicContact CG2-CE 3.58Å; I195-M277 HydrophobicContact CG2-SD 3.89Å; I195-R278 PolarHBondContact O-NH1 3.35Å |
| 196 | S | 85.4 | Confident | 83.5 | Confident | 6 Ų | 6 | 45.6 Ų | 45.6 | 4% | 0.042 | 24% | 0.235 | C | C | . | . | S | Bend | trans | -67.8 | 145.2 | -176.6 | 63.6 | 0 | 0 | 0 | 0 | 112.6 | I192 A193 R201 R278 | I192-S196 WeakPolarHBondContact O-CB 3.34Å; I192-S196 PolarHBondContact O-N 2.9Å; I192-S196 PolarHBondContact O-OG 3.34Å; I192-S196 VanDerWaalsContact O-OG 3.13Å; A193-S196 PolarHBondContact O-OG 2.82Å; S196-R201 WeakPolarHBondContact OG-CA 3.39Å; S196-R201 VanDerWaalsContact OG-CB 3.22Å; S196-R201 WeakPolarHBondContact OG-CB 3.29Å; S196-R201 WeakPolarHBondContact OG-CG 3.5Å; S196-R278 PolarHBondContact O-NH2 3.26Å |
| 197 | P | 82.3 | Confident | 83.4 | Confident | 11 Ų | 11 | 44.2 Ų | 44.2 | 7% | 0.071 | 23% | 0.226 | C | C | . | . | trans | -71.3 | 150.6 | 168.9 | 30.2 | -32.2 | 0 | 0 | 0 | 110.1 | E199 R200 R201 R278 | P197-E199 PolarHBondContact O-N 3.48Å; P197-E199 VanDerWaalsContact O-N 3.12Å; P197-R200 HydrophobicContact CG-CB 4.15Å; P197-R200 PolarHBondContact O-N 3.05Å; P197-R200 VanDerWaalsContact O-N 3.1Å; P197-R201 WeakPolarHBondContact O-CB 3.36Å; P197-R201 PolarHBondContact O-N 2.99Å; P197-R278 VanDerWaalsContact N-NH1 3.15Å | ||
| 198 | R | 74.9 | Confident | 83.3 | Confident | 154 Ų | 154 | 45 Ų | 45 | 58% | 0.581 | 23% | 0.229 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -53.8 | -37.4 | -175 | -69.7 | -176.9 | 175 | 167.1 | 2.3 | 112.5 | R200 D291 | R198-R200 PolarHBondContact O-N 3.47Å; R198-D291 IonicContact CZ-OD2 3.57Å; R198-D291 IonicContact NH1-OD2 2.84Å; R198-D291 PolarHBondContact NH1-OD2 3.47Å; R198-D291 VanDerWaalsContact NH2-CG 3.34Å; R198-D291 IonicContact NH2-OD2 3.81Å; R198-D291 PolarHBondContact NH2-OD2 3.5Å |
| 199 | E | 75 | Confident | 83 | Confident | 137 Ų | 137 | 47.7 Ų | 47.7 | 64% | 0.64 | 24% | 0.241 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -74.7 | -24.8 | -174.2 | -54.5 | 71.6 | -151.3 | 0 | 0 | 113.1 | P197 | P197-E199 PolarHBondContact O-N 3.48Å; P197-E199 VanDerWaalsContact O-N 3.12Å |
| 200 | R | 74.4 | Confident | 83 | Confident | 92 Ų | 92 | 46.8 Ų | 46.8 | 35% | 0.347 | 23% | 0.233 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -120.8 | 6.7 | -176.4 | -56.6 | -173.9 | -179.1 | -173.8 | 0.9 | 113.6 | P197 R198 G202 L203 L204 | P197-R200 HydrophobicContact CG-CB 4.15Å; P197-R200 PolarHBondContact O-N 3.05Å; P197-R200 VanDerWaalsContact O-N 3.1Å; R198-R200 PolarHBondContact O-N 3.47Å; R200-G202 VanDerWaalsContact C-N 3.34Å; R200-G202 PolarHBondContact O-N 3.5Å; R200-L203 PolarHBondContact O-N 3.46Å; R200-L204 PolarHBondContact O-N 2.99Å |
| 201 | R | 78.8 | Confident | 83.2 | Confident | 110 Ų | 110 | 44.1 Ų | 44.1 | 42% | 0.415 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -55.3 | -47.4 | -179.6 | 174.6 | 167.1 | 173.9 | -168.3 | 0.2 | 112.5 | S196 P197 L203 L204 V205 | S196-R201 WeakPolarHBondContact OG-CA 3.39Å; S196-R201 VanDerWaalsContact OG-CB 3.22Å; S196-R201 WeakPolarHBondContact OG-CB 3.29Å; S196-R201 WeakPolarHBondContact OG-CG 3.5Å; P197-R201 WeakPolarHBondContact O-CB 3.36Å; P197-R201 PolarHBondContact O-N 2.99Å; R201-L203 PolarHBondContact O-N 3.26Å; R201-L204 PolarHBondContact O-N 2.62Å; R201-V205 HydrophobicContact CG-CG2 4.37Å; R201-V205 VanDerWaalsContact O-CG2 3.28Å; R201-V205 WeakPolarHBondContact O-CG2 3.5Å; R201-V205 PolarHBondContact O-N 2.7Å |
| 202 | G | 72.2 | Confident | 83.3 | Confident | 53 Ų | 53 | 44.7 Ų | 44.7 | 55% | 0.546 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -57 | -49.3 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112 | R200 L204 V205 T206 | R200-G202 VanDerWaalsContact C-N 3.34Å; R200-G202 PolarHBondContact O-N 3.5Å; G202-L204 PolarHBondContact O-N 3.33Å; G202-V205 PolarHBondContact O-N 3.48Å; G202-T206 WeakPolarHBondContact O-CG2 3.28Å; G202-T206 PolarHBondContact O-N 3.13Å; G202-T206 PolarHBondContact O-OG1 3.43Å |
| 203 | L | 78.1 | Confident | 83.4 | Confident | 73 Ų | 73 | 44.7 Ų | 44.7 | 38% | 0.382 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -61.8 | -40.6 | 179.2 | 178.7 | 64.9 | 0 | 0 | 0 | 113.3 | F23 R200 R201 T206 L207 | F23-L203 HydrophobicContact CB-CD2 4.35Å; F23-L203 HydrophobicContact CD1-CD1 3.7Å; F23-L203 HydrophobicContact CE1-CD1 3.95Å; F23-L203 HydrophobicContact CG-CD1 4.3Å; R200-L203 PolarHBondContact O-N 3.46Å; R201-L203 PolarHBondContact O-N 3.26Å; L203-T206 WeakPolarHBondContact CA-OG1 3.44Å; L203-T206 PolarHBondContact O-OG1 3.14Å; L203-L207 PolarHBondContact O-N 3.38Å |
| 204 | L | 80.9 | Confident | 83.7 | Confident | 19 Ų | 19 | 44 Ų | 44 | 10% | 0.099 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -72.1 | -34.2 | 179.6 | -70.5 | 173.7 | 0 | 0 | 0 | 111.6 | V77 A81 I192 R200 R201 G202 L207 | V77-L204 HydrophobicContact CG1-CD1 3.89Å; A81-L204 HydrophobicContact CB-CD2 3.91Å; I192-L204 HydrophobicContact CG2-CB 3.77Å; I192-L204 WeakPolarHBondContact CG2-O 3.31Å; R200-L204 PolarHBondContact O-N 2.99Å; R201-L204 PolarHBondContact O-N 2.62Å; G202-L204 PolarHBondContact O-N 3.33Å; L204-L207 WeakPolarHBondContact O-CB 3.47Å; L204-L207 PolarHBondContact O-N 3.08Å |
| 205 | V | 81.8 | Confident | 84.1 | Confident | 48 Ų | 48 | 42.9 Ų | 42.9 | 29% | 0.291 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -70.4 | -37.1 | 175.5 | 173.2 | 0 | 0 | 0 | 0 | 111.3 | I192 A193 R201 G202 L207 Y208 | I192-V205 HydrophobicContact CG2-CG2 4.03Å; A193-V205 HydrophobicContact CB-CG2 4.2Å; R201-V205 HydrophobicContact CG-CG2 4.37Å; R201-V205 VanDerWaalsContact O-CG2 3.28Å; R201-V205 WeakPolarHBondContact O-CG2 3.5Å; R201-V205 PolarHBondContact O-N 2.7Å; G202-V205 PolarHBondContact O-N 3.48Å; V205-L207 PolarHBondContact O-N 2.98Å; V205-Y208 WeakPolarHBondContact O-CB 3.42Å; V205-Y208 PolarHBondContact O-N 3.08Å; V205-Y208 VanDerWaalsContact O-N 3.15Å |
| 206 | T | 82.3 | Confident | 84.3 | Confident | 46 Ų | 46 | 42.9 Ų | 42.9 | 28% | 0.282 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -66.9 | -21.9 | 176.9 | 55.6 | 0 | 0 | 0 | 0 | 113.2 | G202 L203 Y208 E209 L210 V374 | G202-T206 WeakPolarHBondContact O-CG2 3.28Å; G202-T206 PolarHBondContact O-N 3.13Å; G202-T206 PolarHBondContact O-OG1 3.43Å; L203-T206 WeakPolarHBondContact CA-OG1 3.44Å; L203-T206 PolarHBondContact O-OG1 3.14Å; T206-Y208 VanDerWaalsContact C-N 3.27Å; T206-Y208 PolarHBondContact O-N 2.97Å; T206-E209 PolarHBondContact O-N 3.31Å; T206-L210 PolarHBondContact O-N 3.43Å; T206-V374 HydrophobicContact CG2-CG1 3.67Å |
| 207 | L | 85.3 | Confident | 84.8 | Confident | 34 Ų | 34 | 42.9 Ų | 42.9 | 18% | 0.178 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -59.6 | -37.7 | 172 | -177 | 64.3 | 0 | 0 | 0 | 112.2 | V82 L203 L204 V205 L210 M211 | V82-L207 HydrophobicContact CG2-CD2 3.94Å; L203-L207 PolarHBondContact O-N 3.38Å; L204-L207 WeakPolarHBondContact O-CB 3.47Å; L204-L207 PolarHBondContact O-N 3.08Å; V205-L207 PolarHBondContact O-N 2.98Å; L207-L210 PolarHBondContact O-N 2.63Å; L207-M211 HydrophobicContact CD1-CE 4.1Å; L207-M211 WeakPolarHBondContact O-CG 3.2Å; L207-M211 PolarHBondContact O-N 3Å |
| 208 | Y | 88.4 | Confident | 85.4 | Confident | 16 Ų | 16 | 43.7 Ų | 43.7 | 6% | 0.063 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -60.9 | -49.2 | 176.1 | 170.9 | -89.2 | 0 | 0 | 0 | 110.8 | G88 L91 G185 A188 C189 V205 T206 L210 M211 V212 | G88-Y208 VanDerWaalsContact N-CE2 3.31Å; L91-Y208 WeakPolarHBondContact CD2-OH 3.09Å; G185-Y208 WeakPolarHBondContact CA-OH 3.48Å; A188-Y208 HydrophobicContact CB-CD2 3.89Å; A188-Y208 HydrophobicContact CB-CE2 3.89Å; C189-Y208 WeakPolarHBondContact SG-CD1 3.43Å; V205-Y208 WeakPolarHBondContact O-CB 3.42Å; V205-Y208 PolarHBondContact O-N 3.08Å; V205-Y208 VanDerWaalsContact O-N 3.15Å; T206-Y208 VanDerWaalsContact C-N 3.27Å; T206-Y208 PolarHBondContact O-N 2.97Å; Y208-L210 VanDerWaalsContact C-N 3.32Å; Y208-L210 PolarHBondContact O-N 3.47Å; Y208-M211 WeakPolarHBondContact O-CB 3.32Å; Y208-M211 PolarHBondContact O-N 3.11Å; Y208-M211 VanDerWaalsContact O-N 3.11Å; Y208-V212 HydrophobicContact CD1-CG2 4.2Å; Y208-V212 HydrophobicContact CE1-CG2 3.69Å; Y208-V212 WeakPolarHBondContact O-CG2 3.31Å; Y208-V212 PolarHBondContact O-N 3.15Å |
| 209 | E | 86.6 | Confident | 86.3 | Confident | 56 Ų | 56 | 36.4 Ų | 36.4 | 26% | 0.262 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -62.6 | -41.2 | 179.8 | -174.5 | 61.2 | -159.9 | 0 | 0 | 111.5 | T206 M211 V212 V213 | T206-E209 PolarHBondContact O-N 3.31Å; E209-M211 VanDerWaalsContact C-N 3.29Å; E209-M211 PolarHBondContact O-N 3.23Å; E209-V212 WeakPolarHBondContact O-CB 3.3Å; E209-V212 PolarHBondContact O-N 3.37Å; E209-V212 VanDerWaalsContact O-N 3.14Å; E209-V213 PolarHBondContact O-N 3.04Å; E209-V213 VanDerWaalsContact O-N 3.08Å |
| 210 | L | 87.3 | Confident | 87.1 | Confident | 24 Ų | 24 | 29.9 Ų | 29.9 | 13% | 0.126 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -59.2 | -42.2 | 174.4 | -176.3 | 61.4 | 0 | 0 | 0 | 111.5 | I18 T206 L207 Y208 V213 V214 I371 | I18-L210 HydrophobicContact CG2-CD1 4.49Å; I18-L210 HydrophobicContact CG2-CD2 3.54Å; I18-L210 HydrophobicContact CG2-CG 4.05Å; T206-L210 PolarHBondContact O-N 3.43Å; L207-L210 PolarHBondContact O-N 2.63Å; Y208-L210 VanDerWaalsContact C-N 3.32Å; Y208-L210 PolarHBondContact O-N 3.47Å; L210-V213 PolarHBondContact O-N 2.93Å; L210-V214 VanDerWaalsContact O-CG2 3.3Å; L210-V214 WeakPolarHBondContact O-CG2 3.41Å; L210-V214 PolarHBondContact O-N 3.27Å; L210-I371 HydrophobicContact CD1-CG1 4.35Å |
| 211 | M | 91.9 | Very high | 88 | Confident | 10 Ų | 10 | 25.7 Ų | 25.7 | 5% | 0.049 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -65.3 | -36 | 175.5 | -71 | -62.7 | 128.7 | 0 | 0 | 112.4 | I18 L19 S85 L89 L207 Y208 E209 V213 V214 G215 | I18-M211 HydrophobicContact CG2-CE 4.45Å; L19-M211 HydrophobicContact CD2-CE 3.69Å; L19-M211 HydrophobicContact CD2-SD 4.4Å; L19-M211 HydrophobicContact CG-CE 4.17Å; S85-M211 VanDerWaalsContact O-CB 3.28Å; S85-M211 WeakPolarHBondContact O-CB 3.39Å; L89-M211 VanDerWaalsContact CA-O 3.31Å; L89-M211 WeakPolarHBondContact CA-O 3.38Å; L89-M211 HydrophobicContact CB-CB 4.34Å; L89-M211 HydrophobicContact CD1-SD 4.41Å; L207-M211 HydrophobicContact CD1-CE 4.1Å; L207-M211 WeakPolarHBondContact O-CG 3.2Å; L207-M211 PolarHBondContact O-N 3Å; Y208-M211 WeakPolarHBondContact O-CB 3.32Å; Y208-M211 PolarHBondContact O-N 3.11Å; Y208-M211 VanDerWaalsContact O-N 3.11Å; E209-M211 VanDerWaalsContact C-N 3.29Å; E209-M211 PolarHBondContact O-N 3.23Å; M211-V213 PolarHBondContact O-N 2.86Å; M211-V214 PolarHBondContact O-N 2.89Å; M211-G215 PolarHBondContact O-N 2.84Å |
| 212 | V | 92.3 | Very high | 88.7 | Confident | 11 Ų | 11 | 20.8 Ų | 20.8 | 7% | 0.067 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -57.3 | -50 | 172 | 175.9 | 0 | 0 | 0 | 0 | 110.6 | G88 L91 G92 Y208 E209 V214 G215 V216 | G88-V212 VanDerWaalsContact CA-CG2 3.46Å; G88-V212 VanDerWaalsContact O-CA 3.26Å; G88-V212 WeakPolarHBondContact O-CA 3.26Å; L91-V212 HydrophobicContact CD2-CG2 4.42Å; G92-V212 VanDerWaalsContact CA-O 3.29Å; G92-V212 WeakPolarHBondContact CA-O 3.24Å; Y208-V212 HydrophobicContact CD1-CG2 4.2Å; Y208-V212 HydrophobicContact CE1-CG2 3.69Å; Y208-V212 WeakPolarHBondContact O-CG2 3.31Å; Y208-V212 PolarHBondContact O-N 3.15Å; E209-V212 WeakPolarHBondContact O-CB 3.3Å; E209-V212 PolarHBondContact O-N 3.37Å; E209-V212 VanDerWaalsContact O-N 3.14Å; V212-V214 PolarHBondContact O-N 2.51Å; V212-G215 WeakPolarHBondContact O-CA 3.46Å; V212-G215 PolarHBondContact O-N 2.68Å; V212-G215 VanDerWaalsContact O-N 3.13Å; V212-V216 WeakPolarHBondContact O-CG2 3.24Å; V212-V216 PolarHBondContact O-N 3.47Å |
| 213 | V | 91.6 | Very high | 89.6 | Confident | 0 Ų | 0 | 18.3 Ų | 18.3 | 0% | 0 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -68.8 | -38.4 | -176.4 | -178.2 | 0 | 0 | 0 | 0 | 112 | E209 L210 M211 G215 V216 M217 K366 V367 T370 | E209-V213 PolarHBondContact O-N 3.04Å; E209-V213 VanDerWaalsContact O-N 3.08Å; L210-V213 PolarHBondContact O-N 2.93Å; M211-V213 PolarHBondContact O-N 2.86Å; V213-G215 VanDerWaalsContact C-N 3.29Å; V213-G215 PolarHBondContact O-N 3.23Å; V213-V216 PolarHBondContact O-N 2.71Å; V213-M217 PolarHBondContact O-N 3.23Å; V213-K366 HydrophobicContact CG1-CB 3.77Å; V213-K366 HydrophobicContact CG1-CD 4.16Å; V213-K366 HydrophobicContact CG1-CG 3.6Å; V213-K366 HydrophobicContact CG2-CG 4.37Å; V213-V367 VanDerWaalsContact CG1-CA 3.4Å; V213-V367 HydrophobicContact CG1-CB 4.11Å; V213-V367 HydrophobicContact CG1-CG2 3.66Å; V213-T370 HydrophobicContact CG2-CG2 4.27Å |
| 214 | V | 93.3 | Very high | 90.3 | Very high | 1 Ų | 1 | 16.3 Ų | 16.3 | 1% | 0.006 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -61.6 | -39.6 | 170.7 | 172 | 0 | 0 | 0 | 0 | 111 | A15 I18 L89 L210 M211 V212 V216 M217 L218 | A15-V214 HydrophobicContact CB-CG1 3.99Å; I18-V214 HydrophobicContact CD1-CG2 3.9Å; L89-V214 HydrophobicContact CD1-CB 4.3Å; L89-V214 HydrophobicContact CD1-CG1 3.88Å; L210-V214 VanDerWaalsContact O-CG2 3.3Å; L210-V214 WeakPolarHBondContact O-CG2 3.41Å; L210-V214 PolarHBondContact O-N 3.27Å; M211-V214 PolarHBondContact O-N 2.89Å; V212-V214 PolarHBondContact O-N 2.51Å; V214-V216 PolarHBondContact O-N 2.92Å; V214-M217 WeakPolarHBondContact O-CB 3.26Å; V214-M217 PolarHBondContact O-N 3.47Å; V214-L218 HydrophobicContact CG1-CD1 4.22Å; V214-L218 HydrophobicContact CG1-CG 4.49Å; V214-L218 WeakPolarHBondContact O-CG 3.37Å; V214-L218 PolarHBondContact O-N 3.22Å |
| 215 | G | 95.2 | Very high | 90.7 | Very high | 0 Ų | 0 | 16 Ų | 16 | 0% | 0 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -58.7 | -46.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112 | L89 G92 Y93 M211 V212 V213 M217 L218 G219 | L89-G215 WeakPolarHBondContact O-CA 3.4Å; G92-G215 CarbonylContact O-C 3.48Å; Y93-G215 VanDerWaalsContact CA-O 3.27Å; Y93-G215 WeakPolarHBondContact CA-O 3.28Å; Y93-G215 VanDerWaalsContact N-C 3.32Å; Y93-G215 PolarHBondContact N-O 3.25Å; M211-G215 PolarHBondContact O-N 2.84Å; V212-G215 WeakPolarHBondContact O-CA 3.46Å; V212-G215 PolarHBondContact O-N 2.68Å; V212-G215 VanDerWaalsContact O-N 3.13Å; V213-G215 VanDerWaalsContact C-N 3.29Å; V213-G215 PolarHBondContact O-N 3.23Å; G215-M217 VanDerWaalsContact C-N 3.31Å; G215-M217 PolarHBondContact O-N 2.97Å; G215-L218 PolarHBondContact O-N 2.83Å; G215-L218 VanDerWaalsContact O-N 3.16Å; G215-G219 PolarHBondContact O-N 3.26Å |
| 216 | V | 93.8 | Very high | 91.2 | Very high | 0 Ų | 0 | 16.1 Ų | 16.1 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -57.2 | -45.8 | 176.4 | 174.3 | 0 | 0 | 0 | 0 | 111.1 | G92 M95 V212 V213 V214 L218 G219 F220 K366 | G92-V216 VanDerWaalsContact C-N 3.3Å; G92-V216 WeakPolarHBondContact O-CA 3.22Å; G92-V216 WeakPolarHBondContact O-CG2 3.43Å; G92-V216 PolarHBondContact O-N 3.23Å; M95-V216 HydrophobicContact CB-CG2 4.22Å; V212-V216 WeakPolarHBondContact O-CG2 3.24Å; V212-V216 PolarHBondContact O-N 3.47Å; V213-V216 PolarHBondContact O-N 2.71Å; V214-V216 PolarHBondContact O-N 2.92Å; V216-L218 PolarHBondContact O-N 3.09Å; V216-G219 PolarHBondContact O-N 3.18Å; V216-F220 HydrophobicContact CG1-CD2 3.89Å; V216-F220 HydrophobicContact CG1-CE2 3.57Å; V216-F220 VanDerWaalsContact O-CD2 3.27Å; V216-F220 WeakPolarHBondContact O-CD2 3.46Å; V216-F220 PolarHBondContact O-N 3.18Å; V216-F220 VanDerWaalsContact O-N 3.15Å; V216-K366 HydrophobicContact CB-CD 4.37Å; V216-K366 HydrophobicContact CG1-CD 4.1Å; V216-K366 HydrophobicContact CG2-CD 4.39Å |
| 217 | M | 94.3 | Very high | 91.3 | Very high | 5 Ų | 5 | 15 Ų | 15 | 3% | 0.025 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -61 | -44 | 176.9 | -176.3 | -168.8 | 70.5 | 0 | 0 | 112.2 | A11 L14 V213 V214 G215 G219 S221 V364 V367 | A11-M217 HydrophobicContact CB-CE 4.18Å; L14-M217 HydrophobicContact CB-CE 4.48Å; L14-M217 HydrophobicContact CD2-CE 3.92Å; L14-M217 HydrophobicContact CD2-SD 3.85Å; V213-M217 PolarHBondContact O-N 3.23Å; V214-M217 WeakPolarHBondContact O-CB 3.26Å; V214-M217 PolarHBondContact O-N 3.47Å; G215-M217 VanDerWaalsContact C-N 3.31Å; G215-M217 PolarHBondContact O-N 2.97Å; M217-G219 VanDerWaalsContact C-N 3.35Å; M217-S221 WeakPolarHBondContact O-CB 3.48Å; M217-S221 PolarHBondContact O-N 2.99Å; M217-S221 PolarHBondContact O-OG 3.46Å; M217-V364 HydrophobicContact CG-CG2 4.37Å; M217-V364 HydrophobicContact SD-CG2 4.29Å; M217-V367 HydrophobicContact CB-CG2 4.14Å; M217-V367 HydrophobicContact SD-CG2 4.11Å |
| 218 | L | 94.8 | Very high | 91.3 | Very high | 29 Ų | 29 | 17.1 Ų | 17.1 | 15% | 0.152 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -64.6 | -38.9 | 176.2 | -69.8 | 173.8 | 0 | 0 | 0 | 111.9 | A11 L89 Y93 V214 G215 V216 S221 C222 | A11-L218 HydrophobicContact CB-CD2 3.72Å; L89-L218 HydrophobicContact CD1-CD1 3.91Å; Y93-L218 HydrophobicContact CD2-CB 4.11Å; V214-L218 HydrophobicContact CG1-CD1 4.22Å; V214-L218 HydrophobicContact CG1-CG 4.49Å; V214-L218 WeakPolarHBondContact O-CG 3.37Å; V214-L218 PolarHBondContact O-N 3.22Å; G215-L218 PolarHBondContact O-N 2.83Å; G215-L218 VanDerWaalsContact O-N 3.16Å; V216-L218 PolarHBondContact O-N 3.09Å; L218-S221 PolarHBondContact O-N 3.01Å; L218-C222 VanDerWaalsContact O-CB 3.29Å; L218-C222 WeakPolarHBondContact O-CB 3.49Å; L218-C222 PolarHBondContact O-N 2.87Å; L218-C222 PolarHBondContact O-SG 3.46Å |
| 219 | G | 93.9 | Very high | 91.2 | Very high | 0 Ų | 0 | 19 Ų | 19 | 0% | 0 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -57.4 | -49.6 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | G215 V216 M217 S223 | G215-G219 PolarHBondContact O-N 3.26Å; V216-G219 PolarHBondContact O-N 3.18Å; M217-G219 VanDerWaalsContact C-N 3.35Å; G219-S223 WeakPolarHBondContact O-CB 3.28Å; G219-S223 PolarHBondContact O-N 3.05Å; G219-S223 PolarHBondContact O-OG 3.11Å |
| 220 | F | 93.3 | Very high | 91.1 | Very high | 0 Ų | 0 | 21.3 Ų | 21.3 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -64.7 | -43.6 | 174.4 | -71.6 | -64.3 | 0 | 0 | 0 | 112.5 | G96 V216 C222 S223 Y224 L337 A340 T360 F362 | G96-F220 WeakPolarHBondContact O-CD1 3.29Å; V216-F220 HydrophobicContact CG1-CD2 3.89Å; V216-F220 HydrophobicContact CG1-CE2 3.57Å; V216-F220 VanDerWaalsContact O-CD2 3.27Å; V216-F220 WeakPolarHBondContact O-CD2 3.46Å; V216-F220 PolarHBondContact O-N 3.18Å; V216-F220 VanDerWaalsContact O-N 3.15Å; F220-C222 PolarHBondContact O-N 2.83Å; F220-S223 WeakPolarHBondContact O-CB 3.38Å; F220-S223 PolarHBondContact O-N 3.41Å; F220-Y224 PolarHBondContact O-N 3.44Å; F220-L337 HydrophobicContact CZ-CD2 4.45Å; F220-A340 HydrophobicContact CE1-CB 4.05Å; F220-A340 HydrophobicContact CZ-CB 4.28Å; F220-T360 PolarHBondContact O-OG1 3.49Å; F220-F362 HydrophobicContact CE2-CB 4.15Å; F220-F362 HydrophobicContact CZ-CB 4.46Å |
| 221 | S | 93.3 | Very high | 91 | Very high | 4 Ų | 4 | 26.5 Ų | 26.5 | 3% | 0.028 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -63.6 | -43.1 | -178.8 | -56.7 | 0 | 0 | 0 | 0 | 112.3 | M217 L218 Y224 A225 T360 | M217-S221 WeakPolarHBondContact O-CB 3.48Å; M217-S221 PolarHBondContact O-N 2.99Å; M217-S221 PolarHBondContact O-OG 3.46Å; L218-S221 PolarHBondContact O-N 3.01Å; S221-Y224 PolarHBondContact O-N 3.22Å; S221-A225 WeakPolarHBondContact O-CB 3.36Å; S221-A225 PolarHBondContact O-N 3.12Å; S221-T360 WeakPolarHBondContact OG-CG2 3.29Å |
| 222 | C | 92.8 | Very high | 90.8 | Very high | 8 Ų | 8 | 26.1 Ų | 26.1 | 5% | 0.054 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -68.5 | -40.4 | 177.5 | -70.6 | 0 | 0 | 0 | 0 | 110.8 | Y93 L218 F220 Y224 A225 F226 L239 | Y93-C222 HydrophobicContact CE2-CB 3.97Å; L218-C222 VanDerWaalsContact O-CB 3.29Å; L218-C222 WeakPolarHBondContact O-CB 3.49Å; L218-C222 PolarHBondContact O-N 2.87Å; L218-C222 PolarHBondContact O-SG 3.46Å; F220-C222 PolarHBondContact O-N 2.83Å; C222-Y224 VanDerWaalsContact C-N 3.28Å; C222-Y224 PolarHBondContact O-N 3.37Å; C222-A225 PolarHBondContact O-N 3.3Å; C222-A225 VanDerWaalsContact O-N 3.12Å; C222-F226 HydrophobicContact CB-CE2 4.47Å; C222-F226 WeakPolarHBondContact O-CD2 3.4Å; C222-F226 PolarHBondContact O-N 3.43Å; C222-L239 HydrophobicContact CB-CD1 4.13Å |
| 223 | S | 91.1 | Very high | 90.7 | Very high | 0 Ų | 0 | 26.3 Ų | 26.3 | 0% | 0 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -55.9 | -46.2 | 174.7 | -60.1 | 0 | 0 | 0 | 0 | 111.1 | L97 G219 F220 F226 T227 | L97-S223 WeakPolarHBondContact CA-OG 3.32Å; G219-S223 WeakPolarHBondContact O-CB 3.28Å; G219-S223 PolarHBondContact O-N 3.05Å; G219-S223 PolarHBondContact O-OG 3.11Å; F220-S223 WeakPolarHBondContact O-CB 3.38Å; F220-S223 PolarHBondContact O-N 3.41Å; S223-F226 PolarHBondContact O-N 2.9Å; S223-T227 PolarHBondContact O-N 3.44Å; S223-T227 VanDerWaalsContact O-N 3.12Å; S223-T227 PolarHBondContact O-OG1 2.98Å |
| 224 | Y | 91.6 | Very high | 90.8 | Very high | 31 Ų | 31 | 27 Ų | 27 | 12% | 0.122 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -61.2 | -48.2 | 174.4 | 171.5 | -112.3 | 0 | 0 | 0 | 112 | N4 V7 F220 S221 C222 F226 T227 L357 | N4-Y224 PolarHBondContact OD1-OH 3.14Å; V7-Y224 HydrophobicContact CG1-CD1 4.43Å; V7-Y224 HydrophobicContact CG2-CE1 4.11Å; F220-Y224 PolarHBondContact O-N 3.44Å; S221-Y224 PolarHBondContact O-N 3.22Å; C222-Y224 VanDerWaalsContact C-N 3.28Å; C222-Y224 PolarHBondContact O-N 3.37Å; Y224-F226 PolarHBondContact O-N 3.34Å; Y224-F226 VanDerWaalsContact O-N 3.16Å; Y224-T227 PolarHBondContact O-N 2.93Å; Y224-T227 VanDerWaalsContact O-N 3.07Å; Y224-T227 PolarHBondContact O-OG1 3.46Å; Y224-L357 HydrophobicContact CD1-CD1 4.13Å; Y224-L357 HydrophobicContact CD2-CB 3.83Å; Y224-L357 HydrophobicContact CD2-CD1 4.42Å; Y224-L357 HydrophobicContact CE1-CD1 3.9Å; Y224-L357 HydrophobicContact CE2-CB 3.75Å; Y224-L357 HydrophobicContact CE2-CD1 4.22Å; Y224-L357 HydrophobicContact CE2-CD2 4.5Å; Y224-L357 HydrophobicContact CE2-CG 4.37Å; Y224-L357 HydrophobicContact CG-CB 4.45Å; Y224-L357 HydrophobicContact CG-CD1 4.37Å |
| 225 | A | 91.2 | Very high | 90.8 | Very high | 13 Ų | 13 | 33.5 Ų | 33.5 | 11% | 0.107 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -58.5 | -32.4 | -176.9 | 0 | 0 | 0 | 0 | 0 | 113.6 | S221 C222 | S221-A225 WeakPolarHBondContact O-CB 3.36Å; S221-A225 PolarHBondContact O-N 3.12Å; C222-A225 PolarHBondContact O-N 3.3Å; C222-A225 VanDerWaalsContact O-N 3.12Å |
| 226 | F | 90.4 | Very high | 90.7 | Very high | 50 Ų | 50 | 33.5 Ų | 33.5 | 22% | 0.219 | 18% | 0.176 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -101.3 | 4.8 | 178.8 | -61.6 | -70.5 | 0 | 0 | 0 | 114.2 | C222 S223 Y224 T228 T229 G232 Y235 L239 | C222-F226 HydrophobicContact CB-CE2 4.47Å; C222-F226 WeakPolarHBondContact O-CD2 3.4Å; C222-F226 PolarHBondContact O-N 3.43Å; S223-F226 PolarHBondContact O-N 2.9Å; Y224-F226 PolarHBondContact O-N 3.34Å; Y224-F226 VanDerWaalsContact O-N 3.16Å; F226-T228 VanDerWaalsContact C-N 3.29Å; F226-T228 PolarHBondContact O-N 2.79Å; F226-T229 PolarHBondContact O-N 2.79Å; F226-G232 WeakPolarHBondContact O-CA 3.26Å; F226-Y235 HydrophobicContact CD1-CG 4.4Å; F226-Y235 HydrophobicContact CE1-CG 4.42Å; F226-L239 HydrophobicContact CD2-CD1 4.44Å; F226-L239 HydrophobicContact CE2-CD1 3.45Å; F226-L239 VanDerWaalsContact CE2-CD1 3.45Å; F226-L239 HydrophobicContact CE2-CG 4.48Å; F226-L239 HydrophobicContact CZ-CD1 4.04Å |
| 227 | T | 85.9 | Confident | 90.7 | Very high | 24 Ų | 24 | 33.5 Ų | 33.5 | 15% | 0.147 | 18% | 0.176 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -62.6 | -36.9 | -179.5 | -60.4 | 0 | 0 | 0 | 0 | 112.1 | S223 Y224 T229 D352 D353 | S223-T227 PolarHBondContact O-N 3.44Å; S223-T227 VanDerWaalsContact O-N 3.12Å; S223-T227 PolarHBondContact O-OG1 2.98Å; Y224-T227 PolarHBondContact O-N 2.93Å; Y224-T227 VanDerWaalsContact O-N 3.07Å; Y224-T227 PolarHBondContact O-OG1 3.46Å; T227-T229 VanDerWaalsContact C-N 3.32Å; T227-T229 PolarHBondContact O-N 3.09Å; T227-D352 HydrophobicContact CG2-CB 4.31Å; T227-D353 WeakPolarHBondContact CB-OD1 3.45Å; T227-D353 WeakPolarHBondContact CG2-OD1 3.44Å |
| 228 | T | 83.8 | Confident | 90.7 | Very high | 78 Ų | 78 | 34.2 Ų | 34.2 | 48% | 0.479 | 19% | 0.185 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -84.1 | -4.2 | 179.3 | 60.5 | 0 | 0 | 0 | 0 | 114.1 | N4 F226 D353 | N4-T228 PolarHBondContact ND2-OG1 2.77Å; F226-T228 VanDerWaalsContact C-N 3.29Å; F226-T228 PolarHBondContact O-N 2.79Å; T228-D353 WeakPolarHBondContact CG2-OD1 3.4Å |
| 229 | T | 87.6 | Confident | 90.7 | Very high | 54 Ų | 54 | 36.1 Ų | 36.1 | 33% | 0.331 | 20% | 0.195 | S | C | . | . | S | Bend | trans | -95 | 132.7 | -172.5 | -56.7 | 0 | 0 | 0 | 0 | 110 | F226 T227 H231 G232 Y235 | F226-T229 PolarHBondContact O-N 2.79Å; T227-T229 VanDerWaalsContact C-N 3.32Å; T227-T229 PolarHBondContact O-N 3.09Å; T229-H231 PolarHBondContact O-N 3.42Å; T229-G232 WeakPolarHBondContact O-CA 3.33Å; T229-G232 PolarHBondContact O-N 2.82Å; T229-Y235 HydrophobicContact CG2-CE2 4.41Å |
| 230 | P | 84.1 | Confident | 90.7 | Very high | 106 Ų | 106 | 36.1 Ų | 36.1 | 69% | 0.688 | 20% | 0.195 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -55.6 | 132.4 | 172 | -23.6 | 33.2 | 0 | 0 | 0 | 110.8 | G232 | P230-G232 PolarHBondContact O-N 3.4Š|
| 231 | H | 85.4 | Confident | 90.9 | Very high | 133 Ų | 133 | 38.1 Ų | 38.1 | 62% | 0.616 | 21% | 0.205 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 56.7 | 28.6 | -173.7 | -55.9 | 79 | 0 | 0 | 0 | 113.9 | T229 W233 A234 | T229-H231 PolarHBondContact O-N 3.42Å; H231-W233 PolarHBondContact O-N 3.28Å; H231-A234 WeakPolarHBondContact O-CB 3.42Å; H231-A234 PolarHBondContact O-N 3.44Å; H231-A234 VanDerWaalsContact O-N 3.07Å |
| 232 | G | 88.1 | Confident | 91 | Very high | 1 Ų | 1 | 41.6 Ų | 41.6 | 1% | 0.01 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -54.5 | -32.6 | 179.3 | 0 | 0 | 0 | 0 | 0 | 115 | F226 T229 P230 A234 Y235 T236 | F226-G232 WeakPolarHBondContact O-CA 3.26Å; T229-G232 WeakPolarHBondContact O-CA 3.33Å; T229-G232 PolarHBondContact O-N 2.82Å; P230-G232 PolarHBondContact O-N 3.4Å; G232-A234 VanDerWaalsContact C-N 3.27Å; G232-A234 PolarHBondContact O-N 3.32Å; G232-Y235 PolarHBondContact O-N 3.44Å; G232-T236 PolarHBondContact O-N 3.2Å; G232-T236 PolarHBondContact O-OG1 2.54Å |
| 233 | W | 90.4 | Very high | 91.1 | Very high | 15 Ų | 15 | 42.5 Ų | 42.5 | 6% | 0.057 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -58.5 | -37.3 | 176.7 | 60.6 | -95.6 | 0 | 0 | 0 | 112.3 | V101 Q104 L105 L161 T165 H231 T236 F237 | V101-W233 HydrophobicContact CG1-CB 4.04Å; Q104-W233 HydrophobicContact CB-CB 4.35Å; L105-W233 HydrophobicContact CD2-CD2 3.97Å; L105-W233 HydrophobicContact CD2-CE3 4.19Å; L105-W233 HydrophobicContact CD2-CG 4.11Å; L161-W233 WeakPolarHBondContact O-CZ3 3.29Å; T165-W233 HydrophobicContact CG2-CH2 3.5Å; T165-W233 VanDerWaalsContact CG2-CH2 3.5Å; T165-W233 HydrophobicContact CG2-CZ2 3.55Å; H231-W233 PolarHBondContact O-N 3.28Å; W233-T236 PolarHBondContact O-N 2.94Å; W233-F237 HydrophobicContact CE3-CD2 4.06Å; W233-F237 HydrophobicContact CE3-CE2 4.28Å; W233-F237 VanDerWaalsContact O-CD2 3.31Å; W233-F237 WeakPolarHBondContact O-CD2 3.42Å; W233-F237 PolarHBondContact O-N 3.46Å |
| 234 | A | 92.8 | Very high | 91.2 | Very high | 16 Ų | 16 | 42.5 Ų | 42.5 | 13% | 0.132 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -69.1 | -42.3 | 179.9 | 0 | 0 | 0 | 0 | 0 | 111.3 | V162 H231 G232 T236 F237 G238 | V162-A234 HydrophobicContact CG1-CB 4.32Å; V162-A234 WeakPolarHBondContact CG2-O 3.49Å; H231-A234 WeakPolarHBondContact O-CB 3.42Å; H231-A234 PolarHBondContact O-N 3.44Å; H231-A234 VanDerWaalsContact O-N 3.07Å; G232-A234 VanDerWaalsContact C-N 3.27Å; G232-A234 PolarHBondContact O-N 3.32Å; A234-T236 VanDerWaalsContact C-N 3.31Å; A234-T236 PolarHBondContact O-N 2.97Å; A234-F237 PolarHBondContact O-N 2.92Å; A234-G238 PolarHBondContact O-N 3.35Å |
| 235 | Y | 92.6 | Very high | 91.4 | Very high | 136 Ų | 136 | 45 Ų | 45 | 53% | 0.533 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -64.1 | -38.9 | 173.4 | -65.5 | -70.5 | 0 | 0 | 0 | 111.9 | F226 T229 G232 F237 G238 L239 | F226-Y235 HydrophobicContact CD1-CG 4.4Å; F226-Y235 HydrophobicContact CE1-CG 4.42Å; T229-Y235 HydrophobicContact CG2-CE2 4.41Å; G232-Y235 PolarHBondContact O-N 3.44Å; Y235-F237 PolarHBondContact O-N 3.35Å; Y235-G238 PolarHBondContact O-N 2.99Å; Y235-L239 WeakPolarHBondContact O-CG 3.45Å; Y235-L239 PolarHBondContact O-N 3.33Å; Y235-L239 VanDerWaalsContact O-N 3.11Å |
| 236 | T | 93.1 | Very high | 91.5 | Very high | 0 Ų | 0 | 49.9 Ų | 49.9 | 0% | 0 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -63 | -42.3 | 178.4 | -52.2 | 0 | 0 | 0 | 0 | 110.9 | Y93 L97 V101 G232 W233 A234 | Y93-T236 VanDerWaalsContact CE1-O 3.29Å; Y93-T236 WeakPolarHBondContact CE1-O 3.31Å; Y93-T236 PolarHBondContact OH-O 2.88Å; L97-T236 HydrophobicContact CB-CG2 3.87Å; V101-T236 HydrophobicContact CG2-CG2 3.67Å; G232-T236 PolarHBondContact O-N 3.2Å; G232-T236 PolarHBondContact O-OG1 2.54Å; W233-T236 PolarHBondContact O-N 2.94Å; A234-T236 VanDerWaalsContact C-N 3.31Å; A234-T236 PolarHBondContact O-N 2.97Å |
| 237 | F | 94.4 | Very high | 91.7 | Very high | 0 Ų | 0 | 47.5 Ų | 47.5 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -66 | -47.4 | 170.3 | -76 | -55.7 | 0 | 0 | 0 | 112.6 | L97 V101 L105 T158 L161 V162 R174 W233 A234 Y235 L239 V240 | L97-F237 HydrophobicContact CD1-CD1 3.66Å; L97-F237 HydrophobicContact CD1-CE1 3.4Å; L97-F237 VanDerWaalsContact CD1-CE1 3.4Å; L97-F237 HydrophobicContact CD1-CZ 4.27Å; V101-F237 HydrophobicContact CG1-CD2 4.44Å; V101-F237 HydrophobicContact CG1-CE2 3.58Å; V101-F237 HydrophobicContact CG1-CZ 3.64Å; L105-F237 HydrophobicContact CD1-CE2 4.37Å; T158-F237 HydrophobicContact CG2-CB 4.34Å; T158-F237 VanDerWaalsContact CG2-O 3.25Å; T158-F237 WeakPolarHBondContact CG2-O 3.2Å; L161-F237 HydrophobicContact CB-CD2 4.29Å; L161-F237 HydrophobicContact CB-CG 4.26Å; L161-F237 HydrophobicContact CD1-CD1 3.73Å; L161-F237 HydrophobicContact CD1-CE1 3.83Å; L161-F237 HydrophobicContact CD1-CG 4.2Å; L161-F237 HydrophobicContact CD1-CZ 4.39Å; V162-F237 HydrophobicContact CG2-CB 4.04Å; R174-F237 VanDerWaalsContact NH1-CE1 3.29Å; W233-F237 HydrophobicContact CE3-CD2 4.06Å; W233-F237 HydrophobicContact CE3-CE2 4.28Å; W233-F237 VanDerWaalsContact O-CD2 3.31Å; W233-F237 WeakPolarHBondContact O-CD2 3.42Å; W233-F237 PolarHBondContact O-N 3.46Å; A234-F237 PolarHBondContact O-N 2.92Å; Y235-F237 PolarHBondContact O-N 3.35Å; F237-L239 PolarHBondContact O-N 3.03Å; F237-L239 VanDerWaalsContact O-N 3.15Å; F237-V240 WeakPolarHBondContact O-CG1 3.26Å; F237-V240 PolarHBondContact O-N 2.89Å |
| 238 | G | 94.2 | Very high | 92 | Very high | 20 Ų | 20 | 49.1 Ų | 49.1 | 21% | 0.206 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -62.3 | -24.8 | -173.1 | 0 | 0 | 0 | 0 | 0 | 115.2 | A234 Y235 V240 I241 | A234-G238 PolarHBondContact O-N 3.35Å; Y235-G238 PolarHBondContact O-N 2.99Å; G238-V240 PolarHBondContact O-N 3.48Å; G238-V240 VanDerWaalsContact O-N 3.13Å; G238-I241 WeakPolarHBondContact O-CB 3.33Å; G238-I241 WeakPolarHBondContact O-CG1 3.46Å; G238-I241 PolarHBondContact O-N 3.15Å |
| 239 | L | 94.6 | Very high | 92.4 | Very high | 69 Ų | 69 | 46.8 Ų | 46.8 | 36% | 0.361 | 26% | 0.26 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.9 | -11.8 | -179.1 | -83.8 | -180 | 0 | 0 | 0 | 115.2 | Y93 C222 F226 Y235 F237 I241 P242 P243 | Y93-L239 HydrophobicContact CE1-CB 4.39Å; Y93-L239 WeakPolarHBondContact OH-CB 3.46Å; C222-L239 HydrophobicContact CB-CD1 4.13Å; F226-L239 HydrophobicContact CD2-CD1 4.44Å; F226-L239 HydrophobicContact CE2-CD1 3.45Å; F226-L239 VanDerWaalsContact CE2-CD1 3.45Å; F226-L239 HydrophobicContact CE2-CG 4.48Å; F226-L239 HydrophobicContact CZ-CD1 4.04Å; Y235-L239 WeakPolarHBondContact O-CG 3.45Å; Y235-L239 PolarHBondContact O-N 3.33Å; Y235-L239 VanDerWaalsContact O-N 3.11Å; F237-L239 PolarHBondContact O-N 3.03Å; F237-L239 VanDerWaalsContact O-N 3.15Å; L239-I241 VanDerWaalsContact C-N 3.31Å; L239-P242 WeakPolarHBondContact O-CD 3.34Å; L239-P243 VanDerWaalsContact O-CD 3.3Å; L239-P243 WeakPolarHBondContact O-CD 3.27Å |
| 240 | V | 95.1 | Very high | 92.7 | Very high | 1 Ų | 1 | 45.7 Ų | 45.7 | 1% | 0.006 | 26% | 0.256 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.6 | -17.4 | 172 | 79.6 | 0 | 0 | 0 | 0 | 112.6 | M90 Y93 V154 T158 F237 G238 P243 A244 | M90-V240 HydrophobicContact CB-CG2 4.06Å; M90-V240 HydrophobicContact CE-CG2 4.34Å; M90-V240 HydrophobicContact CG-CG2 4Å; Y93-V240 HydrophobicContact CD1-CB 3.95Å; Y93-V240 HydrophobicContact CD1-CG2 4.16Å; Y93-V240 HydrophobicContact CE1-CB 4.17Å; V154-V240 HydrophobicContact CG1-CG1 3.99Å; V154-V240 HydrophobicContact CG1-CG2 4.09Å; T158-V240 HydrophobicContact CG2-CG1 3.85Å; T158-V240 VanDerWaalsContact OG1-CG1 3.23Å; T158-V240 WeakPolarHBondContact OG1-CG1 3.27Å; F237-V240 WeakPolarHBondContact O-CG1 3.26Å; F237-V240 PolarHBondContact O-N 2.89Å; G238-V240 PolarHBondContact O-N 3.48Å; G238-V240 VanDerWaalsContact O-N 3.13Å; V240-P243 VanDerWaalsContact O-CD 3.26Å; V240-P243 WeakPolarHBondContact O-CD 3.35Å; V240-P243 VanDerWaalsContact O-CG 3.27Å; V240-P243 WeakPolarHBondContact O-CG 3.34Å; V240-A244 WeakPolarHBondContact O-CB 3.36Å; V240-A244 PolarHBondContact O-N 3.13Å |
| 241 | I | 95.9 | Very high | 93 | Very high | 41 Ų | 41 | 40.7 Ų | 40.7 | 21% | 0.21 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -64.8 | -49.4 | -178.3 | -63.5 | 170.1 | 0 | 0 | 0 | 112 | V155 T158 I159 G238 L239 A244 L245 | V155-I241 HydrophobicContact CG2-CG2 4.48Å; T158-I241 HydrophobicContact CG2-CD1 3.96Å; T158-I241 HydrophobicContact CG2-CG1 3.88Å; I159-I241 HydrophobicContact CG1-CD1 4.49Å; G238-I241 WeakPolarHBondContact O-CB 3.33Å; G238-I241 WeakPolarHBondContact O-CG1 3.46Å; G238-I241 PolarHBondContact O-N 3.15Å; L239-I241 VanDerWaalsContact C-N 3.31Å; I241-A244 WeakPolarHBondContact O-CB 3.5Å; I241-A244 PolarHBondContact O-N 2.98Å; I241-A244 VanDerWaalsContact O-N 3.15Å; I241-L245 HydrophobicContact CG2-CD1 3.74Å; I241-L245 HydrophobicContact CG2-CG 3.98Å; I241-L245 WeakPolarHBondContact O-CG 3.26Å; I241-L245 PolarHBondContact O-N 3.49Å |
| 242 | P | 95.4 | Very high | 93.2 | Very high | 77 Ų | 77 | 39 Ų | 39 | 50% | 0.5 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -55 | -50.1 | 178.4 | -24.8 | 33.4 | 0 | 0 | 0 | 115 | L239 A244 L245 L246 | L239-P242 WeakPolarHBondContact O-CD 3.34Å; P242-A244 VanDerWaalsContact C-N 3.3Å; P242-A244 PolarHBondContact O-N 3.45Å; P242-L245 PolarHBondContact O-N 3.35Å; P242-L246 WeakPolarHBondContact O-CB 3.32Å; P242-L246 PolarHBondContact O-N 3Å |
| 243 | P | 94.4 | Very high | 93.2 | Very high | 27 Ų | 27 | 47.4 Ų | 47.4 | 18% | 0.175 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -64.8 | -33.2 | 176.3 | 23.3 | -30.9 | 0 | 0 | 0 | 112.6 | L89 M90 L239 V240 L246 Q247 | L89-P243 HydrophobicContact CD2-CB 4.45Å; M90-P243 HydrophobicContact CG-CB 4.38Å; M90-P243 HydrophobicContact CG-CG 4.41Å; L239-P243 VanDerWaalsContact O-CD 3.3Å; L239-P243 WeakPolarHBondContact O-CD 3.27Å; V240-P243 VanDerWaalsContact O-CD 3.26Å; V240-P243 WeakPolarHBondContact O-CD 3.35Å; V240-P243 VanDerWaalsContact O-CG 3.27Å; V240-P243 WeakPolarHBondContact O-CG 3.34Å; P243-L246 PolarHBondContact O-N 3.48Å; P243-Q247 WeakPolarHBondContact O-CB 3.27Å; P243-Q247 PolarHBondContact O-N 3.48Å |
| 244 | A | 94.9 | Very high | 93.2 | Very high | 0 Ų | 0 | 47.1 Ų | 47.1 | 0% | 0 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -64.1 | -45.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.5 | M90 V155 V240 I241 P242 Q247 M248 | M90-A244 HydrophobicContact CE-CB 3.43Å; M90-A244 VanDerWaalsContact CE-CB 3.43Å; M90-A244 HydrophobicContact SD-CB 4.01Å; V155-A244 HydrophobicContact CG2-CB 3.65Å; V240-A244 WeakPolarHBondContact O-CB 3.36Å; V240-A244 PolarHBondContact O-N 3.13Å; I241-A244 WeakPolarHBondContact O-CB 3.5Å; I241-A244 PolarHBondContact O-N 2.98Å; I241-A244 VanDerWaalsContact O-N 3.15Å; P242-A244 VanDerWaalsContact C-N 3.3Å; P242-A244 PolarHBondContact O-N 3.45Å; A244-Q247 PolarHBondContact O-N 2.91Å; A244-M248 WeakPolarHBondContact O-CB 3.42Å; A244-M248 PolarHBondContact O-N 2.64Å |
| 245 | L | 95.1 | Very high | 92.9 | Very high | 83 Ų | 83 | 47.1 Ų | 47.1 | 44% | 0.435 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -65.9 | -39.7 | 176.8 | -67.5 | 179.8 | 0 | 0 | 0 | 111.7 | V155 I241 P242 M248 G249 | V155-L245 HydrophobicContact CG2-CD2 4.16Å; I241-L245 HydrophobicContact CG2-CD1 3.74Å; I241-L245 HydrophobicContact CG2-CG 3.98Å; I241-L245 WeakPolarHBondContact O-CG 3.26Å; I241-L245 PolarHBondContact O-N 3.49Å; P242-L245 PolarHBondContact O-N 3.35Å; L245-M248 HydrophobicContact CD2-CE 3.57Å; L245-M248 PolarHBondContact O-N 3.44Å; L245-G249 PolarHBondContact O-N 3.02Å |
| 246 | L | 94.1 | Very high | 92.8 | Very high | 116 Ų | 116 | 42.6 Ų | 42.6 | 61% | 0.607 | 24% | 0.241 | S | C | * | . | H | α-helix | trans | -62.2 | -46.4 | 175.7 | 177.9 | 59.7 | 0 | 0 | 0 | 111.4 | L86 P242 P243 G249 A250 | L86-L246 HydrophobicContact CD2-CB 4.26Å; L86-L246 HydrophobicContact CD2-CD2 3.88Å; L86-L246 HydrophobicContact CD2-CG 3.98Å; P242-L246 WeakPolarHBondContact O-CB 3.32Å; P242-L246 PolarHBondContact O-N 3Å; P243-L246 PolarHBondContact O-N 3.48Å; L246-G249 PolarHBondContact O-N 3.18Å; L246-A250 WeakPolarHBondContact O-CB 3.29Å; L246-A250 PolarHBondContact O-N 3.27Å |
| 247 | Q | 93.4 | Very high | 92.7 | Very high | 0 Ų | 0 | 42.6 Ų | 42.6 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -59.5 | -47.3 | 174.4 | 173.5 | 178.6 | -45.2 | 0 | 0 | 111 | L86 S87 P243 A244 G249 A250 L251 | L86-Q247 HydrophobicContact CB-CB 4.21Å; L86-Q247 HydrophobicContact CD2-CB 4.2Å; S87-Q247 PolarHBondContact OG-NE2 2.68Å; S87-Q247 PolarHBondContact OG-OE1 3.44Å; P243-Q247 WeakPolarHBondContact O-CB 3.27Å; P243-Q247 PolarHBondContact O-N 3.48Å; A244-Q247 PolarHBondContact O-N 2.91Å; Q247-G249 PolarHBondContact O-N 2.9Å; Q247-A250 PolarHBondContact O-N 3.39Å; Q247-L251 HydrophobicContact CG-CD1 3.64Å; Q247-L251 HydrophobicContact CG-CG 4.34Å; Q247-L251 WeakPolarHBondContact O-CB 3.24Å; Q247-L251 VanDerWaalsContact O-CG 3.27Å; Q247-L251 WeakPolarHBondContact O-CG 3.4Å; Q247-L251 PolarHBondContact O-N 2.98Å |
| 248 | M | 92.4 | Very high | 92.5 | Very high | 59 Ų | 59 | 42.6 Ų | 42.6 | 29% | 0.291 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -59.2 | -48 | 179.4 | -173 | 169 | 63.4 | 0 | 0 | 111.2 | L148 A151 A244 L245 L251 L252 | L148-M248 HydrophobicContact CD2-CB 4.45Å; L148-M248 HydrophobicContact CD2-CG 3.75Å; L148-M248 WeakPolarHBondContact CD2-O 3.28Å; A151-M248 HydrophobicContact CB-CB 4.11Å; A244-M248 WeakPolarHBondContact O-CB 3.42Å; A244-M248 PolarHBondContact O-N 2.64Å; L245-M248 HydrophobicContact CD2-CE 3.57Å; L245-M248 PolarHBondContact O-N 3.44Å; M248-L251 PolarHBondContact O-N 2.93Å; M248-L252 WeakPolarHBondContact O-CG 3.47Å; M248-L252 PolarHBondContact O-N 3.05Å |
| 249 | G | 93.4 | Very high | 92.3 | Very high | 29 Ų | 29 | 44.4 Ų | 44.4 | 30% | 0.299 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -60.4 | -45.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | L245 L246 Q247 L251 L252 F253 | L245-G249 PolarHBondContact O-N 3.02Å; L246-G249 PolarHBondContact O-N 3.18Å; Q247-G249 PolarHBondContact O-N 2.9Å; G249-L251 PolarHBondContact O-N 2.95Å; G249-L252 PolarHBondContact O-N 2.71Å; G249-F253 WeakPolarHBondContact O-CD2 3.48Å; G249-F253 WeakPolarHBondContact O-CE2 3.48Å |
| 250 | A | 91.9 | Very high | 92 | Very high | 31 Ų | 31 | 42.3 Ų | 42.3 | 26% | 0.256 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -61.7 | -42.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | L246 Q247 L252 F253 L254 | L246-A250 WeakPolarHBondContact O-CB 3.29Å; L246-A250 PolarHBondContact O-N 3.27Å; Q247-A250 PolarHBondContact O-N 3.39Å; A250-L252 VanDerWaalsContact C-N 3.25Å; A250-L252 PolarHBondContact O-N 3.19Å; A250-F253 PolarHBondContact O-N 2.87Å; A250-L254 WeakPolarHBondContact O-CG 3.26Å; A250-L254 PolarHBondContact O-N 3.39Å |
| 251 | L | 90.4 | Very high | 91.8 | Very high | 0 Ų | 0 | 42.9 Ų | 42.9 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -70.3 | -17.6 | -178.7 | -71.2 | 169.1 | 0 | 0 | 0 | 113.9 | R144 L147 L148 Q247 M248 G249 F253 L254 | R144-L251 VanDerWaalsContact CZ-O 3.31Å; R144-L251 PolarHBondContact NE-O 3.39Å; R144-L251 PolarHBondContact NH2-O 2.95Å; L147-L251 HydrophobicContact CB-CD1 3.44Å; L147-L251 VanDerWaalsContact CB-CD1 3.44Å; L147-L251 HydrophobicContact CD1-CD1 4.11Å; L147-L251 HydrophobicContact CD1-CD2 3.99Å; L147-L251 HydrophobicContact CG-CD1 4.32Å; L148-L251 HydrophobicContact CD2-CB 3.86Å; L148-L251 HydrophobicContact CG-CB 4.3Å; Q247-L251 HydrophobicContact CG-CD1 3.64Å; Q247-L251 HydrophobicContact CG-CG 4.34Å; Q247-L251 WeakPolarHBondContact O-CB 3.24Å; Q247-L251 VanDerWaalsContact O-CG 3.27Å; Q247-L251 WeakPolarHBondContact O-CG 3.4Å; Q247-L251 PolarHBondContact O-N 2.98Å; M248-L251 PolarHBondContact O-N 2.93Å; G249-L251 PolarHBondContact O-N 2.95Å; L251-F253 VanDerWaalsContact C-N 3.27Å; L251-F253 PolarHBondContact O-N 3.47Å; L251-L254 HydrophobicContact CD2-CD1 4.09Å |
| 252 | L | 90.1 | Very high | 91.5 | Very high | 97 Ų | 97 | 41.7 Ų | 41.7 | 51% | 0.508 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -67 | -30.8 | 172.2 | -68.8 | 174.4 | 0 | 0 | 0 | 112.2 | R144 L148 M248 G249 A250 | R144-L252 PolarHBondContact NH2-O 2.94Å; L148-L252 HydrophobicContact CD1-CD2 4.12Å; L148-L252 HydrophobicContact CD2-CD2 4.14Å; L148-L252 HydrophobicContact CD2-CG 4.37Å; M248-L252 WeakPolarHBondContact O-CG 3.47Å; M248-L252 PolarHBondContact O-N 3.05Å; G249-L252 PolarHBondContact O-N 2.71Å; A250-L252 VanDerWaalsContact C-N 3.25Å; A250-L252 PolarHBondContact O-N 3.19Å |
| 253 | F | 89.4 | Confident | 91 | Very high | 179 Ų | 179 | 41.4 Ų | 41.4 | 79% | 0.785 | 22% | 0.224 | S | C | * | . | H | α-helix | trans | -92.7 | -13 | -179.1 | -59.8 | -72.7 | 0 | 0 | 0 | 113.8 | G249 A250 L251 | G249-F253 WeakPolarHBondContact O-CD2 3.48Å; G249-F253 WeakPolarHBondContact O-CE2 3.48Å; A250-F253 PolarHBondContact O-N 2.87Å; L251-F253 VanDerWaalsContact C-N 3.27Å; L251-F253 PolarHBondContact O-N 3.47Å |
| 254 | L | 88.6 | Confident | 90.7 | Very high | 8 Ų | 8 | 44.6 Ų | 44.6 | 4% | 0.042 | 24% | 0.237 | C | C | . | . | S | Bend | trans | -87.4 | 144.5 | -175.6 | -72.9 | 167.5 | 0 | 0 | 0 | 112.9 | L76 A80 S83 R144 A250 L251 | L76-L254 HydrophobicContact CD1-CD2 4.06Å; A80-L254 HydrophobicContact CB-CD1 4.25Å; A80-L254 HydrophobicContact CB-CD2 3.79Å; S83-L254 WeakPolarHBondContact OG-CD1 3.3Å; R144-L254 WeakPolarHBondContact CD-O 3.46Å; R144-L254 VanDerWaalsContact CZ-O 3.29Å; R144-L254 PolarHBondContact NE-O 2.73Å; R144-L254 PolarHBondContact NH1-O 3.4Å; A250-L254 WeakPolarHBondContact O-CG 3.26Å; A250-L254 PolarHBondContact O-N 3.39Å; L251-L254 HydrophobicContact CD2-CD1 4.09Å |
| 255 | P | 88 | Confident | 90.4 | Very high | 16 Ų | 16 | 47.4 Ų | 47.4 | 10% | 0.104 | 27% | 0.265 | C | S | . | . | P | Polyproline II helix | trans | -72.3 | 154.4 | -179.5 | 30.5 | -34.7 | 0 | 0 | 0 | 112 | Y191 V273 M277 | Y191-P255 PolarHBondContact OH-O 3.48Å; P255-V273 HydrophobicContact CB-CG1 3.7Å; P255-V273 HydrophobicContact CB-CG2 4.34Å; P255-V273 HydrophobicContact CG-CG1 4.11Å; P255-M277 HydrophobicContact CG-CE 4.44Å; P255-M277 HydrophobicContact CG-CG 4.36Å; P255-M277 HydrophobicContact CG-SD 4.23Å |
| 256 | P | 90.9 | Very high | 90.2 | Very high | 41 Ų | 41 | 48.4 Ų | 48.4 | 27% | 0.266 | 27% | 0.266 | S | S | . | . | P | Polyproline II helix | trans | -65.2 | 160.8 | 170.3 | 30.6 | -35.8 | 0 | 0 | 0 | 111.2 | L261 | P256-L261 HydrophobicContact CG-CD1 4.01Å; P256-L261 HydrophobicContact CG-CD2 4.12Å; P256-L261 HydrophobicContact CG-CG 4.17Å |
| 257 | S | 91 | Very high | 90.1 | Very high | 1 Ų | 1 | 44.7 Ų | 44.7 | 1% | 0.007 | 25% | 0.248 | C | C | . | . | P | Polyproline II helix | trans | -60.1 | 131.6 | 177.3 | 156.3 | 0 | 0 | 0 | 0 | 111.6 | E194 R259 F260 L261 | E194-S257 WeakPolarHBondContact OE2-CB 3.2Å; E194-S257 PolarHBondContact OE2-OG 3.2Å; S257-R259 VanDerWaalsContact C-N 3.27Å; S257-R259 PolarHBondContact O-N 2.87Å; S257-R259 PolarHBondContact OG-N 3.38Å; S257-F260 PolarHBondContact O-N 3.27Å; S257-F260 PolarHBondContact OG-N 3.09Å; S257-L261 PolarHBondContact O-N 3.39Å; S257-L261 VanDerWaalsContact O-N 3.11Å |
| 258 | P | 89.9 | Confident | 89.9 | Confident | 0 Ų | 0 | 50.3 Ų | 50.3 | 0% | 0 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -56.4 | -41 | 173.5 | -25 | 33.8 | 0 | 0 | 0 | 112.6 | F260 L261 V262 V273 L274 M277 | P258-F260 PolarHBondContact O-N 3.34Å; P258-L261 PolarHBondContact O-N 2.95Å; P258-V262 WeakPolarHBondContact O-CG2 3.4Å; P258-V262 PolarHBondContact O-N 2.94Å; P258-V262 VanDerWaalsContact O-N 3.12Å; P258-V273 HydrophobicContact CG-CG1 4.11Å; P258-L274 HydrophobicContact CB-CB 4.21Å; P258-L274 HydrophobicContact CB-CD1 4.16Å; P258-L274 HydrophobicContact CG-CB 4.22Å; P258-L274 HydrophobicContact CG-CD1 3.87Å; P258-M277 HydrophobicContact CG-SD 4.24Å |
| 259 | R | 89 | Confident | 89.9 | Confident | 58 Ų | 58 | 52.7 Ų | 52.7 | 22% | 0.219 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -61.7 | -43.9 | 178.5 | -175.8 | 178 | 179.4 | 170.3 | -0.1 | 111.6 | E194 S257 L261 V262 T263 I292 L296 E299 | E194-R259 HydrophobicContact CB-CB 4.49Å; E194-R259 HydrophobicContact CG-CB 4.17Å; S257-R259 VanDerWaalsContact C-N 3.27Å; S257-R259 PolarHBondContact O-N 2.87Å; S257-R259 PolarHBondContact OG-N 3.38Å; R259-L261 VanDerWaalsContact C-N 3.35Å; R259-L261 PolarHBondContact O-N 2.86Å; R259-V262 PolarHBondContact O-N 3.34Å; R259-T263 PolarHBondContact O-N 2.85Å; R259-T263 VanDerWaalsContact O-N 3.09Å; R259-I292 HydrophobicContact CB-CG2 4.27Å; R259-I292 HydrophobicContact CG-CG2 4.13Å; R259-L296 HydrophobicContact CG-CD1 4.31Å; R259-L296 HydrophobicContact CG-CD2 4.17Å; R259-L296 HydrophobicContact CG-CG 4.49Å; R259-E299 IonicContact CZ-OE1 2.89Å; R259-E299 IonicContact CZ-OE2 3.77Å; R259-E299 IonicContact NH2-OE1 3.23Å; R259-E299 PolarHBondContact NH2-OE1 3.19Å; R259-E299 IonicContact NH2-OE2 2.95Å; R259-E299 PolarHBondContact NH2-OE2 3.5Å |
| 260 | F | 88.9 | Confident | 89.7 | Confident | 25 Ų | 25 | 51.3 Ų | 51.3 | 11% | 0.11 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -62.1 | -40.8 | 175.9 | 175.3 | -105.3 | 0 | 0 | 0 | 112.2 | D139 S257 P258 V262 T263 Q264 | D139-F260 WeakPolarHBondContact O-CE2 3.3Å; S257-F260 PolarHBondContact O-N 3.27Å; S257-F260 PolarHBondContact OG-N 3.09Å; P258-F260 PolarHBondContact O-N 3.34Å; F260-V262 VanDerWaalsContact C-N 3.29Å; F260-V262 PolarHBondContact O-N 3.38Å; F260-T263 WeakPolarHBondContact CA-OG1 3.43Å; F260-T263 PolarHBondContact O-N 3.35Å; F260-T263 PolarHBondContact O-OG1 2.98Å; F260-Q264 HydrophobicContact CE1-CG 4.05Å; F260-Q264 HydrophobicContact CE2-CG 4.12Å; F260-Q264 HydrophobicContact CZ-CG 3.85Å; F260-Q264 WeakPolarHBondContact O-CG 3.06Å; F260-Q264 PolarHBondContact O-N 3.46Å; F260-Q264 VanDerWaalsContact O-N 3.14Å |
| 261 | L | 89.9 | Confident | 89.7 | Confident | 12 Ų | 12 | 52.7 Ų | 52.7 | 6% | 0.063 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -62.5 | -35.9 | 176.5 | -70.4 | 176 | 0 | 0 | 0 | 112.6 | P256 S257 P258 R259 Q264 G265 K266 Q269 A270 V273 | P256-L261 HydrophobicContact CG-CD1 4.01Å; P256-L261 HydrophobicContact CG-CD2 4.12Å; P256-L261 HydrophobicContact CG-CG 4.17Å; S257-L261 PolarHBondContact O-N 3.39Å; S257-L261 VanDerWaalsContact O-N 3.11Å; P258-L261 PolarHBondContact O-N 2.95Å; R259-L261 VanDerWaalsContact C-N 3.35Å; R259-L261 PolarHBondContact O-N 2.86Å; L261-Q264 PolarHBondContact O-N 2.91Å; L261-G265 PolarHBondContact O-N 3.32Å; L261-K266 HydrophobicContact CD2-CD 4.48Å; L261-K266 PolarHBondContact O-N 2.92Å; L261-Q269 HydrophobicContact CD1-CB 4.24Å; L261-A270 HydrophobicContact CB-CB 3.7Å; L261-A270 HydrophobicContact CD1-CB 4.4Å; L261-V273 HydrophobicContact CD1-CB 4.34Å; L261-V273 HydrophobicContact CD1-CG2 3.89Å |
| 262 | V | 90.3 | Very high | 89.6 | Confident | 16 Ų | 16 | 54.6 Ų | 54.6 | 10% | 0.097 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -66.6 | -41.7 | 173.8 | 178.6 | 0 | 0 | 0 | 0 | 111.3 | P258 R259 F260 Q264 G265 A270 L289 I292 Q293 L296 | P258-V262 WeakPolarHBondContact O-CG2 3.4Å; P258-V262 PolarHBondContact O-N 2.94Å; P258-V262 VanDerWaalsContact O-N 3.12Å; R259-V262 PolarHBondContact O-N 3.34Å; F260-V262 VanDerWaalsContact C-N 3.29Å; F260-V262 PolarHBondContact O-N 3.38Å; V262-Q264 PolarHBondContact O-N 3.43Å; V262-G265 PolarHBondContact O-N 3.21Å; V262-A270 HydrophobicContact CG2-CB 3.65Å; V262-L289 HydrophobicContact CG2-CD1 3.72Å; V262-I292 HydrophobicContact CB-CG2 4.38Å; V262-I292 HydrophobicContact CG2-CG2 4.22Å; V262-Q293 HydrophobicContact CG1-CG 3.69Å; V262-L296 HydrophobicContact CB-CD1 3.91Å; V262-L296 HydrophobicContact CG1-CD1 3.6Å |
| 263 | T | 85.8 | Confident | 89.6 | Confident | 72 Ų | 72 | 51.1 Ų | 51.1 | 44% | 0.442 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -61.7 | -27 | 175.9 | 60 | 0 | 0 | 0 | 0 | 113.3 | R259 F260 G265 L296 | R259-T263 PolarHBondContact O-N 2.85Å; R259-T263 VanDerWaalsContact O-N 3.09Å; F260-T263 WeakPolarHBondContact CA-OG1 3.43Å; F260-T263 PolarHBondContact O-N 3.35Å; F260-T263 PolarHBondContact O-OG1 2.98Å; T263-G265 VanDerWaalsContact C-N 3.29Å; T263-L296 HydrophobicContact CG2-CD1 3.66Å; T263-L296 HydrophobicContact CG2-CD2 3.6Å; T263-L296 HydrophobicContact CG2-CG 4.27Å |
| 264 | Q | 87.3 | Confident | 89.6 | Confident | 94 Ų | 94 | 42.6 Ų | 42.6 | 44% | 0.439 | 23% | 0.23 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -85.9 | 4.1 | 176.3 | -69.2 | -82.6 | -29.5 | 0 | 0 | 113.1 | F260 L261 V262 K266 | F260-Q264 HydrophobicContact CE1-CG 4.05Å; F260-Q264 HydrophobicContact CE2-CG 4.12Å; F260-Q264 HydrophobicContact CZ-CG 3.85Å; F260-Q264 WeakPolarHBondContact O-CG 3.06Å; F260-Q264 PolarHBondContact O-N 3.46Å; F260-Q264 VanDerWaalsContact O-N 3.14Å; L261-Q264 PolarHBondContact O-N 2.91Å; V262-Q264 PolarHBondContact O-N 3.43Å; Q264-K266 HydrophobicContact CB-CG 4.41Å; Q264-K266 PolarHBondContact O-N 3.4Å |
| 265 | G | 88.3 | Confident | 89.5 | Confident | 58 Ų | 58 | 42.6 Ų | 42.6 | 60% | 0.598 | 23% | 0.231 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 74.7 | 3.4 | -176.5 | 0 | 0 | 0 | 0 | 0 | 115 | L261 V262 T263 V267 | L261-G265 PolarHBondContact O-N 3.32Å; V262-G265 PolarHBondContact O-N 3.21Å; T263-G265 VanDerWaalsContact C-N 3.29Å; G265-V267 VanDerWaalsContact C-N 3.31Å; G265-V267 PolarHBondContact O-N 3.35Å; G265-V267 VanDerWaalsContact O-N 3.09Å |
| 266 | K | 91.6 | Very high | 89.5 | Confident | 104 Ų | 104 | 50 Ų | 50 | 45% | 0.452 | 26% | 0.257 | S | S | . | . | trans | -88.8 | 60 | -176.5 | -60.9 | -178.6 | -175.7 | 176.4 | 0 | 111.9 | L261 Q264 E268 Q269 A270 | L261-K266 HydrophobicContact CD2-CD 4.48Å; L261-K266 PolarHBondContact O-N 2.92Å; Q264-K266 HydrophobicContact CB-CG 4.41Å; Q264-K266 PolarHBondContact O-N 3.4Å; K266-E268 PolarHBondContact O-N 3.47Å; K266-Q269 HydrophobicContact CB-CB 4.31Å; K266-Q269 PolarHBondContact O-N 2.97Å; K266-A270 PolarHBondContact O-N 3.5Å | ||
| 267 | V | 91 | Very high | 89.2 | Confident | 38 Ų | 38 | 48.1 Ų | 48.1 | 23% | 0.23 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -61.7 | -41.3 | -171.2 | -177.1 | 0 | 0 | 0 | 0 | 113.1 | G265 Q269 A270 R271 L289 | G265-V267 VanDerWaalsContact C-N 3.31Å; G265-V267 PolarHBondContact O-N 3.35Å; G265-V267 VanDerWaalsContact O-N 3.09Å; V267-Q269 PolarHBondContact O-N 3.33Å; V267-A270 WeakPolarHBondContact O-CB 3.34Å; V267-A270 PolarHBondContact O-N 3.46Å; V267-R271 PolarHBondContact O-N 3.47Å; V267-L289 HydrophobicContact CG1-CD2 3.87Å |
| 268 | E | 90.6 | Very high | 88.9 | Confident | 119 Ų | 119 | 48.9 Ų | 48.9 | 56% | 0.556 | 25% | 0.247 | S | C | * | . | H | α-helix | trans | -66.3 | -37.5 | 179.7 | -69.1 | -52.9 | 136.4 | 0 | 0 | 113.1 | K266 R271 A272 | K266-E268 PolarHBondContact O-N 3.47Å; E268-R271 PolarHBondContact O-N 3.12Å; E268-R271 IonicContact OE1-CZ 2.65Å; E268-R271 IonicContact OE1-NH1 2.68Å; E268-R271 PolarHBondContact OE1-NH1 3.22Å; E268-R271 IonicContact OE2-CZ 3.79Å; E268-R271 IonicContact OE2-NH1 3.71Å; E268-R271 PolarHBondContact OE2-NH1 3.36Å; E268-A272 PolarHBondContact O-N 3.27Å |
| 269 | Q | 90.8 | Very high | 88.5 | Confident | 109 Ų | 109 | 51.8 Ų | 51.8 | 51% | 0.509 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -68.1 | -40.3 | 174.4 | -64.7 | -176.4 | -0.5 | 0 | 0 | 110.7 | L261 K266 V267 R271 A272 V273 | L261-Q269 HydrophobicContact CD1-CB 4.24Å; K266-Q269 HydrophobicContact CB-CB 4.31Å; K266-Q269 PolarHBondContact O-N 2.97Å; V267-Q269 PolarHBondContact O-N 3.33Å; Q269-R271 VanDerWaalsContact C-N 3.31Å; Q269-R271 PolarHBondContact O-N 2.9Å; Q269-A272 PolarHBondContact O-N 3.15Å; Q269-V273 WeakPolarHBondContact O-CG2 3.45Å; Q269-V273 PolarHBondContact O-N 2.84Å |
| 270 | A | 90.6 | Very high | 88 | Confident | 0 Ų | 0 | 53.8 Ų | 53.8 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -58.7 | -43.9 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.4 | L261 V262 K266 V267 V273 L274 L289 | L261-A270 HydrophobicContact CB-CB 3.7Å; L261-A270 HydrophobicContact CD1-CB 4.4Å; V262-A270 HydrophobicContact CG2-CB 3.65Å; K266-A270 PolarHBondContact O-N 3.5Å; V267-A270 WeakPolarHBondContact O-CB 3.34Å; V267-A270 PolarHBondContact O-N 3.46Å; A270-V273 PolarHBondContact O-N 2.91Å; A270-L274 VanDerWaalsContact O-CB 3.26Å; A270-L274 WeakPolarHBondContact O-CB 3.43Å; A270-L274 PolarHBondContact O-N 2.85Å; A270-L289 HydrophobicContact CB-CD1 4.04Å |
| 271 | R | 90.6 | Very high | 87.3 | Confident | 60 Ų | 60 | 55.1 Ų | 55.1 | 23% | 0.226 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -60 | -46.6 | 175.5 | -169.9 | -178.3 | -75.2 | 125.8 | -3.1 | 111.7 | V267 E268 Q269 L274 A275 K282 L289 | V267-R271 PolarHBondContact O-N 3.47Å; E268-R271 PolarHBondContact O-N 3.12Å; E268-R271 IonicContact OE1-CZ 2.65Å; E268-R271 IonicContact OE1-NH1 2.68Å; E268-R271 PolarHBondContact OE1-NH1 3.22Å; E268-R271 IonicContact OE2-CZ 3.79Å; E268-R271 IonicContact OE2-NH1 3.71Å; E268-R271 PolarHBondContact OE2-NH1 3.36Å; Q269-R271 VanDerWaalsContact C-N 3.31Å; Q269-R271 PolarHBondContact O-N 2.9Å; R271-L274 PolarHBondContact O-N 3.22Å; R271-A275 VanDerWaalsContact O-CB 3.31Å; R271-A275 WeakPolarHBondContact O-CB 3.31Å; R271-A275 PolarHBondContact O-N 3.31Å; R271-K282 HydrophobicContact CG-CB 4.36Å; R271-L289 HydrophobicContact CB-CD2 3.82Å; R271-L289 HydrophobicContact CG-CD2 4.23Å |
| 272 | A | 89.8 | Confident | 86.6 | Confident | 40 Ų | 40 | 60.2 Ų | 60.2 | 33% | 0.331 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -64 | -42.7 | 179.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | E268 Q269 R276 | E268-A272 PolarHBondContact O-N 3.27Å; Q269-A272 PolarHBondContact O-N 3.15Å; A272-R276 PolarHBondContact O-N 2.63Å; A272-R276 VanDerWaalsContact O-N 3.12Å |
| 273 | V | 89.6 | Confident | 85.5 | Confident | 23 Ų | 23 | 67 Ų | 67 | 14% | 0.139 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -65.1 | -48 | 176.2 | 172.8 | 0 | 0 | 0 | 0 | 110.5 | P255 P258 L261 Q269 A270 A275 R276 M277 | P255-V273 HydrophobicContact CB-CG1 3.7Å; P255-V273 HydrophobicContact CB-CG2 4.34Å; P255-V273 HydrophobicContact CG-CG1 4.11Å; P258-V273 HydrophobicContact CG-CG1 4.11Å; L261-V273 HydrophobicContact CD1-CB 4.34Å; L261-V273 HydrophobicContact CD1-CG2 3.89Å; Q269-V273 WeakPolarHBondContact O-CG2 3.45Å; Q269-V273 PolarHBondContact O-N 2.84Å; A270-V273 PolarHBondContact O-N 2.91Å; V273-A275 VanDerWaalsContact C-N 3.34Å; V273-A275 PolarHBondContact O-N 2.98Å; V273-R276 WeakPolarHBondContact O-CB 3.47Å; V273-R276 PolarHBondContact O-N 3.38Å; V273-R276 VanDerWaalsContact O-N 3.14Å; V273-M277 HydrophobicContact CG1-CG 4.18Å; V273-M277 HydrophobicContact CG1-SD 4.08Å; V273-M277 VanDerWaalsContact O-CG 3.3Å; V273-M277 WeakPolarHBondContact O-CG 3.3Å; V273-M277 PolarHBondContact O-N 3.29Å |
| 274 | L | 88.8 | Confident | 85.1 | Confident | 0 Ų | 0 | 68.4 Ų | 68.4 | 0% | 0 | 36% | 0.358 | C | S | . | . | H | α-helix | trans | -62.6 | -41.1 | -178.4 | -168.1 | 61.3 | 0 | 0 | 0 | 111.4 | P258 A270 R271 R276 M277 R278 V285 E288 I292 | P258-L274 HydrophobicContact CB-CB 4.21Å; P258-L274 HydrophobicContact CB-CD1 4.16Å; P258-L274 HydrophobicContact CG-CB 4.22Å; P258-L274 HydrophobicContact CG-CD1 3.87Å; A270-L274 VanDerWaalsContact O-CB 3.26Å; A270-L274 WeakPolarHBondContact O-CB 3.43Å; A270-L274 PolarHBondContact O-N 2.85Å; R271-L274 PolarHBondContact O-N 3.22Å; L274-R276 PolarHBondContact O-N 3.16Å; L274-M277 PolarHBondContact O-N 2.84Å; L274-R278 HydrophobicContact CD1-CG 4.44Å; L274-R278 WeakPolarHBondContact O-CB 3.47Å; L274-R278 VanDerWaalsContact O-CG 3.3Å; L274-R278 WeakPolarHBondContact O-CG 3.36Å; L274-R278 PolarHBondContact O-N 2.87Å; L274-V285 HydrophobicContact CB-CG1 3.69Å; L274-V285 HydrophobicContact CD2-CG1 3.24Å; L274-V285 HydrophobicContact CG-CG1 3.26Å; L274-E288 HydrophobicContact CD2-CB 4.34Å; L274-E288 HydrophobicContact CD2-CG 4.14Å; L274-I292 HydrophobicContact CD2-CD1 4.2Å |
| 275 | A | 87.8 | Confident | 84.9 | Confident | 8 Ų | 8 | 64 Ų | 64 | 7% | 0.066 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -57.8 | -45.7 | 172.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | R271 V273 M277 R278 G279 R280 K282 | R271-A275 VanDerWaalsContact O-CB 3.31Å; R271-A275 WeakPolarHBondContact O-CB 3.31Å; R271-A275 PolarHBondContact O-N 3.31Å; V273-A275 VanDerWaalsContact C-N 3.34Å; V273-A275 PolarHBondContact O-N 2.98Å; A275-M277 PolarHBondContact O-N 2.69Å; A275-R278 PolarHBondContact O-N 3Å; A275-G279 PolarHBondContact O-N 3.22Å; A275-R280 PolarHBondContact O-N 3.26Å; A275-R280 VanDerWaalsContact O-N 3.17Å; A275-K282 HydrophobicContact CB-CG 3.92Å |
| 276 | R | 87.1 | Confident | 84.8 | Confident | 172 Ų | 172 | 63.4 Ų | 63.4 | 65% | 0.649 | 32% | 0.324 | S | S | * | . | H | α-helix | trans | -63.2 | -39.9 | 176.1 | -171.8 | -180 | 178.9 | -178 | -0.6 | 112.4 | L76 A272 V273 L274 G279 | L76-R276 HydrophobicContact CD2-CG 4Å; A272-R276 PolarHBondContact O-N 2.63Å; A272-R276 VanDerWaalsContact O-N 3.12Å; V273-R276 WeakPolarHBondContact O-CB 3.47Å; V273-R276 PolarHBondContact O-N 3.38Å; V273-R276 VanDerWaalsContact O-N 3.14Å; L274-R276 PolarHBondContact O-N 3.16Å; R276-G279 PolarHBondContact O-N 3.33Å |
| 277 | M | 84.9 | Confident | 84.5 | Confident | 1 Ų | 1 | 63 Ų | 63 | 1% | 0.005 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -71.9 | -32.6 | 178.6 | -65.1 | -164.3 | 87.8 | 0 | 0 | 112.8 | S74 L76 V77 A80 I195 P255 P258 V273 L274 A275 G279 | S74-M277 WeakPolarHBondContact CB-O 3.47Å; L76-M277 HydrophobicContact CD2-CG 4.36Å; V77-M277 HydrophobicContact CG2-CB 4.1Å; V77-M277 HydrophobicContact CG2-CE 4.22Å; V77-M277 WeakPolarHBondContact CG2-O 3.38Å; A80-M277 HydrophobicContact CB-CE 4.44Å; I195-M277 HydrophobicContact CB-CE 3.44Å; I195-M277 VanDerWaalsContact CB-CE 3.44Å; I195-M277 HydrophobicContact CB-SD 4.05Å; I195-M277 HydrophobicContact CD1-CE 4.12Å; I195-M277 HydrophobicContact CG1-CE 4.26Å; I195-M277 HydrophobicContact CG2-CE 3.58Å; I195-M277 HydrophobicContact CG2-SD 3.89Å; P255-M277 HydrophobicContact CG-CE 4.44Å; P255-M277 HydrophobicContact CG-CG 4.36Å; P255-M277 HydrophobicContact CG-SD 4.23Å; P258-M277 HydrophobicContact CG-SD 4.24Å; V273-M277 HydrophobicContact CG1-CG 4.18Å; V273-M277 HydrophobicContact CG1-SD 4.08Å; V273-M277 VanDerWaalsContact O-CG 3.3Å; V273-M277 WeakPolarHBondContact O-CG 3.3Å; V273-M277 PolarHBondContact O-N 3.29Å; L274-M277 PolarHBondContact O-N 2.84Å; A275-M277 PolarHBondContact O-N 2.69Å; M277-G279 VanDerWaalsContact C-N 3.35Å |
| 278 | R | 85.3 | Confident | 84.2 | Confident | 17 Ų | 17 | 63.2 Ų | 63.2 | 6% | 0.064 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -82.3 | -14.9 | 175.1 | -62.3 | -66.2 | 177.5 | -124.5 | 1.2 | 112.7 | I195 S196 P197 L274 A275 R280 V285 E288 | I195-R278 PolarHBondContact O-NH1 3.35Å; S196-R278 PolarHBondContact O-NH2 3.26Å; P197-R278 VanDerWaalsContact N-NH1 3.15Å; L274-R278 HydrophobicContact CD1-CG 4.44Å; L274-R278 WeakPolarHBondContact O-CB 3.47Å; L274-R278 VanDerWaalsContact O-CG 3.3Å; L274-R278 WeakPolarHBondContact O-CG 3.36Å; L274-R278 PolarHBondContact O-N 2.87Å; A275-R278 PolarHBondContact O-N 3Å; R278-R280 HydrophobicContact CB-CB 4.22Å; R278-R280 HydrophobicContact CB-CG 4.2Å; R278-R280 PolarHBondContact O-N 2.67Å; R278-V285 HydrophobicContact CB-CG2 4.35Å; R278-V285 HydrophobicContact CG-CG2 4.39Å; R278-E288 IonicContact CZ-OE1 2.63Å; R278-E288 IonicContact CZ-OE2 2.79Å; R278-E288 IonicContact NE-OE1 3.73Å; R278-E288 PolarHBondContact NE-OE1 3.38Å; R278-E288 IonicContact NE-OE2 2.71Å; R278-E288 PolarHBondContact NE-OE2 3.29Å; R278-E288 IonicContact NH2-OE1 3.19Å; R278-E288 PolarHBondContact NH2-OE1 3.01Å; R278-E288 IonicContact NH2-OE2 3.94Å |
| 279 | G | 81.6 | Confident | 84 | Confident | 61 Ų | 61 | 57.7 Ų | 57.7 | 63% | 0.629 | 30% | 0.299 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 63.5 | 29.3 | -173.2 | 0 | 0 | 0 | 0 | 0 | 112.2 | A275 R276 M277 | A275-G279 PolarHBondContact O-N 3.22Å; R276-G279 PolarHBondContact O-N 3.33Å; M277-G279 VanDerWaalsContact C-N 3.35Å |
| 280 | R | 78.3 | Confident | 83.9 | Confident | 100 Ų | 100 | 59 Ų | 59 | 38% | 0.377 | 30% | 0.3 | S | S | . | . | S | Bend | trans | -119.9 | 165.8 | -175.3 | -70.4 | -176.2 | 177.6 | 175.4 | -6.1 | 111.1 | K69 A275 R278 D284 V285 | K69-R280 PolarHBondContact O-NH2 3.37Å; A275-R280 PolarHBondContact O-N 3.26Å; A275-R280 VanDerWaalsContact O-N 3.17Å; R278-R280 HydrophobicContact CB-CB 4.22Å; R278-R280 HydrophobicContact CB-CG 4.2Å; R278-R280 PolarHBondContact O-N 2.67Å; R280-D284 HydrophobicContact CB-CB 4.22Å; R280-V285 HydrophobicContact CB-CG2 4.21Å |
| 281 | A | 74.6 | Confident | 83.7 | Confident | 53 Ų | 53 | 61.9 Ų | 61.9 | 44% | 0.438 | 32% | 0.315 | S | S | . | . | trans | -63.8 | 157.6 | 171.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | E283 D284 | A281-E283 PolarHBondContact O-N 3.01Å; A281-D284 PolarHBondContact O-N 2.96Å | ||
| 282 | K | 73.5 | Confident | 83.5 | Confident | 119 Ų | 119 | 60.5 Ų | 60.5 | 52% | 0.517 | 31% | 0.312 | S | S | . | . | S | Bend | trans | -63.1 | -30.5 | -179.3 | -72.5 | -177.5 | -179.9 | 178.7 | 0 | 112.8 | R271 A275 | R271-K282 HydrophobicContact CG-CB 4.36Å; A275-K282 HydrophobicContact CB-CG 3.92Å |
| 283 | E | 67.2 | Low | 83.4 | Confident | 159 Ų | 159 | 61.8 Ų | 61.8 | 74% | 0.743 | 31% | 0.311 | S | S | * | . | G | 310 helix | trans | -67.4 | -44.2 | -178.2 | -73.4 | 146.2 | -158.6 | 0 | 0 | 111.7 | A281 V285 S286 | A281-E283 PolarHBondContact O-N 3.01Å; E283-V285 PolarHBondContact O-N 3.23Å; E283-S286 WeakPolarHBondContact O-CB 3.13Å; E283-S286 PolarHBondContact O-N 3.34Å; E283-S286 PolarHBondContact O-OG 3.24Å |
| 284 | D | 77.8 | Confident | 83.3 | Confident | 102 Ų | 102 | 64.1 Ų | 64.1 | 55% | 0.545 | 33% | 0.325 | S | S | . | . | G | 310 helix | trans | -62.6 | -10.8 | -179.8 | -62.2 | -25.4 | 0 | 0 | 0 | 114.8 | R280 A281 | R280-D284 HydrophobicContact CB-CB 4.22Å; A281-D284 PolarHBondContact O-N 2.96Å |
| 285 | V | 83.9 | Confident | 82.9 | Confident | 2 Ų | 2 | 65.4 Ų | 65.4 | 1% | 0.012 | 34% | 0.338 | C | S | . | . | G | 310 helix | trans | -110.1 | -4.6 | -171.5 | 177.6 | 0 | 0 | 0 | 0 | 111.7 | L274 R278 R280 E283 D287 E288 L289 | L274-V285 HydrophobicContact CB-CG1 3.69Å; L274-V285 HydrophobicContact CD2-CG1 3.24Å; L274-V285 HydrophobicContact CG-CG1 3.26Å; R278-V285 HydrophobicContact CB-CG2 4.35Å; R278-V285 HydrophobicContact CG-CG2 4.39Å; R280-V285 HydrophobicContact CB-CG2 4.21Å; E283-V285 PolarHBondContact O-N 3.23Å; V285-D287 VanDerWaalsContact C-N 3.34Å; V285-D287 PolarHBondContact O-N 3.09Å; V285-E288 PolarHBondContact O-N 3.26Å; V285-L289 PolarHBondContact O-N 3.18Å |
| 286 | S | 85.1 | Confident | 82.7 | Confident | 45 Ų | 45 | 66.4 Ų | 66.4 | 32% | 0.315 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -63.6 | -37 | -177.2 | -56.8 | 0 | 0 | 0 | 0 | 112.9 | E283 L289 R290 | E283-S286 WeakPolarHBondContact O-CB 3.13Å; E283-S286 PolarHBondContact O-N 3.34Å; E283-S286 PolarHBondContact O-OG 3.24Å; S286-L289 PolarHBondContact O-N 3.31Å; S286-R290 PolarHBondContact O-N 3.31Å |
| 287 | D | 84.7 | Confident | 82.5 | Confident | 96 Ų | 96 | 65.1 Ų | 65.1 | 51% | 0.513 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -65.8 | -45.3 | 176.6 | -70.6 | -45.9 | 0 | 0 | 0 | 111.8 | V285 L289 R290 D291 | V285-D287 VanDerWaalsContact C-N 3.34Å; V285-D287 PolarHBondContact O-N 3.09Å; D287-L289 VanDerWaalsContact C-N 3.29Å; D287-L289 PolarHBondContact O-N 2.92Å; D287-R290 WeakPolarHBondContact O-CB 3.32Å; D287-R290 PolarHBondContact O-N 3.31Å; D287-R290 IonicContact OD1-CZ 3.19Å; D287-R290 IonicContact OD1-NH1 3.96Å; D287-R290 IonicContact OD1-NH2 2.79Å; D287-R290 PolarHBondContact OD1-NH2 3.25Å; D287-D291 PolarHBondContact O-N 3.16Å |
| 288 | E | 84.8 | Confident | 82 | Confident | 42 Ų | 42 | 70.3 Ų | 70.3 | 20% | 0.196 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -63 | -38.2 | 176.9 | -172.7 | 175.6 | -170.9 | 0 | 0 | 111.3 | L274 R278 V285 D291 I292 | L274-E288 HydrophobicContact CD2-CB 4.34Å; L274-E288 HydrophobicContact CD2-CG 4.14Å; R278-E288 IonicContact CZ-OE1 2.63Å; R278-E288 IonicContact CZ-OE2 2.79Å; R278-E288 IonicContact NE-OE1 3.73Å; R278-E288 PolarHBondContact NE-OE1 3.38Å; R278-E288 IonicContact NE-OE2 2.71Å; R278-E288 PolarHBondContact NE-OE2 3.29Å; R278-E288 IonicContact NH2-OE1 3.19Å; R278-E288 PolarHBondContact NH2-OE1 3.01Å; R278-E288 IonicContact NH2-OE2 3.94Å; V285-E288 PolarHBondContact O-N 3.26Å; E288-D291 PolarHBondContact O-N 3.49Å; E288-I292 WeakPolarHBondContact O-CG1 3.19Å; E288-I292 PolarHBondContact O-N 3.13Å; E288-I292 VanDerWaalsContact O-N 3.1Å |
| 289 | L | 87.9 | Confident | 81.5 | Confident | 2 Ų | 2 | 72.1 Ų | 72.1 | 1% | 0.01 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -65.9 | -40 | 175.9 | -172.2 | 66.8 | 0 | 0 | 0 | 112.2 | V262 V267 A270 R271 V285 S286 D287 D291 I292 Q293 | V262-L289 HydrophobicContact CG2-CD1 3.72Å; V267-L289 HydrophobicContact CG1-CD2 3.87Å; A270-L289 HydrophobicContact CB-CD1 4.04Å; R271-L289 HydrophobicContact CB-CD2 3.82Å; R271-L289 HydrophobicContact CG-CD2 4.23Å; V285-L289 PolarHBondContact O-N 3.18Å; S286-L289 PolarHBondContact O-N 3.31Å; D287-L289 VanDerWaalsContact C-N 3.29Å; D287-L289 PolarHBondContact O-N 2.92Å; L289-D291 VanDerWaalsContact C-N 3.34Å; L289-I292 PolarHBondContact O-N 3.41Å; L289-Q293 WeakPolarHBondContact O-CG 3.44Å; L289-Q293 PolarHBondContact O-N 2.98Å; L289-Q293 VanDerWaalsContact O-N 3.09Å |
| 290 | R | 88.6 | Confident | 81 | Confident | 136 Ų | 136 | 73.4 Ų | 73.4 | 51% | 0.513 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -61.6 | -44.2 | 174.6 | -177.3 | 177.7 | 63.6 | -151.9 | -14.1 | 110.7 | S286 D287 I292 Q293 V294 | S286-R290 PolarHBondContact O-N 3.31Å; D287-R290 WeakPolarHBondContact O-CB 3.32Å; D287-R290 PolarHBondContact O-N 3.31Å; D287-R290 IonicContact OD1-CZ 3.19Å; D287-R290 IonicContact OD1-NH1 3.96Å; D287-R290 IonicContact OD1-NH2 2.79Å; D287-R290 PolarHBondContact OD1-NH2 3.25Å; R290-I292 VanDerWaalsContact C-N 3.3Å; R290-I292 PolarHBondContact O-N 3.14Å; R290-Q293 WeakPolarHBondContact O-CB 3.34Å; R290-Q293 PolarHBondContact O-N 3.49Å; R290-Q293 VanDerWaalsContact O-N 3.1Å; R290-V294 HydrophobicContact CG-CG2 4.48Å; R290-V294 WeakPolarHBondContact O-CG2 3.5Å; R290-V294 PolarHBondContact O-N 3.47Å |
| 291 | D | 85.6 | Confident | 80.9 | Confident | 61 Ų | 61 | 76.2 Ų | 76.2 | 33% | 0.326 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -62.2 | -38 | 178.2 | -68.5 | -4.2 | 0 | 0 | 0 | 112.2 | R198 D287 E288 L289 Q293 V294 G295 | R198-D291 IonicContact CZ-OD2 3.57Å; R198-D291 IonicContact NH1-OD2 2.84Å; R198-D291 PolarHBondContact NH1-OD2 3.47Å; R198-D291 VanDerWaalsContact NH2-CG 3.34Å; R198-D291 IonicContact NH2-OD2 3.81Å; R198-D291 PolarHBondContact NH2-OD2 3.5Å; D287-D291 PolarHBondContact O-N 3.16Å; E288-D291 PolarHBondContact O-N 3.49Å; L289-D291 VanDerWaalsContact C-N 3.34Å; D291-Q293 VanDerWaalsContact C-N 3.34Å; D291-V294 PolarHBondContact O-N 3.47Å; D291-G295 PolarHBondContact O-N 3.47Å |
| 292 | I | 85.8 | Confident | 80.9 | Confident | 32 Ų | 32 | 76.7 Ų | 76.7 | 16% | 0.164 | 39% | 0.385 | C | S | . | . | H | α-helix | trans | -62.4 | -42 | 173.9 | -68.6 | 167.3 | 0 | 0 | 0 | 110.8 | R259 V262 L274 E288 L289 R290 L296 | R259-I292 HydrophobicContact CB-CG2 4.27Å; R259-I292 HydrophobicContact CG-CG2 4.13Å; V262-I292 HydrophobicContact CB-CG2 4.38Å; V262-I292 HydrophobicContact CG2-CG2 4.22Å; L274-I292 HydrophobicContact CD2-CD1 4.2Å; E288-I292 WeakPolarHBondContact O-CG1 3.19Å; E288-I292 PolarHBondContact O-N 3.13Å; E288-I292 VanDerWaalsContact O-N 3.1Å; L289-I292 PolarHBondContact O-N 3.41Å; R290-I292 VanDerWaalsContact C-N 3.3Å; R290-I292 PolarHBondContact O-N 3.14Å; I292-L296 HydrophobicContact CG2-CD1 4.04Å; I292-L296 WeakPolarHBondContact O-CB 3.19Å; I292-L296 VanDerWaalsContact O-CG 3.3Å; I292-L296 WeakPolarHBondContact O-CG 3.38Å; I292-L296 PolarHBondContact O-N 3.16Å |
| 293 | Q | 88.6 | Confident | 81.3 | Confident | 67 Ų | 67 | 74 Ų | 74 | 31% | 0.313 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -65.5 | -43 | 178.3 | -72.7 | 176.6 | -22 | 0 | 0 | 112.5 | V262 L289 R290 D291 L296 K297 | V262-Q293 HydrophobicContact CG1-CG 3.69Å; L289-Q293 WeakPolarHBondContact O-CG 3.44Å; L289-Q293 PolarHBondContact O-N 2.98Å; L289-Q293 VanDerWaalsContact O-N 3.09Å; R290-Q293 WeakPolarHBondContact O-CB 3.34Å; R290-Q293 PolarHBondContact O-N 3.49Å; R290-Q293 VanDerWaalsContact O-N 3.1Å; D291-Q293 VanDerWaalsContact C-N 3.34Å; Q293-L296 PolarHBondContact O-N 2.83Å; Q293-K297 WeakPolarHBondContact O-CG 3.39Å; Q293-K297 PolarHBondContact O-N 3.16Å; Q293-K297 VanDerWaalsContact O-N 3.13Å |
| 294 | V | 86.8 | Confident | 81.8 | Confident | 72 Ų | 72 | 70.3 Ų | 70.3 | 44% | 0.436 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -62.3 | -48.3 | 176.9 | 173.8 | 0 | 0 | 0 | 0 | 110.2 | R290 D291 L296 K297 E298 | R290-V294 HydrophobicContact CG-CG2 4.48Å; R290-V294 WeakPolarHBondContact O-CG2 3.5Å; R290-V294 PolarHBondContact O-N 3.47Å; D291-V294 PolarHBondContact O-N 3.47Å; V294-L296 VanDerWaalsContact C-N 3.3Å; V294-L296 PolarHBondContact O-N 3.38Å; V294-K297 WeakPolarHBondContact O-CB 3.38Å; V294-K297 PolarHBondContact O-N 3.21Å; V294-K297 VanDerWaalsContact O-N 3.1Å; V294-E298 PolarHBondContact O-N 3.35Å; V294-E298 VanDerWaalsContact O-N 3.09Å |
| 295 | G | 81.7 | Confident | 82.1 | Confident | 26 Ų | 26 | 74.6 Ų | 74.6 | 27% | 0.268 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -62.2 | -34.5 | 179 | 0 | 0 | 0 | 0 | 0 | 113.8 | D291 E299 | D291-G295 PolarHBondContact O-N 3.47Å; G295-E299 WeakPolarHBondContact O-CG 3.41Å; G295-E299 PolarHBondContact O-N 2.97Å; G295-E299 VanDerWaalsContact O-N 3.11Å |
| 296 | L | 82.3 | Confident | 82 | Confident | 29 Ų | 29 | 76.1 Ų | 76.1 | 15% | 0.152 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -69.9 | -33.8 | 174.9 | -74.9 | 172.8 | 0 | 0 | 0 | 112.8 | R259 V262 T263 I292 Q293 V294 S300 | R259-L296 HydrophobicContact CG-CD1 4.31Å; R259-L296 HydrophobicContact CG-CD2 4.17Å; R259-L296 HydrophobicContact CG-CG 4.49Å; V262-L296 HydrophobicContact CB-CD1 3.91Å; V262-L296 HydrophobicContact CG1-CD1 3.6Å; T263-L296 HydrophobicContact CG2-CD1 3.66Å; T263-L296 HydrophobicContact CG2-CD2 3.6Å; T263-L296 HydrophobicContact CG2-CG 4.27Å; I292-L296 HydrophobicContact CG2-CD1 4.04Å; I292-L296 WeakPolarHBondContact O-CB 3.19Å; I292-L296 VanDerWaalsContact O-CG 3.3Å; I292-L296 WeakPolarHBondContact O-CG 3.38Å; I292-L296 PolarHBondContact O-N 3.16Å; Q293-L296 PolarHBondContact O-N 2.83Å; V294-L296 VanDerWaalsContact C-N 3.3Å; V294-L296 PolarHBondContact O-N 3.38Å; L296-S300 PolarHBondContact O-N 3.37Å; L296-S300 VanDerWaalsContact O-N 3.13Å |
| 297 | K | 82.8 | Confident | 81.9 | Confident | 146 Ų | 146 | 74 Ų | 74 | 64% | 0.635 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -65.7 | -47.9 | 174.2 | -74.8 | -179.7 | 178.4 | -176.1 | 0 | 110.7 | Q293 V294 E299 S300 E301 | Q293-K297 WeakPolarHBondContact O-CG 3.39Å; Q293-K297 PolarHBondContact O-N 3.16Å; Q293-K297 VanDerWaalsContact O-N 3.13Å; V294-K297 WeakPolarHBondContact O-CB 3.38Å; V294-K297 PolarHBondContact O-N 3.21Å; V294-K297 VanDerWaalsContact O-N 3.1Å; K297-E299 VanDerWaalsContact C-N 3.3Å; K297-E299 PolarHBondContact O-N 2.93Å; K297-S300 PolarHBondContact O-N 2.85Å; K297-S300 VanDerWaalsContact O-N 3.08Å; K297-S300 PolarHBondContact O-OG 3.16Å; K297-E301 PolarHBondContact O-N 3.32Å |
| 298 | E | 75.8 | Confident | 81.9 | Confident | 109 Ų | 109 | 73.8 Ų | 73.8 | 51% | 0.509 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -57.3 | -40.8 | 176 | -71.4 | -179.7 | 171.3 | 0 | 0 | 112.4 | V294 S300 E301 H302 | V294-E298 PolarHBondContact O-N 3.35Å; V294-E298 VanDerWaalsContact O-N 3.09Å; E298-S300 VanDerWaalsContact C-N 3.35Å; E298-S300 PolarHBondContact O-N 2.7Å; E298-E301 PolarHBondContact O-N 2.79Å; E298-H302 PolarHBondContact O-CD2 2.95Å |
| 299 | E | 74.6 | Confident | 81.6 | Confident | 55 Ų | 55 | 74.2 Ų | 74.2 | 26% | 0.257 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -66.6 | -34.2 | 176.4 | -79.5 | 179.3 | 177 | 0 | 0 | 113.5 | R259 G295 K297 E301 | R259-E299 IonicContact CZ-OE1 2.89Å; R259-E299 IonicContact CZ-OE2 3.77Å; R259-E299 IonicContact NH2-OE1 3.23Å; R259-E299 PolarHBondContact NH2-OE1 3.19Å; R259-E299 IonicContact NH2-OE2 2.95Å; R259-E299 PolarHBondContact NH2-OE2 3.5Å; G295-E299 WeakPolarHBondContact O-CG 3.41Å; G295-E299 PolarHBondContact O-N 2.97Å; G295-E299 VanDerWaalsContact O-N 3.11Å; K297-E299 VanDerWaalsContact C-N 3.3Å; K297-E299 PolarHBondContact O-N 2.93Å; E299-E301 VanDerWaalsContact C-N 3.31Å; E299-E301 PolarHBondContact O-N 3.36Å |
| 300 | S | 70.6 | Confident | 80.9 | Confident | 89 Ų | 89 | 77.7 Ų | 77.7 | 62% | 0.622 | 39% | 0.39 | S | S | * | . | H | α-helix | trans | -71.4 | -25.5 | -179.9 | 72.8 | 0 | 0 | 0 | 0 | 113.4 | L296 K297 E298 H302 | L296-S300 PolarHBondContact O-N 3.37Å; L296-S300 VanDerWaalsContact O-N 3.13Å; K297-S300 PolarHBondContact O-N 2.85Å; K297-S300 VanDerWaalsContact O-N 3.08Å; K297-S300 PolarHBondContact O-OG 3.16Å; E298-S300 VanDerWaalsContact C-N 3.35Å; E298-S300 PolarHBondContact O-N 2.7Å; S300-H302 VanDerWaalsContact C-N 3.34Å |
| 301 | E | 76.1 | Confident | 80 | Confident | 158 Ų | 158 | 77.4 Ų | 77.4 | 74% | 0.738 | 39% | 0.393 | S | S | * | . | H | α-helix | trans | -75 | -23.2 | -179.4 | -71.9 | -178.7 | 178.7 | 0 | 0 | 113.1 | K297 E298 E299 | K297-E301 PolarHBondContact O-N 3.32Å; E298-E301 PolarHBondContact O-N 2.79Å; E299-E301 VanDerWaalsContact C-N 3.31Å; E299-E301 PolarHBondContact O-N 3.36Å |
| 302 | H | 75.6 | Confident | 79.2 | Confident | 64 Ų | 64 | 77.5 Ų | 77.5 | 30% | 0.296 | 40% | 0.402 | S | S | . | . | S | Bend | trans | -83.5 | 145.4 | 177 | -72.7 | -63.5 | 0 | 0 | 0 | 111.6 | E298 S300 E306 V517 R520 | E298-H302 PolarHBondContact O-CD2 2.95Å; S300-H302 VanDerWaalsContact C-N 3.34Å; H302-E306 IonicContact CE1-OE2 3.06Å; H302-E306 IonicContact CG-OE2 2.76Å; H302-E306 IonicContact ND1-OE1 3.85Å; H302-E306 IonicContact ND1-OE2 3.73Å; H302-E306 PolarHBondContact ND1-OE2 3.4Å; H302-V517 HydrophobicContact CB-CG1 3.82Å; H302-R520 VanDerWaalsContact O-CZ 3.3Å; H302-R520 PolarHBondContact O-NH1 2.77Å; H302-R520 PolarHBondContact O-NH2 3.38Å |
| 303 | S | 80.3 | Confident | 78.9 | Confident | 63 Ų | 63 | 77.7 Ų | 77.7 | 44% | 0.441 | 40% | 0.403 | S | S | . | . | trans | -102.7 | 151.8 | 174.2 | -175.5 | 0 | 0 | 0 | 0 | 112.2 | W305 E306 R520 | S303-W305 VanDerWaalsContact C-N 3.26Å; S303-W305 PolarHBondContact O-N 3.23Å; S303-E306 VanDerWaalsContact O-CB 3.26Å; S303-E306 WeakPolarHBondContact O-CB 3.27Å; S303-E306 PolarHBondContact O-N 2.64Å; S303-E306 VanDerWaalsContact O-N 3.15Å; S303-R520 VanDerWaalsContact CA-NH1 3.3Å; S303-R520 PolarHBondContact O-NH1 3.36Å | ||
| 304 | F | 79.5 | Confident | 78.6 | Confident | 80 Ų | 80 | 74.8 Ų | 74.8 | 35% | 0.351 | 39% | 0.39 | S | S | . | . | G | 310 helix | trans | -61 | -38.4 | -179.9 | 177.8 | -94.2 | 0 | 0 | 0 | 111.5 | E306 L307 F308 R520 V524 | F304-E306 PolarHBondContact O-N 2.88Å; F304-L307 VanDerWaalsContact O-CB 3.27Å; F304-L307 WeakPolarHBondContact O-CB 3.43Å; F304-L307 PolarHBondContact O-N 3.17Å; F304-F308 HydrophobicContact CD1-CE2 4.45Å; F304-F308 AromaticContact CE1-CE2 3.81Å; F304-F308 HydrophobicContact CE1-CE2 3.81Å; F304-F308 HydrophobicContact CZ-CE2 4.21Å; F304-R520 HydrophobicContact CD2-CB 4.06Å; F304-R520 HydrophobicContact CD2-CG 4.18Å; F304-R520 HydrophobicContact CE2-CB 4.43Å; F304-R520 VanDerWaalsContact N-NH1 3.12Å; F304-V524 HydrophobicContact CE2-CG2 3.88Å; F304-V524 HydrophobicContact CZ-CG2 3.75Å |
| 305 | W | 83.3 | Confident | 78.6 | Confident | 193 Ų | 193 | 79.1 Ų | 79.1 | 73% | 0.731 | 40% | 0.398 | S | S | * | . | G | 310 helix | trans | -67.4 | -20.5 | 178.9 | -60.9 | 108.4 | 0 | 0 | 0 | 113.5 | S303 L307 F308 | S303-W305 VanDerWaalsContact C-N 3.26Å; S303-W305 PolarHBondContact O-N 3.23Å; W305-L307 PolarHBondContact O-N 3.03Å; W305-F308 HydrophobicContact CE3-CD2 4.43Å; W305-F308 PolarHBondContact O-N 2.99Å; W305-F308 VanDerWaalsContact O-N 3.14Å |
| 306 | E | 82.7 | Confident | 78.8 | Confident | 33 Ų | 33 | 79.7 Ų | 79.7 | 15% | 0.154 | 40% | 0.398 | C | S | . | . | G | 310 helix | trans | -64.1 | -23.4 | 176.7 | -162.6 | 170.4 | -163.6 | 0 | 0 | 111.9 | H302 S303 F304 F308 S309 K311 L314 | H302-E306 IonicContact CE1-OE2 3.06Å; H302-E306 IonicContact CG-OE2 2.76Å; H302-E306 IonicContact ND1-OE1 3.85Å; H302-E306 IonicContact ND1-OE2 3.73Å; H302-E306 PolarHBondContact ND1-OE2 3.4Å; S303-E306 VanDerWaalsContact O-CB 3.26Å; S303-E306 WeakPolarHBondContact O-CB 3.27Å; S303-E306 PolarHBondContact O-N 2.64Å; S303-E306 VanDerWaalsContact O-N 3.15Å; F304-E306 PolarHBondContact O-N 2.88Å; E306-F308 VanDerWaalsContact C-N 3.27Å; E306-F308 PolarHBondContact O-N 3.29Å; E306-S309 WeakPolarHBondContact O-CB 3.38Å; E306-S309 PolarHBondContact O-N 2.91Å; E306-S309 VanDerWaalsContact O-N 3.09Å; E306-K311 WeakPolarHBondContact OE1-CD 3.18Å; E306-K311 WeakPolarHBondContact OE1-CE 3.48Å; E306-K311 IonicContact OE1-NZ 3.44Å; E306-K311 PolarHBondContact OE1-NZ 3.48Å; E306-L314 HydrophobicContact CG-CD1 4.42Å |
| 307 | L | 81.1 | Confident | 79.1 | Confident | 2 Ų | 2 | 78.5 Ų | 78.5 | 1% | 0.01 | 39% | 0.392 | C | S | . | . | G | 310 helix | trans | -62.7 | -33.6 | 175.4 | -172 | 67.8 | 0 | 0 | 0 | 112.9 | F304 W305 S309 L314 R315 L318 F513 A521 V524 | F304-L307 VanDerWaalsContact O-CB 3.27Å; F304-L307 WeakPolarHBondContact O-CB 3.43Å; F304-L307 PolarHBondContact O-N 3.17Å; W305-L307 PolarHBondContact O-N 3.03Å; L307-S309 VanDerWaalsContact C-N 3.31Å; L307-L314 CarbonylContact O-C 3.55Å; L307-R315 PolarHBondContact O-N 3.49Å; L307-L318 HydrophobicContact CD1-CD1 4.41Å; L307-L318 HydrophobicContact CD2-CD1 3.84Å; L307-L318 HydrophobicContact CD2-CD2 4.04Å; L307-L318 HydrophobicContact CD2-CG 4.49Å; L307-L318 HydrophobicContact CG-CD1 4.19Å; L307-L318 HydrophobicContact CG-CD2 4.02Å; L307-L318 HydrophobicContact CG-CG 4.48Å; L307-F513 HydrophobicContact CD1-CE1 4.44Å; L307-A521 HydrophobicContact CD1-CB 3.58Å; L307-A521 HydrophobicContact CD2-CB 4.26Å; L307-V524 HydrophobicContact CD2-CB 4.47Å; L307-V524 HydrophobicContact CD2-CG2 4.04Å |
| 308 | F | 85.2 | Confident | 79.5 | Confident | 91 Ų | 91 | 71.7 Ų | 71.7 | 40% | 0.399 | 36% | 0.362 | S | S | . | . | G | 310 helix | trans | -87.4 | -5.3 | 177.9 | -62 | -83.6 | 0 | 0 | 0 | 112.6 | F304 W305 E306 L318 | F304-F308 HydrophobicContact CD1-CE2 4.45Å; F304-F308 AromaticContact CE1-CE2 3.81Å; F304-F308 HydrophobicContact CE1-CE2 3.81Å; F304-F308 HydrophobicContact CZ-CE2 4.21Å; W305-F308 HydrophobicContact CE3-CD2 4.43Å; W305-F308 PolarHBondContact O-N 2.99Å; W305-F308 VanDerWaalsContact O-N 3.14Å; E306-F308 VanDerWaalsContact C-N 3.27Å; E306-F308 PolarHBondContact O-N 3.29Å; F308-L318 HydrophobicContact CD1-CD2 3.9Å; F308-L318 HydrophobicContact CE1-CD2 3.59Å; F308-L318 HydrophobicContact CZ-CD2 4.11Å |
| 309 | S | 79.1 | Confident | 80.2 | Confident | 51 Ų | 51 | 70 Ų | 70 | 36% | 0.357 | 36% | 0.359 | S | S | . | . | S | Bend | trans | -74.5 | 155.3 | 177.8 | -171.7 | 0 | 0 | 0 | 0 | 112 | E306 L307 K311 R315 | E306-S309 WeakPolarHBondContact O-CB 3.38Å; E306-S309 PolarHBondContact O-N 2.91Å; E306-S309 VanDerWaalsContact O-N 3.09Å; L307-S309 VanDerWaalsContact C-N 3.31Å; S309-K311 PolarHBondContact O-N 3.41Å; S309-K311 PolarHBondContact OG-N 2.98Å; S309-R315 PolarHBondContact O-N 3.47Å |
| 310 | S | 73.9 | Confident | 81 | Confident | 75 Ų | 75 | 67.9 Ų | 67.9 | 52% | 0.524 | 35% | 0.35 | S | S | . | . | S | Bend | trans | -76.5 | -6.4 | 171.5 | -166.8 | 0 | 0 | 0 | 0 | 112.9 | A312 N313 | S310-A312 PolarHBondContact O-N 3.49Å; S310-N313 PolarHBondContact O-N 3.39Å |
| 311 | K | 68.1 | Low | 82 | Confident | 130 Ų | 130 | 63.7 Ų | 63.7 | 57% | 0.565 | 32% | 0.321 | S | S | * | . | G | 310 helix | trans | -59.8 | 132.3 | 177.6 | -163.6 | 174.9 | 170.5 | -159.2 | 0 | 110 | E306 S309 N313 L314 | E306-K311 WeakPolarHBondContact OE1-CD 3.18Å; E306-K311 WeakPolarHBondContact OE1-CE 3.48Å; E306-K311 IonicContact OE1-NZ 3.44Å; E306-K311 PolarHBondContact OE1-NZ 3.48Å; S309-K311 PolarHBondContact O-N 3.41Å; S309-K311 PolarHBondContact OG-N 2.98Å; K311-N313 PolarHBondContact O-N 2.99Å; K311-L314 VanDerWaalsContact O-CG 3.32Å; K311-L314 WeakPolarHBondContact O-CG 3.49Å; K311-L314 PolarHBondContact O-N 3.44Å; K311-L314 VanDerWaalsContact O-N 3.17Å |
| 312 | A | 68.4 | Low | 82.9 | Confident | 62 Ų | 62 | 58.4 Ų | 58.4 | 51% | 0.512 | 30% | 0.297 | S | S | . | . | G | 310 helix | trans | 51.3 | 26.8 | -178.2 | 0 | 0 | 0 | 0 | 0 | 115.9 | S310 L314 R317 | S310-A312 PolarHBondContact O-N 3.49Å; A312-L314 HydrophobicContact CB-CG 4.36Å; A312-L314 PolarHBondContact O-N 2.94Å; A312-R317 PolarHBondContact O-NH1 3.34Å |
| 313 | N | 79.6 | Confident | 83.8 | Confident | 36 Ų | 36 | 56.7 Ų | 56.7 | 19% | 0.193 | 29% | 0.294 | C | S | . | . | G | 310 helix | trans | 56.4 | 26.6 | -177.2 | -60.2 | -48.8 | 0 | 0 | 0 | 114.6 | S310 K311 R315 S316 R317 A587 | S310-N313 PolarHBondContact O-N 3.39Å; K311-N313 PolarHBondContact O-N 2.99Å; N313-R315 PolarHBondContact O-N 3.43Å; N313-S316 WeakPolarHBondContact O-CB 3.4Å; N313-S316 PolarHBondContact O-N 2.92Å; N313-S316 VanDerWaalsContact O-N 3.15Å; N313-R317 WeakPolarHBondContact O-CG 3.31Å; N313-R317 PolarHBondContact O-N 3.38Å; N313-R317 VanDerWaalsContact O-N 3.14Å; N313-A587 WeakPolarHBondContact ND2-CB 3.41Å |
| 314 | L | 82.9 | Confident | 84.5 | Confident | 7 Ų | 7 | 53.7 Ų | 53.7 | 4% | 0.037 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -61.7 | -41.2 | -177.9 | -68.9 | 175.8 | 0 | 0 | 0 | 112.7 | E306 L307 K311 A312 S316 R317 L318 P514 V517 | E306-L314 HydrophobicContact CG-CD1 4.42Å; L307-L314 CarbonylContact O-C 3.55Å; K311-L314 VanDerWaalsContact O-CG 3.32Å; K311-L314 WeakPolarHBondContact O-CG 3.49Å; K311-L314 PolarHBondContact O-N 3.44Å; K311-L314 VanDerWaalsContact O-N 3.17Å; A312-L314 HydrophobicContact CB-CG 4.36Å; A312-L314 PolarHBondContact O-N 2.94Å; L314-S316 VanDerWaalsContact C-N 3.31Å; L314-S316 PolarHBondContact O-N 2.83Å; L314-R317 WeakPolarHBondContact O-CB 3.46Å; L314-R317 PolarHBondContact O-N 3.44Å; L314-L318 WeakPolarHBondContact O-CB 3.41Å; L314-L318 PolarHBondContact O-N 3.19Å; L314-P514 HydrophobicContact CD2-CG 3.81Å; L314-V517 HydrophobicContact CD2-CG2 3.96Å |
| 315 | R | 86.3 | Confident | 85.3 | Confident | 162 Ų | 162 | 50 Ų | 50 | 61% | 0.611 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -56.2 | -42.6 | 173.3 | -178.1 | 177.8 | 172.6 | -175.8 | -1.2 | 112.9 | L307 S309 N313 L318 V319 | L307-R315 PolarHBondContact O-N 3.49Å; S309-R315 PolarHBondContact O-N 3.47Å; N313-R315 PolarHBondContact O-N 3.43Å; R315-L318 PolarHBondContact O-N 3.31Å; R315-V319 VanDerWaalsContact O-CG2 3.29Å; R315-V319 WeakPolarHBondContact O-CG2 3.41Å; R315-V319 PolarHBondContact O-N 3Å |
| 316 | S | 85.8 | Confident | 85.9 | Confident | 39 Ų | 39 | 45.2 Ų | 45.2 | 27% | 0.273 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -66.6 | -40.2 | 179.5 | -165.1 | 0 | 0 | 0 | 0 | 111.5 | N313 L314 T320 | N313-S316 WeakPolarHBondContact O-CB 3.4Å; N313-S316 PolarHBondContact O-N 2.92Å; N313-S316 VanDerWaalsContact O-N 3.15Å; L314-S316 VanDerWaalsContact C-N 3.31Å; L314-S316 PolarHBondContact O-N 2.83Å; S316-T320 WeakPolarHBondContact O-CB 3.24Å; S316-T320 PolarHBondContact O-N 3.39Å; S316-T320 PolarHBondContact O-OG1 3.38Å |
| 317 | R | 88.9 | Confident | 86.5 | Confident | 3 Ų | 3 | 44.2 Ų | 44.2 | 1% | 0.011 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -63.5 | -43.6 | 175.2 | -69.1 | 166.6 | 153.7 | 174.1 | -14.9 | 111.4 | A312 N313 L314 T320 G321 I512 F513 L579 S583 L586 | A312-R317 PolarHBondContact O-NH1 3.34Å; N313-R317 WeakPolarHBondContact O-CG 3.31Å; N313-R317 PolarHBondContact O-N 3.38Å; N313-R317 VanDerWaalsContact O-N 3.14Å; L314-R317 WeakPolarHBondContact O-CB 3.46Å; L314-R317 PolarHBondContact O-N 3.44Å; R317-T320 PolarHBondContact O-N 2.92Å; R317-G321 PolarHBondContact O-N 3.48Å; R317-I512 WeakPolarHBondContact CD-O 3.48Å; R317-I512 VanDerWaalsContact CZ-O 3.32Å; R317-I512 PolarHBondContact NE-O 3.29Å; R317-F513 HydrophobicContact CB-CD1 4.09Å; R317-F513 HydrophobicContact CB-CE1 3.68Å; R317-F513 HydrophobicContact CB-CZ 4.48Å; R317-L579 PolarHBondContact NH2-O 3.41Å; R317-L579 VanDerWaalsContact NH2-O 3.12Å; R317-S583 VanDerWaalsContact CZ-OG 3.3Å; R317-S583 PolarHBondContact NH1-OG 3.39Å; R317-S583 PolarHBondContact NH2-OG 3.31Å; R317-L586 HydrophobicContact CG-CD1 3.65Å |
| 318 | L | 90.8 | Very high | 87.2 | Confident | 3 Ų | 3 | 44.4 Ų | 44.4 | 2% | 0.016 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -61.6 | -50.5 | 176.7 | -174.1 | 66.9 | 0 | 0 | 0 | 111.3 | L307 F308 L314 R315 T320 G321 M322 F513 V524 V525 | L307-L318 HydrophobicContact CD1-CD1 4.41Å; L307-L318 HydrophobicContact CD2-CD1 3.84Å; L307-L318 HydrophobicContact CD2-CD2 4.04Å; L307-L318 HydrophobicContact CD2-CG 4.49Å; L307-L318 HydrophobicContact CG-CD1 4.19Å; L307-L318 HydrophobicContact CG-CD2 4.02Å; L307-L318 HydrophobicContact CG-CG 4.48Å; F308-L318 HydrophobicContact CD1-CD2 3.9Å; F308-L318 HydrophobicContact CE1-CD2 3.59Å; F308-L318 HydrophobicContact CZ-CD2 4.11Å; L314-L318 WeakPolarHBondContact O-CB 3.41Å; L314-L318 PolarHBondContact O-N 3.19Å; R315-L318 PolarHBondContact O-N 3.31Å; L318-T320 VanDerWaalsContact C-N 3.3Å; L318-T320 PolarHBondContact O-N 2.71Å; L318-G321 PolarHBondContact O-N 2.91Å; L318-M322 HydrophobicContact CD1-CG 4.4Å; L318-M322 HydrophobicContact CD1-SD 4.48Å; L318-M322 HydrophobicContact CD2-CE 4.22Å; L318-M322 HydrophobicContact CD2-SD 4.41Å; L318-M322 HydrophobicContact CG-CE 3.95Å; L318-M322 HydrophobicContact CG-CG 4.37Å; L318-M322 HydrophobicContact CG-SD 4.11Å; L318-M322 WeakPolarHBondContact O-CG 3.41Å; L318-M322 PolarHBondContact O-N 2.79Å; L318-F513 HydrophobicContact CB-CE1 4.5Å; L318-F513 HydrophobicContact CD1-CZ 4.34Å; L318-V524 HydrophobicContact CD1-CB 4.31Å; L318-V524 HydrophobicContact CD1-CG1 4.12Å; L318-V525 HydrophobicContact CD1-CG2 4.02Å |
| 319 | V | 91.6 | Very high | 87.7 | Confident | 74 Ų | 74 | 40.3 Ų | 40.3 | 45% | 0.448 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -59.5 | -42.7 | 178.1 | 171.5 | 0 | 0 | 0 | 0 | 111.1 | R315 G321 M322 A323 | R315-V319 VanDerWaalsContact O-CG2 3.29Å; R315-V319 WeakPolarHBondContact O-CG2 3.41Å; R315-V319 PolarHBondContact O-N 3Å; V319-G321 PolarHBondContact O-N 3.25Å; V319-M322 HydrophobicContact CG2-CE 4.17Å; V319-M322 PolarHBondContact O-N 3Å; V319-A323 VanDerWaalsContact O-CB 3.26Å; V319-A323 WeakPolarHBondContact O-CB 3.27Å; V319-A323 PolarHBondContact O-N 2.87Å |
| 320 | T | 91.1 | Very high | 88.4 | Confident | 10 Ų | 10 | 38.2 Ų | 38.2 | 6% | 0.061 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -61.1 | -44.8 | 176.6 | -53.9 | 0 | 0 | 0 | 0 | 111.3 | S316 R317 L318 L324 F566 | S316-T320 WeakPolarHBondContact O-CB 3.24Å; S316-T320 PolarHBondContact O-N 3.39Å; S316-T320 PolarHBondContact O-OG1 3.38Å; R317-T320 PolarHBondContact O-N 2.92Å; L318-T320 VanDerWaalsContact C-N 3.3Å; L318-T320 PolarHBondContact O-N 2.71Å; T320-L324 VanDerWaalsContact O-CB 3.28Å; T320-L324 WeakPolarHBondContact O-CB 3.24Å; T320-L324 PolarHBondContact O-N 2.9Å; T320-F566 HydrophobicContact CG2-CZ 4.09Å |
| 321 | G | 92.1 | Very high | 89.4 | Confident | 1 Ų | 1 | 34.7 Ų | 34.7 | 1% | 0.01 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -64.4 | -44.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | R317 L318 V319 L324 V325 L509 | R317-G321 PolarHBondContact O-N 3.48Å; L318-G321 PolarHBondContact O-N 2.91Å; V319-G321 PolarHBondContact O-N 3.25Å; G321-L324 PolarHBondContact O-N 3.45Å; G321-V325 PolarHBondContact O-N 3.03Å; G321-V325 VanDerWaalsContact O-N 3.12Å; G321-L509 VanDerWaalsContact CA-CD2 3.48Å |
| 322 | M | 94.8 | Very high | 90.6 | Very high | 48 Ų | 48 | 28.5 Ų | 28.5 | 24% | 0.236 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -64.6 | -43.7 | 177.1 | -69 | -173.4 | -54.8 | 0 | 0 | 112 | L318 V319 L324 V325 F326 V524 V525 V528 | L318-M322 HydrophobicContact CD1-CG 4.4Å; L318-M322 HydrophobicContact CD1-SD 4.48Å; L318-M322 HydrophobicContact CD2-CE 4.22Å; L318-M322 HydrophobicContact CD2-SD 4.41Å; L318-M322 HydrophobicContact CG-CE 3.95Å; L318-M322 HydrophobicContact CG-CG 4.37Å; L318-M322 HydrophobicContact CG-SD 4.11Å; L318-M322 WeakPolarHBondContact O-CG 3.41Å; L318-M322 PolarHBondContact O-N 2.79Å; V319-M322 HydrophobicContact CG2-CE 4.17Å; V319-M322 PolarHBondContact O-N 3Å; M322-L324 VanDerWaalsContact C-N 3.35Å; M322-V325 VanDerWaalsContact O-CG2 3.23Å; M322-V325 WeakPolarHBondContact O-CG2 3.5Å; M322-F326 WeakPolarHBondContact O-CB 3.45Å; M322-F326 PolarHBondContact O-N 3Å; M322-V524 HydrophobicContact SD-CG1 4.23Å; M322-V525 HydrophobicContact CG-CG2 4.14Å; M322-V528 HydrophobicContact CB-CG1 4.44Å; M322-V528 HydrophobicContact CG-CG2 4.07Å; M322-V528 HydrophobicContact SD-CG2 3.99Å |
| 323 | A | 95.3 | Very high | 91.6 | Very high | 28 Ų | 28 | 26.7 Ų | 26.7 | 23% | 0.231 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -64.8 | -39.5 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | V319 F326 L327 F566 | V319-A323 VanDerWaalsContact O-CB 3.26Å; V319-A323 WeakPolarHBondContact O-CB 3.27Å; V319-A323 PolarHBondContact O-N 2.87Å; A323-F326 PolarHBondContact O-N 3.49Å; A323-L327 WeakPolarHBondContact O-CB 3.3Å; A323-L327 VanDerWaalsContact O-CG 3.3Å; A323-L327 WeakPolarHBondContact O-CG 3.36Å; A323-L327 PolarHBondContact O-N 3.24Å; A323-F566 HydrophobicContact CB-CE1 4.4Å; A323-F566 HydrophobicContact CB-CE2 3.73Å; A323-F566 HydrophobicContact CB-CZ 3.58Å |
| 324 | L | 95.1 | Very high | 92.1 | Very high | 0 Ų | 0 | 25.2 Ų | 25.2 | 0% | 0 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -62.6 | -47.5 | 178.2 | -176.5 | 59.9 | 0 | 0 | 0 | 111.9 | T320 G321 M322 L327 Q328 V505 V508 L563 F566 V567 V571 | T320-L324 VanDerWaalsContact O-CB 3.28Å; T320-L324 WeakPolarHBondContact O-CB 3.24Å; T320-L324 PolarHBondContact O-N 2.9Å; G321-L324 PolarHBondContact O-N 3.45Å; M322-L324 VanDerWaalsContact C-N 3.35Å; L324-L327 PolarHBondContact O-N 2.88Å; L324-Q328 WeakPolarHBondContact O-CB 3.34Å; L324-Q328 PolarHBondContact O-N 3.33Å; L324-V505 HydrophobicContact CD1-CG2 4.15Å; L324-V505 HydrophobicContact CD2-CB 4.32Å; L324-V505 HydrophobicContact CD2-CG1 3.9Å; L324-V505 HydrophobicContact CD2-CG2 4.1Å; L324-V505 HydrophobicContact CG-CB 4.44Å; L324-V505 HydrophobicContact CG-CG1 3.9Å; L324-V505 HydrophobicContact CG-CG2 3.9Å; L324-V508 HydrophobicContact CD2-CB 4.09Å; L324-V508 HydrophobicContact CD2-CG1 4Å; L324-V508 HydrophobicContact CD2-CG2 4.48Å; L324-L563 HydrophobicContact CD1-CD1 4.06Å; L324-F566 HydrophobicContact CB-CE1 4.11Å; L324-F566 HydrophobicContact CD1-CE1 4.31Å; L324-V567 HydrophobicContact CD1-CG2 4.41Å; L324-V571 HydrophobicContact CD1-CG2 4.47Å |
| 325 | V | 95.1 | Very high | 92.5 | Very high | 1 Ų | 1 | 24.9 Ų | 24.9 | 1% | 0.006 | 13% | 0.126 | C | C | . | . | H | α-helix | trans | -69.1 | -35.2 | 177 | -62.4 | 0 | 0 | 0 | 0 | 112.1 | G321 M322 Q328 Q329 V505 L509 V525 V528 N529 | G321-V325 PolarHBondContact O-N 3.03Å; G321-V325 VanDerWaalsContact O-N 3.12Å; M322-V325 VanDerWaalsContact O-CG2 3.23Å; M322-V325 WeakPolarHBondContact O-CG2 3.5Å; V325-Q328 WeakPolarHBondContact O-CB 3.33Å; V325-Q328 PolarHBondContact O-N 3.36Å; V325-Q329 WeakPolarHBondContact O-CG 3.48Å; V325-Q329 PolarHBondContact O-N 2.94Å; V325-Q329 VanDerWaalsContact O-N 3.08Å; V325-V505 HydrophobicContact CG1-CG1 3.81Å; V325-L509 HydrophobicContact CG1-CD1 4Å; V325-V525 HydrophobicContact CB-CG1 4.29Å; V325-V525 HydrophobicContact CG1-CG1 3.49Å; V325-V525 VanDerWaalsContact CG1-CG1 3.49Å; V325-V525 HydrophobicContact CG2-CG1 3.77Å; V325-V528 HydrophobicContact CG2-CB 4.36Å; V325-V528 HydrophobicContact CG2-CG1 4.08Å; V325-N529 HydrophobicContact CB-CB 4.03Å; V325-N529 HydrophobicContact CG1-CB 4.41Å; V325-N529 HydrophobicContact CG2-CB 4.19Å |
| 326 | F | 96.2 | Very high | 92.8 | Very high | 93 Ų | 93 | 17.2 Ų | 17.2 | 41% | 0.408 | 10% | 0.097 | S | C | . | . | H | α-helix | trans | -60.6 | -51.2 | 174.6 | 172.9 | -92 | 0 | 0 | 0 | 110.8 | M322 A323 Q328 Q329 A330 T532 | M322-F326 WeakPolarHBondContact O-CB 3.45Å; M322-F326 PolarHBondContact O-N 3Å; A323-F326 PolarHBondContact O-N 3.49Å; F326-Q328 VanDerWaalsContact C-N 3.33Å; F326-Q328 PolarHBondContact O-N 3.39Å; F326-Q329 PolarHBondContact O-N 2.96Å; F326-A330 HydrophobicContact CE1-CB 4.35Å; F326-A330 WeakPolarHBondContact O-CB 3.27Å; F326-A330 PolarHBondContact O-N 3.45Å; F326-T532 HydrophobicContact CD2-CG2 3.42Å; F326-T532 VanDerWaalsContact CD2-CG2 3.42Å; F326-T532 HydrophobicContact CE2-CG2 3.82Å; F326-T532 HydrophobicContact CG-CG2 4.23Å |
| 327 | L | 95.9 | Very high | 93 | Very high | 12 Ų | 12 | 15.8 Ų | 15.8 | 6% | 0.063 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -64.3 | -38.1 | 179.7 | -72.3 | 169.8 | 0 | 0 | 0 | 111.7 | A323 L324 Q329 A330 T331 M559 V562 L563 F566 | A323-L327 WeakPolarHBondContact O-CB 3.3Å; A323-L327 VanDerWaalsContact O-CG 3.3Å; A323-L327 WeakPolarHBondContact O-CG 3.36Å; A323-L327 PolarHBondContact O-N 3.24Å; L324-L327 PolarHBondContact O-N 2.88Å; L327-Q329 PolarHBondContact O-N 3.4Å; L327-A330 PolarHBondContact O-N 2.83Å; L327-T331 VanDerWaalsContact O-CG2 3.27Å; L327-T331 WeakPolarHBondContact O-CG2 3.49Å; L327-T331 PolarHBondContact O-N 3.2Å; L327-T331 VanDerWaalsContact O-N 3.15Å; L327-M559 HydrophobicContact CD2-CE 3.71Å; L327-V562 HydrophobicContact CD2-CG1 3.9Å; L327-L563 HydrophobicContact CB-CB 4.27Å; L327-L563 HydrophobicContact CB-CD1 3.83Å; L327-L563 HydrophobicContact CD1-CD1 4.44Å; L327-F566 HydrophobicContact CD1-CB 3.64Å; L327-F566 HydrophobicContact CD1-CD1 3.67Å; L327-F566 HydrophobicContact CD1-CD2 4.04Å; L327-F566 HydrophobicContact CD1-CE1 4.35Å; L327-F566 HydrophobicContact CD1-CG 3.49Å; L327-F566 VanDerWaalsContact CD1-CG 3.49Å |
| 328 | Q | 94.7 | Very high | 93.1 | Very high | 7 Ų | 7 | 16.6 Ų | 16.6 | 3% | 0.033 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -53.2 | -52 | 171.5 | 173.4 | -170.2 | -34.9 | 0 | 0 | 111 | L324 V325 F326 T331 F497 L501 V505 | L324-Q328 WeakPolarHBondContact O-CB 3.34Å; L324-Q328 PolarHBondContact O-N 3.33Å; V325-Q328 WeakPolarHBondContact O-CB 3.33Å; V325-Q328 PolarHBondContact O-N 3.36Å; F326-Q328 VanDerWaalsContact C-N 3.33Å; F326-Q328 PolarHBondContact O-N 3.39Å; Q328-T331 PolarHBondContact O-N 3.43Å; Q328-T331 PolarHBondContact O-OG1 3.45Å; Q328-F497 HydrophobicContact CG-CE2 4.06Å; Q328-F497 HydrophobicContact CG-CZ 4.24Å; Q328-L501 HydrophobicContact CB-CD2 4.23Å; Q328-L501 HydrophobicContact CG-CB 4.24Å; Q328-L501 HydrophobicContact CG-CD2 4.4Å; Q328-V505 VanDerWaalsContact OE1-CB 3.24Å; Q328-V505 VanDerWaalsContact OE1-CG1 3.24Å; Q328-V505 VanDerWaalsContact OE1-CG2 3.27Å |
| 329 | Q | 95.4 | Very high | 93.1 | Very high | 4 Ų | 4 | 16.5 Ų | 16.5 | 2% | 0.019 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -70 | -36 | -179.2 | -58.6 | -53.2 | 100.9 | 0 | 0 | 111.8 | V325 F326 L327 T331 G332 N529 T532 N533 I536 | V325-Q329 WeakPolarHBondContact O-CG 3.48Å; V325-Q329 PolarHBondContact O-N 2.94Å; V325-Q329 VanDerWaalsContact O-N 3.08Å; F326-Q329 PolarHBondContact O-N 2.96Å; L327-Q329 PolarHBondContact O-N 3.4Å; Q329-T331 PolarHBondContact O-N 3.28Å; Q329-G332 PolarHBondContact O-N 2.89Å; Q329-N529 WeakPolarHBondContact CG-OD1 3.44Å; Q329-N529 PolarHBondContact OE1-OD1 2.88Å; Q329-T532 HydrophobicContact CB-CG2 3.81Å; Q329-T532 HydrophobicContact CG-CG2 4.47Å; Q329-N533 HydrophobicContact CG-CB 4.41Å; Q329-N533 VanDerWaalsContact NE2-CG 3.26Å; Q329-N533 PolarHBondContact NE2-ND2 2.9Å; Q329-I536 HydrophobicContact CB-CD1 3.87Å; Q329-I536 WeakPolarHBondContact O-CD1 3.34Å |
| 330 | A | 94.8 | Very high | 93 | Very high | 8 Ų | 8 | 13 Ų | 13 | 7% | 0.066 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -63.9 | -17.5 | 178 | 0 | 0 | 0 | 0 | 0 | 114.5 | F326 L327 G332 I536 Y556 M559 | F326-A330 HydrophobicContact CE1-CB 4.35Å; F326-A330 WeakPolarHBondContact O-CB 3.27Å; F326-A330 PolarHBondContact O-N 3.45Å; L327-A330 PolarHBondContact O-N 2.83Å; A330-G332 PolarHBondContact O-N 3.15Å; A330-I536 HydrophobicContact CB-CD1 4.28Å; A330-Y556 WeakPolarHBondContact O-CD1 3.36Å; A330-M559 HydrophobicContact CB-CB 4.46Å; A330-M559 HydrophobicContact CB-CE 3.74Å; A330-M559 HydrophobicContact CB-CG 4.41Å |
| 331 | T | 95.3 | Very high | 92.9 | Very high | 0 Ų | 0 | 12.5 Ų | 12.5 | 0% | 0 | 7% | 0.068 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -69.1 | -7.1 | 169.8 | 67.2 | 0 | 0 | 0 | 0 | 113.8 | L327 Q328 Q329 M393 Y493 L501 Y556 L563 | L327-T331 VanDerWaalsContact O-CG2 3.27Å; L327-T331 WeakPolarHBondContact O-CG2 3.49Å; L327-T331 PolarHBondContact O-N 3.2Å; L327-T331 VanDerWaalsContact O-N 3.15Å; Q328-T331 PolarHBondContact O-N 3.43Å; Q328-T331 PolarHBondContact O-OG1 3.45Å; Q329-T331 PolarHBondContact O-N 3.28Å; T331-M393 HydrophobicContact CG2-CE 3.95Å; T331-M393 WeakPolarHBondContact OG1-CE 3.23Å; T331-Y493 PolarHBondContact O-OH 3.46Å; T331-Y493 VanDerWaalsContact O-OH 3.09Å; T331-L501 HydrophobicContact CG2-CD1 4.21Å; T331-Y556 WeakPolarHBondContact O-CB 3.28Å; T331-L563 HydrophobicContact CG2-CD2 3.8Å |
| 332 | G | 92.8 | Very high | 92.5 | Very high | 0 Ų | 0 | 12.9 Ų | 12.9 | 0% | 0 | 7% | 0.07 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 89.5 | 7.3 | 172.1 | 0 | 0 | 0 | 0 | 0 | 115.3 | Q329 A330 N335 I336 | Q329-G332 PolarHBondContact O-N 2.89Å; A330-G332 PolarHBondContact O-N 3.15Å; G332-N335 PolarHBondContact O-N 3.47Å; G332-I336 WeakPolarHBondContact O-CG1 3.23Å; G332-I336 PolarHBondContact O-N 2.88Å |
| 333 | Q | 89.6 | Confident | 92.1 | Very high | 24 Ų | 24 | 10.8 Ų | 10.8 | 11% | 0.112 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -54.8 | -45.7 | -177.5 | 179.7 | -85.9 | -57.3 | 0 | 0 | 114.5 | N335 I336 L337 Y493 F497 | Q333-N335 VanDerWaalsContact C-N 3.29Å; Q333-N335 PolarHBondContact O-N 3.19Å; Q333-I336 PolarHBondContact O-N 3.45Å; Q333-L337 VanDerWaalsContact NE2-CG 3.33Å; Q333-L337 PolarHBondContact O-N 3.37Å; Q333-L337 VanDerWaalsContact O-N 3.11Å; Q333-Y493 WeakPolarHBondContact CA-OH 3.37Å; Q333-Y493 WeakPolarHBondContact CB-OH 3.35Å; Q333-Y493 PolarHBondContact N-OH 3.07Å; Q333-F497 HydrophobicContact CB-CD2 3.67Å; Q333-F497 HydrophobicContact CB-CE1 4.48Å; Q333-F497 HydrophobicContact CB-CE2 3.47Å; Q333-F497 VanDerWaalsContact CB-CE2 3.47Å; Q333-F497 HydrophobicContact CB-CG 4.26Å; Q333-F497 HydrophobicContact CB-CZ 3.92Å; Q333-F497 HydrophobicContact CG-CD1 3.73Å; Q333-F497 HydrophobicContact CG-CD2 3.66Å; Q333-F497 HydrophobicContact CG-CE1 3.63Å; Q333-F497 HydrophobicContact CG-CE2 3.54Å; Q333-F497 HydrophobicContact CG-CG 3.76Å; Q333-F497 HydrophobicContact CG-CZ 3.53Å |
| 334 | P | 89.3 | Confident | 91.6 | Very high | 6 Ų | 6 | 9.4 Ų | 9.4 | 4% | 0.039 | 5% | 0.048 | C | C | . | . | H | α-helix | trans | -58.6 | -44.3 | 179.8 | -25.1 | 35.1 | 0 | 0 | 0 | 111.9 | L337 S338 N533 | P334-L337 PolarHBondContact O-N 3.47Å; P334-S338 VanDerWaalsContact O-CB 3.32Å; P334-S338 WeakPolarHBondContact O-CB 3.5Å; P334-S338 PolarHBondContact O-N 3.42Å; P334-S338 PolarHBondContact O-OG 2.85Å; P334-N533 WeakPolarHBondContact CB-OD1 3.36Å; P334-N533 WeakPolarHBondContact CG-OD1 3.42Å |
| 335 | N | 91.6 | Very high | 91 | Very high | 0 Ų | 0 | 13 Ų | 13 | 0% | 0 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -68.6 | -42.7 | -178.1 | -65.2 | -12.9 | 0 | 0 | 0 | 112 | G332 Q333 L337 S338 Y339 I536 S537 F540 Y556 | G332-N335 PolarHBondContact O-N 3.47Å; Q333-N335 VanDerWaalsContact C-N 3.29Å; Q333-N335 PolarHBondContact O-N 3.19Å; N335-L337 VanDerWaalsContact C-N 3.26Å; N335-L337 PolarHBondContact O-N 2.92Å; N335-S338 PolarHBondContact O-N 3.01Å; N335-Y339 HydrophobicContact CB-CD2 4.25Å; N335-Y339 WeakPolarHBondContact O-CB 3.4Å; N335-Y339 WeakPolarHBondContact O-CD2 3.12Å; N335-Y339 PolarHBondContact O-N 3.14Å; N335-I536 WeakPolarHBondContact ND2-CG2 3.39Å; N335-I536 PolarHBondContact ND2-O 3.12Å; N335-S537 VanDerWaalsContact OD1-CA 3.25Å; N335-S537 WeakPolarHBondContact OD1-CA 3.36Å; N335-S537 PolarHBondContact OD1-OG 3.28Å; N335-F540 HydrophobicContact CB-CB 4.33Å; N335-F540 HydrophobicContact CB-CD1 4.12Å; N335-F540 HydrophobicContact CB-CD2 3.64Å; N335-F540 HydrophobicContact CB-CE1 4.37Å; N335-F540 HydrophobicContact CB-CE2 3.9Å; N335-F540 HydrophobicContact CB-CG 3.74Å; N335-F540 HydrophobicContact CB-CZ 4.26Å; N335-F540 VanDerWaalsContact ND2-CB 3.31Å; N335-F540 WeakPolarHBondContact ND2-CB 3.36Å; N335-F540 VanDerWaalsContact ND2-CD2 3.3Å; N335-F540 WeakPolarHBondContact ND2-CD2 3.38Å; N335-F540 WeakPolarHBondContact ND2-CG 3.49Å; N335-Y556 PolarHBondContact ND2-OH 2.94Å |
| 336 | I | 92 | Very high | 90.1 | Very high | 1 Ų | 1 | 14.4 Ų | 14.4 | 1% | 0.005 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -63.1 | -34.6 | 178.6 | -69.9 | 166.4 | 0 | 0 | 0 | 111.3 | G332 Q333 A340 F362 L397 L490 Y493 Y556 | G332-I336 WeakPolarHBondContact O-CG1 3.23Å; G332-I336 PolarHBondContact O-N 2.88Å; Q333-I336 PolarHBondContact O-N 3.45Å; I336-A340 VanDerWaalsContact O-CA 3.3Å; I336-A340 WeakPolarHBondContact O-CA 3.31Å; I336-A340 VanDerWaalsContact O-CB 3.31Å; I336-A340 WeakPolarHBondContact O-CB 3.43Å; I336-A340 PolarHBondContact O-N 3.05Å; I336-F362 HydrophobicContact CG2-CE2 4.13Å; I336-L397 HydrophobicContact CD1-CD2 3.76Å; I336-L490 HydrophobicContact CG2-CD2 4.01Å; I336-Y493 HydrophobicContact CB-CD1 4.49Å; I336-Y493 HydrophobicContact CB-CE1 3.94Å; I336-Y493 HydrophobicContact CD1-CD1 3.8Å; I336-Y493 HydrophobicContact CD1-CE1 3.28Å; I336-Y493 HydrophobicContact CD1-CE2 4.13Å; I336-Y493 HydrophobicContact CD1-CG 4.41Å; I336-Y493 VanDerWaalsContact CD1-CZ 3.47Å; I336-Y493 HydrophobicContact CG1-CE1 4.19Å; I336-Y493 HydrophobicContact CG2-CD1 3.9Å; I336-Y493 HydrophobicContact CG2-CE1 3.82Å; I336-Y556 HydrophobicContact CD1-CD2 4.41Å |
| 337 | L | 90.8 | Very high | 89.1 | Confident | 8 Ų | 8 | 10.1 Ų | 10.1 | 4% | 0.042 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -77 | -47.5 | 173.9 | -69.6 | -168 | 0 | 0 | 0 | 112.6 | S99 F220 Q333 P334 N335 Y339 A340 F362 V494 | S99-L337 WeakPolarHBondContact CB-O 3.36Å; F220-L337 HydrophobicContact CZ-CD2 4.45Å; Q333-L337 VanDerWaalsContact NE2-CG 3.33Å; Q333-L337 PolarHBondContact O-N 3.37Å; Q333-L337 VanDerWaalsContact O-N 3.11Å; P334-L337 PolarHBondContact O-N 3.47Å; N335-L337 VanDerWaalsContact C-N 3.26Å; N335-L337 PolarHBondContact O-N 2.92Å; L337-Y339 VanDerWaalsContact C-N 3.3Å; L337-Y339 PolarHBondContact O-N 3.4Å; L337-A340 WeakPolarHBondContact O-CB 3.25Å; L337-A340 PolarHBondContact O-N 3.2Å; L337-F362 HydrophobicContact CD2-CB 4.44Å; L337-F362 HydrophobicContact CD2-CD2 4Å; L337-V494 HydrophobicContact CD2-CG2 4.26Å |
| 338 | S | 90.9 | Very high | 87.9 | Confident | 21 Ų | 21 | 10.2 Ų | 10.2 | 15% | 0.147 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -68.6 | -28.8 | -176.5 | -66.7 | 0 | 0 | 0 | 0 | 113 | S99 P334 N335 | S99-S338 WeakPolarHBondContact CA-O 3.37Å; S99-S338 WeakPolarHBondContact CB-O 3.37Å; S99-S338 PolarHBondContact OG-O 2.65Å; P334-S338 VanDerWaalsContact O-CB 3.32Å; P334-S338 WeakPolarHBondContact O-CB 3.5Å; P334-S338 PolarHBondContact O-N 3.42Å; P334-S338 PolarHBondContact O-OG 2.85Å; N335-S338 PolarHBondContact O-N 3.01Å |
| 339 | Y | 90.6 | Very high | 87.2 | Confident | 1 Ų | 1 | 11.1 Ų | 11.1 | 0% | 0.004 | 6% | 0.061 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -111.7 | 19.8 | 178.2 | -59.3 | -81.3 | 0 | 0 | 0 | 112.8 | L102 V120 N335 L337 S341 P342 L343 F540 L541 | L102-Y339 HydrophobicContact CD2-CD1 3.55Å; L102-Y339 HydrophobicContact CD2-CE1 3.47Å; L102-Y339 VanDerWaalsContact CD2-CE1 3.47Å; V120-Y339 HydrophobicContact CG1-CE2 4.17Å; V120-Y339 HydrophobicContact CG2-CE1 3.93Å; N335-Y339 HydrophobicContact CB-CD2 4.25Å; N335-Y339 WeakPolarHBondContact O-CB 3.4Å; N335-Y339 WeakPolarHBondContact O-CD2 3.12Å; N335-Y339 PolarHBondContact O-N 3.14Å; L337-Y339 VanDerWaalsContact C-N 3.3Å; L337-Y339 PolarHBondContact O-N 3.4Å; Y339-S341 PolarHBondContact O-N 3.3Å; Y339-P342 VanDerWaalsContact O-CD 3.31Å; Y339-P342 WeakPolarHBondContact O-CD 3.47Å; Y339-L343 VanDerWaalsContact O-CB 3.24Å; Y339-L343 WeakPolarHBondContact O-CB 3.23Å; Y339-L343 PolarHBondContact O-N 2.88Å; Y339-F540 HydrophobicContact CD1-CD1 4.38Å; Y339-F540 HydrophobicContact CD1-CE1 4.42Å; Y339-F540 AromaticContact CD2-CD1 3.22Å; Y339-F540 HydrophobicContact CD2-CD1 3.22Å; Y339-F540 AromaticContact CD2-CE1 3.49Å; Y339-F540 HydrophobicContact CD2-CE1 3.49Å; Y339-F540 VanDerWaalsContact CD2-CE1 3.49Å; Y339-F540 HydrophobicContact CD2-CG 4.18Å; Y339-F540 HydrophobicContact CE2-CB 4.24Å; Y339-F540 AromaticContact CE2-CD1 3.43Å; Y339-F540 HydrophobicContact CE2-CD1 3.43Å; Y339-F540 VanDerWaalsContact CE2-CD1 3.43Å; Y339-F540 HydrophobicContact CE2-CE1 4.18Å; Y339-F540 HydrophobicContact CE2-CG 4.17Å; Y339-F540 AromaticContact CG-CD1 3.75Å; Y339-F540 HydrophobicContact CG-CD1 3.75Å; Y339-F540 AromaticContact CG-CE1 3.63Å; Y339-F540 HydrophobicContact CG-CE1 3.63Å; Y339-L541 HydrophobicContact CD1-CD1 4.33Å; Y339-L541 HydrophobicContact CD1-CD2 3.94Å; Y339-L541 HydrophobicContact CD1-CG 4.33Å; Y339-L541 HydrophobicContact CE1-CD1 3.52Å; Y339-L541 HydrophobicContact CE1-CD2 3.88Å; Y339-L541 HydrophobicContact CE1-CG 3.75Å; Y339-L541 HydrophobicContact CG-CD2 4.49Å |
| 340 | A | 90 | Very high | 86.1 | Confident | 0 Ų | 0 | 16 Ų | 16 | 0% | 0 | 9% | 0.087 | C | C | . | . | H | α-helix | trans | -52 | -55.6 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | S99 F220 I336 L337 L343 L344 F362 | S99-A340 PolarHBondContact OG-N 3.02Å; F220-A340 HydrophobicContact CE1-CB 4.05Å; F220-A340 HydrophobicContact CZ-CB 4.28Å; I336-A340 VanDerWaalsContact O-CA 3.3Å; I336-A340 WeakPolarHBondContact O-CA 3.31Å; I336-A340 VanDerWaalsContact O-CB 3.31Å; I336-A340 WeakPolarHBondContact O-CB 3.43Å; I336-A340 PolarHBondContact O-N 3.05Å; L337-A340 WeakPolarHBondContact O-CB 3.25Å; L337-A340 PolarHBondContact O-N 3.2Å; A340-L343 PolarHBondContact O-N 2.95Å; A340-L344 VanDerWaalsContact O-CG 3.32Å; A340-L344 WeakPolarHBondContact O-CG 3.24Å; A340-L344 PolarHBondContact O-N 3.08Å; A340-F362 HydrophobicContact CB-CD2 3.81Å; A340-F362 HydrophobicContact CB-CE2 3.6Å; A340-F362 HydrophobicContact CB-CZ 4.32Å |
| 341 | S | 87.9 | Confident | 85.3 | Confident | 0 Ų | 0 | 18 Ų | 18 | 0% | 0 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -63.5 | -46.6 | -179.5 | -52.4 | 0 | 0 | 0 | 0 | 112.2 | S99 L103 Y339 L343 L344 R345 S359 | S99-S341 PolarHBondContact OG-N 3.09Å; L103-S341 VanDerWaalsContact CD1-CB 3.44Å; Y339-S341 PolarHBondContact O-N 3.3Å; S341-L343 VanDerWaalsContact C-N 3.33Å; S341-L343 PolarHBondContact O-N 3Å; S341-L344 PolarHBondContact O-N 3.43Å; S341-R345 WeakPolarHBondContact O-CB 3.42Å; S341-R345 PolarHBondContact O-N 3.14Å; S341-S359 PolarHBondContact OG-OG 3.48Å |
| 342 | P | 84.1 | Confident | 84.6 | Confident | 9 Ų | 9 | 21 Ų | 21 | 6% | 0.058 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -56.3 | -39.8 | 170.6 | -26.6 | 32.3 | 0 | 0 | 0 | 115 | L102 L103 Y339 R345 S346 | L102-P342 HydrophobicContact CD2-CG 4.24Å; L103-P342 HydrophobicContact CD2-CB 4.29Å; L103-P342 HydrophobicContact CD2-CG 3.87Å; L103-P342 HydrophobicContact CG-CG 4.2Å; Y339-P342 VanDerWaalsContact O-CD 3.31Å; Y339-P342 WeakPolarHBondContact O-CD 3.47Å; P342-R345 WeakPolarHBondContact O-CB 3.49Å; P342-R345 PolarHBondContact O-N 3.38Å; P342-S346 PolarHBondContact O-N 3.11Å |
| 343 | L | 86.3 | Confident | 84 | Confident | 3 Ų | 3 | 24 Ų | 24 | 2% | 0.016 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -68.5 | -37.7 | 178.5 | -173.9 | 66.3 | 0 | 0 | 0 | 111.6 | Y339 A340 S341 S346 V347 L490 V549 M553 | Y339-L343 VanDerWaalsContact O-CB 3.24Å; Y339-L343 WeakPolarHBondContact O-CB 3.23Å; Y339-L343 PolarHBondContact O-N 2.88Å; A340-L343 PolarHBondContact O-N 2.95Å; S341-L343 VanDerWaalsContact C-N 3.33Å; S341-L343 PolarHBondContact O-N 3Å; L343-S346 PolarHBondContact O-N 2.66Å; L343-S346 PolarHBondContact O-OG 3.42Å; L343-V347 VanDerWaalsContact O-CG2 3.26Å; L343-V347 WeakPolarHBondContact O-CG2 3.27Å; L343-V347 PolarHBondContact O-N 3.43Å; L343-L490 HydrophobicContact CD2-CD1 3.92Å; L343-L490 HydrophobicContact CD2-CD2 3.69Å; L343-L490 HydrophobicContact CD2-CG 4.47Å; L343-L490 HydrophobicContact CG-CD1 4.32Å; L343-V549 HydrophobicContact CD1-CG1 3.73Å; L343-M553 HydrophobicContact CD1-CE 4.45Å |
| 344 | L | 86.3 | Confident | 83.8 | Confident | 0 Ų | 0 | 24.4 Ų | 24.4 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -70.8 | -37.7 | 174.8 | -70 | 166.1 | 0 | 0 | 0 | 111.4 | A340 S341 S346 V347 F349 A355 A358 F362 L487 L490 | A340-L344 VanDerWaalsContact O-CG 3.32Å; A340-L344 WeakPolarHBondContact O-CG 3.24Å; A340-L344 PolarHBondContact O-N 3.08Å; S341-L344 PolarHBondContact O-N 3.43Å; L344-S346 VanDerWaalsContact C-N 3.3Å; L344-S346 PolarHBondContact O-N 2.97Å; L344-V347 PolarHBondContact O-N 3.22Å; L344-F349 HydrophobicContact CB-CD2 4.17Å; L344-F349 HydrophobicContact CD2-CD2 4.38Å; L344-F349 HydrophobicContact CD2-CE2 4.16Å; L344-F349 VanDerWaalsContact O-CD2 3.32Å; L344-F349 WeakPolarHBondContact O-CD2 3.42Å; L344-F349 PolarHBondContact O-N 2.94Å; L344-A355 HydrophobicContact CB-CB 4.29Å; L344-A358 HydrophobicContact CD1-CB 3.78Å; L344-F362 HydrophobicContact CD1-CE1 4.05Å; L344-F362 HydrophobicContact CD1-CZ 4.17Å; L344-L487 HydrophobicContact CD2-CD1 3.69Å; L344-L490 HydrophobicContact CD2-CD1 3.95Å |
| 345 | R | 82.2 | Confident | 83.6 | Confident | 75 Ų | 75 | 24.1 Ų | 24.1 | 28% | 0.283 | 14% | 0.138 | S | C | . | . | H | α-helix | trans | -57.4 | -44.8 | 172.6 | -164.5 | 81.3 | 176.6 | 80.8 | -2.2 | 111.1 | S341 P342 V347 G348 F349 D350 D352 A355 | S341-R345 WeakPolarHBondContact O-CB 3.42Å; S341-R345 PolarHBondContact O-N 3.14Å; P342-R345 WeakPolarHBondContact O-CB 3.49Å; P342-R345 PolarHBondContact O-N 3.38Å; R345-V347 VanDerWaalsContact C-N 3.31Å; R345-V347 PolarHBondContact O-N 2.91Å; R345-G348 PolarHBondContact O-N 3.47Å; R345-F349 VanDerWaalsContact CD-O 3.29Å; R345-F349 WeakPolarHBondContact CD-O 3.48Å; R345-F349 PolarHBondContact NH1-O 3.5Å; R345-D350 PolarHBondContact NH1-O 2.99Å; R345-D350 PolarHBondContact NH2-O 3.42Å; R345-D352 WeakPolarHBondContact CD-OD1 3.22Å; R345-D352 IonicContact CZ-OD1 3.77Å; R345-D352 IonicContact NE-OD1 3.94Å; R345-D352 PolarHBondContact NE-OD1 3.12Å; R345-D352 IonicContact NH2-OD1 2.78Å; R345-A355 HydrophobicContact CB-CB 4.23Å |
| 346 | S | 75.8 | Confident | 83.3 | Confident | 30 Ų | 30 | 24.1 Ų | 24.1 | 21% | 0.21 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -69.1 | -27.4 | -179.5 | 71.3 | 0 | 0 | 0 | 0 | 113.5 | P342 L343 L344 G348 L411 | P342-S346 PolarHBondContact O-N 3.11Å; L343-S346 PolarHBondContact O-N 2.66Å; L343-S346 PolarHBondContact O-OG 3.42Å; L344-S346 VanDerWaalsContact C-N 3.3Å; L344-S346 PolarHBondContact O-N 2.97Å; S346-G348 PolarHBondContact O-N 3.4Å; S346-L411 WeakPolarHBondContact O-CD1 3.34Å; S346-L411 VanDerWaalsContact O-CG 3.25Å; S346-L411 WeakPolarHBondContact O-CG 3.37Å |
| 347 | V | 74.7 | Confident | 83.2 | Confident | 3 Ų | 3 | 27.9 Ų | 27.9 | 2% | 0.018 | 16% | 0.158 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -75.1 | -6.2 | 175.9 | 168.4 | 0 | 0 | 0 | 0 | 113 | L343 L344 R345 T404 L411 L478 | L343-V347 VanDerWaalsContact O-CG2 3.26Å; L343-V347 WeakPolarHBondContact O-CG2 3.27Å; L343-V347 PolarHBondContact O-N 3.43Å; L344-V347 PolarHBondContact O-N 3.22Å; R345-V347 VanDerWaalsContact C-N 3.31Å; R345-V347 PolarHBondContact O-N 2.91Å; V347-T404 HydrophobicContact CG2-CG2 4.46Å; V347-L411 HydrophobicContact CG2-CD2 4.39Å; V347-L478 WeakPolarHBondContact O-CD2 3.27Å |
| 348 | G | 71 | Confident | 83 | Confident | 14 Ų | 14 | 28.2 Ų | 28.2 | 14% | 0.144 | 16% | 0.162 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 108.1 | 21.5 | 174 | 0 | 0 | 0 | 0 | 0 | 114.7 | R345 S346 D350 K483 | R345-G348 PolarHBondContact O-N 3.47Å; S346-G348 PolarHBondContact O-N 3.4Å; G348-D350 PolarHBondContact O-N 3.27Å; G348-K483 WeakPolarHBondContact O-CD 3.45Å; G348-K483 WeakPolarHBondContact O-CE 3.32Å; G348-K483 PolarHBondContact O-NZ 2.93Å |
| 349 | F | 80.1 | Confident | 82.9 | Confident | 27 Ų | 27 | 27.2 Ų | 27.2 | 12% | 0.118 | 16% | 0.155 | C | C | . | . | trans | -76.9 | 100 | 160.6 | -74.4 | -91.3 | 0 | 0 | 0 | 107.8 | L344 R345 S351 A354 A355 A358 L487 | L344-F349 HydrophobicContact CB-CD2 4.17Å; L344-F349 HydrophobicContact CD2-CD2 4.38Å; L344-F349 HydrophobicContact CD2-CE2 4.16Å; L344-F349 VanDerWaalsContact O-CD2 3.32Å; L344-F349 WeakPolarHBondContact O-CD2 3.42Å; L344-F349 PolarHBondContact O-N 2.94Å; R345-F349 VanDerWaalsContact CD-O 3.29Å; R345-F349 WeakPolarHBondContact CD-O 3.48Å; R345-F349 PolarHBondContact NH1-O 3.5Å; F349-S351 PolarHBondContact O-N 3.21Å; F349-S351 VanDerWaalsContact O-N 3.17Å; F349-A354 HydrophobicContact CB-CB 4.46Å; F349-A354 HydrophobicContact CD1-CB 4.09Å; F349-A355 HydrophobicContact CB-CB 4.17Å; F349-A358 HydrophobicContact CD1-CB 4.46Å; F349-A358 HydrophobicContact CE1-CB 4.17Å; F349-A358 HydrophobicContact CZ-CB 4.31Å; F349-L487 HydrophobicContact CE2-CB 4.44Å; F349-L487 HydrophobicContact CZ-CB 4.45Å; F349-L487 HydrophobicContact CZ-CD2 3.98Å | ||
| 350 | D | 71.2 | Confident | 82.9 | Confident | 105 Ų | 105 | 27.7 Ų | 27.7 | 56% | 0.561 | 16% | 0.158 | S | C | * | . | trans | -74 | -4 | -164.5 | -64.5 | -54.4 | 0 | 0 | 0 | 115.2 | R345 G348 K483 | R345-D350 PolarHBondContact NH1-O 2.99Å; R345-D350 PolarHBondContact NH2-O 3.42Å; G348-D350 PolarHBondContact O-N 3.27Å; D350-K483 IonicContact OD2-NZ 3.96Å; D350-K483 PolarHBondContact OD2-NZ 3.49Å | ||
| 351 | S | 79.9 | Confident | 83 | Confident | 51 Ų | 51 | 28.8 Ų | 28.8 | 36% | 0.357 | 17% | 0.17 | S | C | . | . | S | Bend | trans | -126.4 | 147 | 173.8 | 67.1 | 0 | 0 | 0 | 0 | 112.4 | F349 D353 A354 A355 | F349-S351 PolarHBondContact O-N 3.21Å; F349-S351 VanDerWaalsContact O-N 3.17Å; S351-D353 PolarHBondContact O-N 3.3Å; S351-A354 PolarHBondContact O-N 3.46Å; S351-A354 WeakPolarHBondContact OG-CB 3.22Å; S351-A354 PolarHBondContact OG-N 3.15Å; S351-A354 VanDerWaalsContact OG-N 3.13Å; S351-A355 PolarHBondContact O-N 3.43Å |
| 352 | D | 79.1 | Confident | 83.2 | Confident | 63 Ų | 63 | 28.8 Ų | 28.8 | 34% | 0.337 | 17% | 0.17 | S | C | . | . | H | α-helix | trans | -62.4 | -32.8 | 176.7 | -63.9 | -9.1 | 0 | 0 | 0 | 111.2 | T227 R345 T356 | T227-D352 HydrophobicContact CG2-CB 4.31Å; R345-D352 WeakPolarHBondContact CD-OD1 3.22Å; R345-D352 IonicContact CZ-OD1 3.77Å; R345-D352 IonicContact NE-OD1 3.94Å; R345-D352 PolarHBondContact NE-OD1 3.12Å; R345-D352 IonicContact NH2-OD1 2.78Å; D352-T356 WeakPolarHBondContact O-CB 3.37Å; D352-T356 PolarHBondContact O-N 3.37Å; D352-T356 PolarHBondContact O-OG1 2.94Å |
| 353 | D | 81.8 | Confident | 83.5 | Confident | 62 Ų | 62 | 28.4 Ų | 28.4 | 33% | 0.332 | 17% | 0.167 | S | C | . | . | H | α-helix | trans | -63.4 | -46.7 | 173.5 | -67.4 | -24.1 | 0 | 0 | 0 | 111.9 | T227 T228 S351 T356 L357 | T227-D353 WeakPolarHBondContact CB-OD1 3.45Å; T227-D353 WeakPolarHBondContact CG2-OD1 3.44Å; T228-D353 WeakPolarHBondContact CG2-OD1 3.4Å; S351-D353 PolarHBondContact O-N 3.3Å; D353-T356 PolarHBondContact O-N 3.43Å; D353-L357 VanDerWaalsContact O-CB 3.24Å; D353-L357 WeakPolarHBondContact O-CB 3.47Å; D353-L357 PolarHBondContact O-N 3.32Å |
| 354 | A | 84.2 | Confident | 83.9 | Confident | 33 Ų | 33 | 31.4 Ų | 31.4 | 27% | 0.273 | 19% | 0.185 | S | C | . | . | H | α-helix | trans | -69.1 | -38.9 | -179.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | F349 S351 L357 A358 | F349-A354 HydrophobicContact CB-CB 4.46Å; F349-A354 HydrophobicContact CD1-CB 4.09Å; S351-A354 PolarHBondContact O-N 3.46Å; S351-A354 WeakPolarHBondContact OG-CB 3.22Å; S351-A354 PolarHBondContact OG-N 3.15Å; S351-A354 VanDerWaalsContact OG-N 3.13Å; A354-L357 PolarHBondContact O-N 3.01Å; A354-A358 VanDerWaalsContact O-CB 3.31Å; A354-A358 WeakPolarHBondContact O-CB 3.29Å; A354-A358 PolarHBondContact O-N 3.49Å |
| 355 | A | 85.3 | Confident | 84.2 | Confident | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -65 | -42.2 | 176 | 0 | 0 | 0 | 0 | 0 | 112.1 | L344 R345 F349 S351 A358 S359 | L344-A355 HydrophobicContact CB-CB 4.29Å; R345-A355 HydrophobicContact CB-CB 4.23Å; F349-A355 HydrophobicContact CB-CB 4.17Å; S351-A355 PolarHBondContact O-N 3.43Å; A355-A358 PolarHBondContact O-N 3.14Å; A355-S359 PolarHBondContact O-N 3.04Å |
| 356 | T | 85.2 | Confident | 84.7 | Confident | 1 Ų | 1 | 30.3 Ų | 30.3 | 1% | 0.006 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -74.4 | -31.1 | 179 | -50.3 | 0 | 0 | 0 | 0 | 112.3 | D352 D353 S359 T360 | D352-T356 WeakPolarHBondContact O-CB 3.37Å; D352-T356 PolarHBondContact O-N 3.37Å; D352-T356 PolarHBondContact O-OG1 2.94Å; D353-T356 PolarHBondContact O-N 3.43Å; T356-S359 WeakPolarHBondContact CA-OG 3.27Å; T356-S359 PolarHBondContact O-OG 3.15Å; T356-T360 PolarHBondContact O-N 3.27Å; T356-T360 PolarHBondContact O-OG1 3.02Å; T356-T360 VanDerWaalsContact O-OG1 3.14Å |
| 357 | L | 89.3 | Confident | 85.4 | Confident | 79 Ų | 79 | 29.2 Ų | 29.2 | 41% | 0.414 | 18% | 0.177 | S | C | . | . | H | α-helix | trans | -65.7 | -45.7 | 169.9 | -179 | 60.2 | 0 | 0 | 0 | 111.2 | Y224 D353 A354 S359 T360 | Y224-L357 HydrophobicContact CD1-CD1 4.13Å; Y224-L357 HydrophobicContact CD2-CB 3.83Å; Y224-L357 HydrophobicContact CD2-CD1 4.42Å; Y224-L357 HydrophobicContact CE1-CD1 3.9Å; Y224-L357 HydrophobicContact CE2-CB 3.75Å; Y224-L357 HydrophobicContact CE2-CD1 4.22Å; Y224-L357 HydrophobicContact CE2-CD2 4.5Å; Y224-L357 HydrophobicContact CE2-CG 4.37Å; Y224-L357 HydrophobicContact CG-CB 4.45Å; Y224-L357 HydrophobicContact CG-CD1 4.37Å; D353-L357 VanDerWaalsContact O-CB 3.24Å; D353-L357 WeakPolarHBondContact O-CB 3.47Å; D353-L357 PolarHBondContact O-N 3.32Å; A354-L357 PolarHBondContact O-N 3.01Å; L357-S359 VanDerWaalsContact C-N 3.32Å; L357-S359 PolarHBondContact O-N 3.31Å; L357-T360 VanDerWaalsContact O-CB 3.23Å; L357-T360 WeakPolarHBondContact O-CB 3.36Å; L357-T360 PolarHBondContact O-N 3.12Å; L357-T360 VanDerWaalsContact O-N 3.12Å |
| 358 | A | 87.9 | Confident | 86.3 | Confident | 15 Ų | 15 | 33.6 Ų | 33.6 | 12% | 0.124 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -63.7 | -36.1 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | L344 F349 A354 A355 T360 G361 L487 | L344-A358 HydrophobicContact CD1-CB 3.78Å; F349-A358 HydrophobicContact CD1-CB 4.46Å; F349-A358 HydrophobicContact CE1-CB 4.17Å; F349-A358 HydrophobicContact CZ-CB 4.31Å; A354-A358 VanDerWaalsContact O-CB 3.31Å; A354-A358 WeakPolarHBondContact O-CB 3.29Å; A354-A358 PolarHBondContact O-N 3.49Å; A355-A358 PolarHBondContact O-N 3.14Å; A358-T360 VanDerWaalsContact C-N 3.26Å; A358-T360 PolarHBondContact O-N 3.28Å; A358-G361 PolarHBondContact O-N 3.18Å; A358-G361 VanDerWaalsContact O-N 3.09Å; A358-L487 HydrophobicContact CB-CD1 4.3Å; A358-L487 HydrophobicContact CB-CD2 4.45Å |
| 359 | S | 89.3 | Confident | 87.2 | Confident | 0 Ų | 0 | 33.2 Ų | 33.2 | 0% | 0 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -67.9 | -23.7 | 174.3 | 67 | 0 | 0 | 0 | 0 | 113.4 | S341 A355 T356 L357 G361 F362 | S341-S359 PolarHBondContact OG-OG 3.48Å; A355-S359 PolarHBondContact O-N 3.04Å; T356-S359 WeakPolarHBondContact CA-OG 3.27Å; T356-S359 PolarHBondContact O-OG 3.15Å; L357-S359 VanDerWaalsContact C-N 3.32Å; L357-S359 PolarHBondContact O-N 3.31Å; S359-G361 PolarHBondContact O-N 3.16Å; S359-F362 VanDerWaalsContact O-CB 3.25Å; S359-F362 WeakPolarHBondContact O-CB 3.46Å; S359-F362 PolarHBondContact O-N 3.45Å |
| 360 | T | 90.4 | Very high | 87.5 | Confident | 12 Ų | 12 | 32.2 Ų | 32.2 | 7% | 0.074 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -59.7 | -30.6 | 170.1 | -56.5 | 0 | 0 | 0 | 0 | 112.2 | F220 S221 T356 L357 A358 F362 G363 V364 | F220-T360 PolarHBondContact O-OG1 3.49Å; S221-T360 WeakPolarHBondContact OG-CG2 3.29Å; T356-T360 PolarHBondContact O-N 3.27Å; T356-T360 PolarHBondContact O-OG1 3.02Å; T356-T360 VanDerWaalsContact O-OG1 3.14Å; L357-T360 VanDerWaalsContact O-CB 3.23Å; L357-T360 WeakPolarHBondContact O-CB 3.36Å; L357-T360 PolarHBondContact O-N 3.12Å; L357-T360 VanDerWaalsContact O-N 3.12Å; A358-T360 VanDerWaalsContact C-N 3.26Å; A358-T360 PolarHBondContact O-N 3.28Å; T360-F362 PolarHBondContact O-N 2.89Å; T360-G363 PolarHBondContact O-N 3.41Å; T360-G363 VanDerWaalsContact O-N 3.16Å; T360-V364 PolarHBondContact O-N 3.23Å |
| 361 | G | 91.3 | Very high | 88.2 | Confident | 23 Ų | 23 | 30.8 Ų | 30.8 | 24% | 0.237 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -57.6 | -30.9 | 172.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | A358 S359 V364 V365 | A358-G361 PolarHBondContact O-N 3.18Å; A358-G361 VanDerWaalsContact O-N 3.09Å; S359-G361 PolarHBondContact O-N 3.16Å; G361-V364 PolarHBondContact O-N 3.45Å; G361-V365 WeakPolarHBondContact O-CB 3.5Å; G361-V365 WeakPolarHBondContact O-CG2 3.12Å; G361-V365 PolarHBondContact O-N 3.18Å |
| 362 | F | 91.9 | Very high | 88.4 | Confident | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -66.8 | -42.1 | 179.7 | -68.6 | 28.1 | 0 | 0 | 0 | 109.9 | F220 I336 L337 A340 L344 S359 T360 K366 L487 L490 L491 V494 | F220-F362 HydrophobicContact CE2-CB 4.15Å; F220-F362 HydrophobicContact CZ-CB 4.46Å; I336-F362 HydrophobicContact CG2-CE2 4.13Å; L337-F362 HydrophobicContact CD2-CB 4.44Å; L337-F362 HydrophobicContact CD2-CD2 4Å; A340-F362 HydrophobicContact CB-CD2 3.81Å; A340-F362 HydrophobicContact CB-CE2 3.6Å; A340-F362 HydrophobicContact CB-CZ 4.32Å; L344-F362 HydrophobicContact CD1-CE1 4.05Å; L344-F362 HydrophobicContact CD1-CZ 4.17Å; S359-F362 VanDerWaalsContact O-CB 3.25Å; S359-F362 WeakPolarHBondContact O-CB 3.46Å; S359-F362 PolarHBondContact O-N 3.45Å; T360-F362 PolarHBondContact O-N 2.89Å; F362-K366 VanDerWaalsContact O-CB 3.28Å; F362-K366 WeakPolarHBondContact O-CB 3.46Å; F362-K366 PolarHBondContact O-N 3.18Å; F362-L487 HydrophobicContact CE1-CD1 4.12Å; F362-L490 HydrophobicContact CE1-CB 4.14Å; F362-L490 HydrophobicContact CZ-CB 3.68Å; F362-L490 HydrophobicContact CZ-CD1 4.1Å; F362-L490 HydrophobicContact CZ-CD2 4.5Å; F362-L490 HydrophobicContact CZ-CG 4.3Å; F362-L491 HydrophobicContact CD1-CD2 3.51Å; F362-L491 HydrophobicContact CE1-CD2 3.94Å; F362-L491 HydrophobicContact CG-CD2 4.46Å; F362-V494 HydrophobicContact CB-CG1 4.42Å; F362-V494 HydrophobicContact CB-CG2 4.38Å; F362-V494 HydrophobicContact CD2-CG2 3.74Å; F362-V494 HydrophobicContact CE2-CG2 4.18Å; F362-V494 HydrophobicContact CG-CG2 4.08Å |
| 363 | G | 91.2 | Very high | 88.6 | Confident | 0 Ų | 0 | 28 Ų | 28 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -61.1 | -45.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | T360 K366 V367 | T360-G363 PolarHBondContact O-N 3.41Å; T360-G363 VanDerWaalsContact O-N 3.16Å; G363-K366 WeakPolarHBondContact O-CB 3.23Å; G363-K366 PolarHBondContact O-N 3.45Å; G363-V367 WeakPolarHBondContact O-CG2 3.45Å; G363-V367 PolarHBondContact O-N 2.89Å |
| 364 | V | 93.5 | Very high | 88.6 | Confident | 66 Ų | 66 | 27.2 Ų | 27.2 | 40% | 0.4 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -62.1 | -49.4 | 178.1 | 176 | 0 | 0 | 0 | 0 | 111.1 | M217 T360 G361 K366 V367 V368 | M217-V364 HydrophobicContact CG-CG2 4.37Å; M217-V364 HydrophobicContact SD-CG2 4.29Å; T360-V364 PolarHBondContact O-N 3.23Å; G361-V364 PolarHBondContact O-N 3.45Å; V364-K366 VanDerWaalsContact C-N 3.26Å; V364-K366 PolarHBondContact O-N 3.5Å; V364-V367 PolarHBondContact O-N 3.07Å; V364-V368 HydrophobicContact CG1-CG2 4.38Å; V364-V368 WeakPolarHBondContact O-CG2 3.2Å; V364-V368 PolarHBondContact O-N 2.97Å |
| 365 | V | 94 | Very high | 88.5 | Confident | 35 Ų | 35 | 31 Ų | 31 | 21% | 0.212 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -61.5 | -36.9 | 178.5 | 167.6 | 0 | 0 | 0 | 0 | 111.3 | G361 V368 G369 L491 V494 A495 | G361-V365 WeakPolarHBondContact O-CB 3.5Å; G361-V365 WeakPolarHBondContact O-CG2 3.12Å; G361-V365 PolarHBondContact O-N 3.18Å; V365-V368 PolarHBondContact O-N 2.95Å; V365-G369 PolarHBondContact O-N 3.33Å; V365-L491 WeakPolarHBondContact CG1-O 3.34Å; V365-L491 HydrophobicContact CG2-CB 4.41Å; V365-L491 HydrophobicContact CG2-CD2 3.97Å; V365-V494 HydrophobicContact CG1-CB 4.48Å; V365-V494 HydrophobicContact CG1-CG1 4.3Å; V365-A495 HydrophobicContact CG1-CB 3.42Å; V365-A495 VanDerWaalsContact CG1-CB 3.42Å |
| 366 | K | 91.6 | Very high | 88.5 | Confident | 18 Ų | 18 | 34.6 Ų | 34.6 | 8% | 0.078 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -60.9 | -49.7 | 174.9 | -157.7 | 175.6 | -176.5 | 161.2 | 0 | 111 | V213 V216 F362 G363 V364 V368 G369 T370 V494 S498 | V213-K366 HydrophobicContact CG1-CB 3.77Å; V213-K366 HydrophobicContact CG1-CD 4.16Å; V213-K366 HydrophobicContact CG1-CG 3.6Å; V213-K366 HydrophobicContact CG2-CG 4.37Å; V216-K366 HydrophobicContact CB-CD 4.37Å; V216-K366 HydrophobicContact CG1-CD 4.1Å; V216-K366 HydrophobicContact CG2-CD 4.39Å; F362-K366 VanDerWaalsContact O-CB 3.28Å; F362-K366 WeakPolarHBondContact O-CB 3.46Å; F362-K366 PolarHBondContact O-N 3.18Å; G363-K366 WeakPolarHBondContact O-CB 3.23Å; G363-K366 PolarHBondContact O-N 3.45Å; V364-K366 VanDerWaalsContact C-N 3.26Å; V364-K366 PolarHBondContact O-N 3.5Å; K366-V368 PolarHBondContact O-N 3.09Å; K366-G369 PolarHBondContact O-N 2.79Å; K366-T370 PolarHBondContact O-N 3.48Å; K366-T370 PolarHBondContact O-OG1 3.3Å; K366-V494 HydrophobicContact CB-CG1 4.34Å; K366-S498 WeakPolarHBondContact CA-OG 3.45Å; K366-S498 VanDerWaalsContact CG-OG 3.32Å; K366-S498 WeakPolarHBondContact CG-OG 3.43Å |
| 367 | V | 91.4 | Very high | 88.2 | Confident | 6 Ų | 6 | 35.3 Ų | 35.3 | 4% | 0.036 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -58.5 | -50.2 | 177.4 | 176.1 | 0 | 0 | 0 | 0 | 110.9 | I18 V213 M217 G363 V364 G369 T370 I371 | I18-V367 HydrophobicContact CD1-CG1 4.34Å; V213-V367 VanDerWaalsContact CG1-CA 3.4Å; V213-V367 HydrophobicContact CG1-CB 4.11Å; V213-V367 HydrophobicContact CG1-CG2 3.66Å; M217-V367 HydrophobicContact CB-CG2 4.14Å; M217-V367 HydrophobicContact SD-CG2 4.11Å; G363-V367 WeakPolarHBondContact O-CG2 3.45Å; G363-V367 PolarHBondContact O-N 2.89Å; V364-V367 PolarHBondContact O-N 3.07Å; V367-G369 VanDerWaalsContact C-N 3.33Å; V367-G369 PolarHBondContact O-N 2.74Å; V367-T370 PolarHBondContact O-N 3.21Å; V367-I371 HydrophobicContact CG1-CD1 4.24Å; V367-I371 WeakPolarHBondContact O-CG1 3.45Å; V367-I371 PolarHBondContact O-N 2.97Å |
| 368 | V | 92.1 | Very high | 87.7 | Confident | 95 Ų | 95 | 37.8 Ų | 37.8 | 58% | 0.576 | 22% | 0.221 | S | C | * | . | H | α-helix | trans | -65 | -37 | -177.8 | 174.2 | 0 | 0 | 0 | 0 | 111.6 | V364 V365 K366 P372 | V364-V368 HydrophobicContact CG1-CG2 4.38Å; V364-V368 WeakPolarHBondContact O-CG2 3.2Å; V364-V368 PolarHBondContact O-N 2.97Å; V365-V368 PolarHBondContact O-N 2.95Å; K366-V368 PolarHBondContact O-N 3.09Å; V368-P372 WeakPolarHBondContact O-CD 3.42Å |
| 369 | G | 89.8 | Confident | 87.5 | Confident | 6 Ų | 6 | 46 Ų | 46 | 6% | 0.062 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -73.3 | -37.2 | 179.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | V365 K366 V367 P372 I499 | V365-G369 PolarHBondContact O-N 3.33Å; K366-G369 PolarHBondContact O-N 2.79Å; V367-G369 VanDerWaalsContact C-N 3.33Å; V367-G369 PolarHBondContact O-N 2.74Å; G369-P372 WeakPolarHBondContact O-CD 3.45Å; G369-I499 WeakPolarHBondContact O-CG1 3.43Å |
| 370 | T | 87.1 | Confident | 87.2 | Confident | 6 Ų | 6 | 48.9 Ų | 48.9 | 4% | 0.037 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -71.5 | -32.5 | -177.3 | -58.3 | 0 | 0 | 0 | 0 | 112.9 | V213 K366 V367 A373 V374 | V213-T370 HydrophobicContact CG2-CG2 4.27Å; K366-T370 PolarHBondContact O-N 3.48Å; K366-T370 PolarHBondContact O-OG1 3.3Å; V367-T370 PolarHBondContact O-N 3.21Å; T370-A373 WeakPolarHBondContact O-CB 3.3Å; T370-A373 PolarHBondContact O-N 3.29Å; T370-V374 HydrophobicContact CG2-CG2 4.18Å; T370-V374 WeakPolarHBondContact O-CG2 3.27Å; T370-V374 PolarHBondContact O-N 3.43Å; T370-V374 VanDerWaalsContact O-N 3.11Å |
| 371 | I | 86.4 | Confident | 86.9 | Confident | 76 Ų | 76 | 48.3 Ų | 48.3 | 39% | 0.39 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -60.2 | -53.9 | -177.7 | -67.7 | 165 | 0 | 0 | 0 | 112.1 | L210 V367 A373 V374 L375 | L210-I371 HydrophobicContact CD1-CG1 4.35Å; V367-I371 HydrophobicContact CG1-CD1 4.24Å; V367-I371 WeakPolarHBondContact O-CG1 3.45Å; V367-I371 PolarHBondContact O-N 2.97Å; I371-A373 VanDerWaalsContact C-N 3.28Å; I371-A373 PolarHBondContact O-N 3.4Å; I371-V374 PolarHBondContact O-N 3.26Å; I371-L375 HydrophobicContact CG2-CD1 3.96Å; I371-L375 WeakPolarHBondContact O-CG 3.35Å; I371-L375 PolarHBondContact O-N 3.3Å |
| 372 | P | 84.9 | Confident | 86.7 | Confident | 56 Ų | 56 | 47.4 Ų | 47.4 | 36% | 0.364 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -60.4 | -36.7 | 175.9 | -24.1 | 33.5 | 0 | 0 | 0 | 113.3 | V368 G369 V374 L375 L376 | V368-P372 WeakPolarHBondContact O-CD 3.42Å; G369-P372 WeakPolarHBondContact O-CD 3.45Å; P372-V374 PolarHBondContact O-N 2.98Å; P372-L375 PolarHBondContact O-N 2.85Å; P372-L376 HydrophobicContact CB-CD1 4.34Å; P372-L376 VanDerWaalsContact O-CB 3.24Å; P372-L376 WeakPolarHBondContact O-CB 3.24Å; P372-L376 WeakPolarHBondContact O-CG 3.42Å; P372-L376 PolarHBondContact O-N 3.04Å |
| 373 | A | 83.3 | Confident | 86.6 | Confident | 0 Ų | 0 | 49.1 Ų | 49.1 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -59.4 | -48.4 | -179.6 | 0 | 0 | 0 | 0 | 0 | 111.2 | T370 I371 L375 L376 V377 I499 P503 M504 | T370-A373 WeakPolarHBondContact O-CB 3.3Å; T370-A373 PolarHBondContact O-N 3.29Å; I371-A373 VanDerWaalsContact C-N 3.28Å; I371-A373 PolarHBondContact O-N 3.4Å; A373-L375 VanDerWaalsContact C-N 3.34Å; A373-L375 PolarHBondContact O-N 2.88Å; A373-L376 PolarHBondContact O-N 3.1Å; A373-V377 WeakPolarHBondContact O-CB 3.29Å; A373-V377 PolarHBondContact O-N 3.48Å; A373-I499 WeakPolarHBondContact CB-O 3.29Å; A373-P503 HydrophobicContact CB-CG 3.96Å; A373-M504 HydrophobicContact CB-CE 4.41Å |
| 374 | V | 79.8 | Confident | 86.7 | Confident | 45 Ų | 45 | 53.4 Ų | 53.4 | 27% | 0.273 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -66.3 | -35.3 | 178.3 | 175.4 | 0 | 0 | 0 | 0 | 111.9 | T206 T370 I371 P372 V377 | T206-V374 HydrophobicContact CG2-CG1 3.67Å; T370-V374 HydrophobicContact CG2-CG2 4.18Å; T370-V374 WeakPolarHBondContact O-CG2 3.27Å; T370-V374 PolarHBondContact O-N 3.43Å; T370-V374 VanDerWaalsContact O-N 3.11Å; I371-V374 PolarHBondContact O-N 3.26Å; P372-V374 PolarHBondContact O-N 2.98Å; V374-V377 WeakPolarHBondContact O-CG1 3.48Å |
| 375 | L | 82.4 | Confident | 86.6 | Confident | 112 Ų | 112 | 51.4 Ų | 51.4 | 59% | 0.586 | 27% | 0.269 | S | S | * | . | H | α-helix | trans | -78.9 | -27 | -178.4 | -66.3 | 176.4 | 0 | 0 | 0 | 113.9 | I371 P372 A373 | I371-L375 HydrophobicContact CG2-CD1 3.96Å; I371-L375 WeakPolarHBondContact O-CG 3.35Å; I371-L375 PolarHBondContact O-N 3.3Å; P372-L375 PolarHBondContact O-N 2.85Å; A373-L375 VanDerWaalsContact C-N 3.34Å; A373-L375 PolarHBondContact O-N 2.88Å |
| 376 | L | 84.9 | Confident | 86.6 | Confident | 75 Ų | 75 | 49.8 Ų | 49.8 | 39% | 0.393 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -106.2 | -12.2 | -172.9 | -65.2 | 174.8 | 0 | 0 | 0 | 113.5 | P372 A373 D378 R379 V380 F385 | P372-L376 HydrophobicContact CB-CD1 4.34Å; P372-L376 VanDerWaalsContact O-CB 3.24Å; P372-L376 WeakPolarHBondContact O-CB 3.24Å; P372-L376 WeakPolarHBondContact O-CG 3.42Å; P372-L376 PolarHBondContact O-N 3.04Å; A373-L376 PolarHBondContact O-N 3.1Å; L376-D378 VanDerWaalsContact C-N 3.3Å; L376-D378 PolarHBondContact O-N 3.01Å; L376-R379 PolarHBondContact O-N 3.41Å; L376-V380 HydrophobicContact CB-CG2 4.31Å; L376-V380 PolarHBondContact O-N 2.94Å; L376-F385 HydrophobicContact CB-CE2 4.33Å; L376-F385 HydrophobicContact CB-CZ 3.81Å |
| 377 | V | 80.3 | Confident | 86.7 | Confident | 16 Ų | 16 | 49.9 Ų | 49.9 | 10% | 0.097 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -52.9 | -46.4 | -179.5 | 63.7 | 0 | 0 | 0 | 0 | 112.6 | A373 V374 R379 G381 M504 | A373-V377 WeakPolarHBondContact O-CB 3.29Å; A373-V377 PolarHBondContact O-N 3.48Å; V374-V377 WeakPolarHBondContact O-CG1 3.48Å; V377-R379 PolarHBondContact O-N 2.89Å; V377-G381 WeakPolarHBondContact O-CA 3.37Å; V377-G381 PolarHBondContact O-N 3.17Å; V377-M504 HydrophobicContact CB-CE 3.81Å; V377-M504 HydrophobicContact CB-SD 4.18Å; V377-M504 HydrophobicContact CG2-CE 3.63Å; V377-M504 HydrophobicContact CG2-SD 3.45Å; V377-M504 WeakPolarHBondContact CG2-SD 3.25Å |
| 378 | D | 78.8 | Confident | 86.9 | Confident | 132 Ų | 132 | 53.8 Ų | 53.8 | 71% | 0.706 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -65.1 | -27.7 | -179.4 | -63.6 | -25.4 | 0 | 0 | 0 | 112.1 | L376 K575 | L376-D378 VanDerWaalsContact C-N 3.3Å; L376-D378 PolarHBondContact O-N 3.01Å; D378-K575 VanDerWaalsContact O-CE 3.29Å; D378-K575 WeakPolarHBondContact O-CE 3.43Å |
| 379 | R | 82.7 | Confident | 87 | Confident | 188 Ų | 188 | 49.4 Ų | 49.4 | 71% | 0.709 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -88 | -41.2 | -178.2 | -67.9 | -166.8 | 177 | -169.8 | -1.9 | 113.3 | L376 V377 K575 | L376-R379 PolarHBondContact O-N 3.41Å; V377-R379 PolarHBondContact O-N 2.89Å; R379-K575 PolarHBondContact O-NZ 3.06Å |
| 380 | V | 83.9 | Confident | 87.4 | Confident | 59 Ų | 59 | 49.1 Ų | 49.1 | 36% | 0.358 | 26% | 0.256 | S | S | . | . | H | α-helix | trans | -96 | -32.1 | -171.2 | -179.4 | 0 | 0 | 0 | 0 | 111.2 | L376 L384 F385 | L376-V380 HydrophobicContact CB-CG2 4.31Å; L376-V380 PolarHBondContact O-N 2.94Å; V380-L384 HydrophobicContact CG1-CB 4.24Å; V380-L384 HydrophobicContact CG1-CD2 3.62Å; V380-L384 HydrophobicContact CG1-CG 4.21Å; V380-F385 HydrophobicContact CB-CD2 4.33Å; V380-F385 HydrophobicContact CB-CE2 3.64Å; V380-F385 HydrophobicContact CB-CZ 4.18Å; V380-F385 HydrophobicContact CG1-CD2 4.4Å; V380-F385 HydrophobicContact CG1-CE2 4.04Å; V380-F385 HydrophobicContact CG1-CZ 4.46Å; V380-F385 HydrophobicContact CG2-CE2 4.25Å; V380-F385 HydrophobicContact CG2-CZ 4.34Å |
| 381 | G | 83.4 | Confident | 87.9 | Confident | 0 Ų | 0 | 51.8 Ų | 51.8 | 0% | 0 | 27% | 0.272 | C | S | . | . | trans | 91.6 | 144 | -178.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | V377 K383 L384 | V377-G381 WeakPolarHBondContact O-CA 3.37Å; V377-G381 PolarHBondContact O-N 3.17Å; G381-K383 PolarHBondContact O-N 2.97Å; G381-L384 PolarHBondContact O-N 2.65Å | ||
| 382 | T | 87.8 | Confident | 88.4 | Confident | 4 Ų | 4 | 49.6 Ų | 49.6 | 3% | 0.025 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -61.4 | -41.2 | -168.9 | -42.4 | 0 | 0 | 0 | 0 | 113.9 | L384 F385 L386 M504 V507 V508 | T382-L384 PolarHBondContact O-N 3.35Å; T382-F385 PolarHBondContact O-N 3.42Å; T382-L386 WeakPolarHBondContact O-CG 3.45Å; T382-L386 PolarHBondContact O-N 3.05Å; T382-L386 VanDerWaalsContact O-N 3.14Å; T382-M504 HydrophobicContact CG2-CB 3.69Å; T382-M504 HydrophobicContact CG2-CG 4.18Å; T382-M504 WeakPolarHBondContact CG2-O 3.43Å; T382-M504 HydrophobicContact CG2-SD 3.79Å; T382-V507 HydrophobicContact CG2-CB 4.14Å; T382-V507 HydrophobicContact CG2-CG1 4.07Å; T382-V508 HydrophobicContact CG2-CG2 3.43Å; T382-V508 VanDerWaalsContact CG2-CG2 3.43Å |
| 383 | K | 90.4 | Very high | 88.9 | Confident | 36 Ų | 36 | 46.9 Ų | 46.9 | 16% | 0.157 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -63.1 | -38.7 | -177.3 | -174.6 | 170.9 | 179.3 | 158.2 | 0 | 113 | G381 L386 C387 V567 I568 V571 Q573 | G381-K383 PolarHBondContact O-N 2.97Å; K383-L386 PolarHBondContact O-N 3.19Å; K383-C387 PolarHBondContact O-N 3.32Å; K383-C387 PolarHBondContact O-SG 3.47Å; K383-C387 VanDerWaalsContact O-SG 3.38Å; K383-V567 WeakPolarHBondContact CE-O 3.28Å; K383-V567 HydrophobicContact CG-CG1 4Å; K383-V567 PolarHBondContact NZ-O 3.2Å; K383-I568 PolarHBondContact NZ-O 2.9Å; K383-V571 PolarHBondContact NZ-O 3.37Å; K383-Q573 VanDerWaalsContact CB-OE1 3.28Å |
| 384 | L | 91.6 | Very high | 89.6 | Confident | 91 Ų | 91 | 46.9 Ų | 46.9 | 48% | 0.476 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -68.4 | -41.6 | -179.3 | -176.8 | 57.5 | 0 | 0 | 0 | 111.1 | V380 G381 T382 L386 C387 V388 | V380-L384 HydrophobicContact CG1-CB 4.24Å; V380-L384 HydrophobicContact CG1-CD2 3.62Å; V380-L384 HydrophobicContact CG1-CG 4.21Å; G381-L384 PolarHBondContact O-N 2.65Å; T382-L384 PolarHBondContact O-N 3.35Å; L384-L386 VanDerWaalsContact C-N 3.32Å; L384-L386 PolarHBondContact O-N 3.25Å; L384-C387 PolarHBondContact O-N 3.06Å; L384-V388 HydrophobicContact CD1-CG2 3.98Å; L384-V388 HydrophobicContact CG-CG2 4.28Å; L384-V388 WeakPolarHBondContact O-CG2 3.42Å; L384-V388 PolarHBondContact O-N 3.32Å |
| 385 | F | 92.2 | Very high | 90.5 | Very high | 24 Ų | 24 | 48.3 Ų | 48.3 | 11% | 0.105 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -59.1 | -43.4 | 174.1 | -82.9 | -69.8 | 0 | 0 | 0 | 112.1 | L376 V380 T382 G389 I499 S500 M504 | L376-F385 HydrophobicContact CB-CE2 4.33Å; L376-F385 HydrophobicContact CB-CZ 3.81Å; V380-F385 HydrophobicContact CB-CD2 4.33Å; V380-F385 HydrophobicContact CB-CE2 3.64Å; V380-F385 HydrophobicContact CB-CZ 4.18Å; V380-F385 HydrophobicContact CG1-CD2 4.4Å; V380-F385 HydrophobicContact CG1-CE2 4.04Å; V380-F385 HydrophobicContact CG1-CZ 4.46Å; V380-F385 HydrophobicContact CG2-CE2 4.25Å; V380-F385 HydrophobicContact CG2-CZ 4.34Å; T382-F385 PolarHBondContact O-N 3.42Å; F385-G389 PolarHBondContact O-N 2.87Å; F385-I499 HydrophobicContact CD1-CG2 3.72Å; F385-I499 HydrophobicContact CE1-CG2 3.77Å; F385-S500 WeakPolarHBondContact O-CB 3.12Å; F385-M504 HydrophobicContact CB-CG 3.6Å; F385-M504 HydrophobicContact CB-SD 3.82Å; F385-M504 HydrophobicContact CD2-SD 3.95Å; F385-M504 HydrophobicContact CG-CG 4.38Å; F385-M504 HydrophobicContact CG-SD 4.09Å |
| 386 | L | 93.3 | Very high | 91.1 | Very high | 1 Ų | 1 | 43.3 Ų | 43.3 | 1% | 0.005 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -60.8 | -44.2 | 175.6 | -71 | 172.1 | 0 | 0 | 0 | 112.1 | T382 K383 L384 A390 L501 M504 V505 V508 V567 V571 | T382-L386 WeakPolarHBondContact O-CG 3.45Å; T382-L386 PolarHBondContact O-N 3.05Å; T382-L386 VanDerWaalsContact O-N 3.14Å; K383-L386 PolarHBondContact O-N 3.19Å; L384-L386 VanDerWaalsContact C-N 3.32Å; L384-L386 PolarHBondContact O-N 3.25Å; L386-A390 WeakPolarHBondContact O-CB 3.32Å; L386-A390 PolarHBondContact O-N 2.88Å; L386-L501 HydrophobicContact CD2-CD2 3.8Å; L386-L501 HydrophobicContact CD2-CG 4.37Å; L386-M504 HydrophobicContact CD1-CB 4.48Å; L386-M504 HydrophobicContact CD2-CB 3.66Å; L386-M504 HydrophobicContact CG-CB 3.82Å; L386-V505 HydrophobicContact CD2-CG2 4.08Å; L386-V508 HydrophobicContact CD1-CG2 3.94Å; L386-V567 HydrophobicContact CB-CG1 3.76Å; L386-V567 HydrophobicContact CB-CG2 4.12Å; L386-V567 HydrophobicContact CD1-CG1 4.35Å; L386-V567 HydrophobicContact CD1-CG2 4.42Å; L386-V571 HydrophobicContact CD1-CG1 4.42Å |
| 387 | C | 95.3 | Very high | 91.6 | Very high | 20 Ų | 20 | 39.8 Ų | 39.8 | 14% | 0.135 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -65.5 | -50.3 | 178.2 | -68.9 | 0 | 0 | 0 | 0 | 112.6 | K383 L384 G389 A390 V391 L564 | K383-C387 PolarHBondContact O-N 3.32Å; K383-C387 PolarHBondContact O-SG 3.47Å; K383-C387 VanDerWaalsContact O-SG 3.38Å; L384-C387 PolarHBondContact O-N 3.06Å; C387-G389 VanDerWaalsContact C-N 3.29Å; C387-G389 PolarHBondContact O-N 3.49Å; C387-A390 PolarHBondContact O-N 3.33Å; C387-V391 WeakPolarHBondContact O-CG2 3.4Å; C387-V391 PolarHBondContact O-N 3.4Å; C387-V391 VanDerWaalsContact O-N 3.09Å; C387-L564 HydrophobicContact CB-CD1 3.8Å |
| 388 | V | 95.2 | Very high | 92.4 | Very high | 87 Ų | 87 | 40.3 Ų | 40.3 | 53% | 0.527 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -61.1 | -42.4 | -179.9 | 172.4 | 0 | 0 | 0 | 0 | 110.4 | L384 V391 A392 | L384-V388 HydrophobicContact CD1-CG2 3.98Å; L384-V388 HydrophobicContact CG-CG2 4.28Å; L384-V388 WeakPolarHBondContact O-CG2 3.42Å; L384-V388 PolarHBondContact O-N 3.32Å; V388-V391 PolarHBondContact O-N 3.45Å; V388-A392 WeakPolarHBondContact O-CB 3.44Å; V388-A392 PolarHBondContact O-N 3.42Å |
| 389 | G | 94.9 | Very high | 93.1 | Very high | 4 Ų | 4 | 35.8 Ų | 35.8 | 4% | 0.041 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -59.7 | -49.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.6 | F385 C387 V391 A392 M393 S500 | F385-G389 PolarHBondContact O-N 2.87Å; C387-G389 VanDerWaalsContact C-N 3.29Å; C387-G389 PolarHBondContact O-N 3.49Å; G389-V391 VanDerWaalsContact C-N 3.33Å; G389-V391 PolarHBondContact O-N 2.96Å; G389-A392 PolarHBondContact O-N 3.15Å; G389-M393 WeakPolarHBondContact O-CB 3.48Å; G389-M393 VanDerWaalsContact O-CG 3.24Å; G389-M393 WeakPolarHBondContact O-CG 3.33Å; G389-M393 PolarHBondContact O-N 3.05Å; G389-S500 VanDerWaalsContact CA-CB 3.49Å; G389-S500 VanDerWaalsContact CA-OG 3.29Å; G389-S500 WeakPolarHBondContact CA-OG 3.42Å |
| 390 | A | 96.5 | Very high | 93.5 | Very high | 0 Ų | 0 | 27 Ų | 27 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -60.2 | -40.9 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | L386 C387 G394 L563 L564 | L386-A390 WeakPolarHBondContact O-CB 3.32Å; L386-A390 PolarHBondContact O-N 2.88Å; C387-A390 PolarHBondContact O-N 3.33Å; A390-G394 PolarHBondContact O-N 3.33Å; A390-L563 HydrophobicContact CB-CD2 4.13Å; A390-L563 HydrophobicContact CB-CG 4.31Å; A390-L564 HydrophobicContact CB-CB 3.89Å; A390-L564 HydrophobicContact CB-CD1 4.36Å |
| 391 | V | 97.7 | Very high | 93.8 | Very high | 62 Ų | 62 | 24.2 Ų | 24.2 | 38% | 0.376 | 15% | 0.15 | S | C | . | . | H | α-helix | trans | -65.1 | -49 | 174.6 | 174.3 | 0 | 0 | 0 | 0 | 111.2 | C387 V388 G389 M393 G394 T395 L564 | C387-V391 WeakPolarHBondContact O-CG2 3.4Å; C387-V391 PolarHBondContact O-N 3.4Å; C387-V391 VanDerWaalsContact O-N 3.09Å; V388-V391 PolarHBondContact O-N 3.45Å; G389-V391 VanDerWaalsContact C-N 3.33Å; G389-V391 PolarHBondContact O-N 2.96Å; V391-M393 VanDerWaalsContact C-N 3.33Å; V391-M393 PolarHBondContact O-N 3.38Å; V391-G394 PolarHBondContact O-N 2.9Å; V391-T395 HydrophobicContact CG1-CG2 4.29Å; V391-T395 WeakPolarHBondContact O-CB 3.26Å; V391-T395 VanDerWaalsContact O-CG2 3.31Å; V391-T395 WeakPolarHBondContact O-CG2 3.47Å; V391-T395 PolarHBondContact O-N 3.36Å; V391-T395 PolarHBondContact O-OG1 3.47Å; V391-L564 HydrophobicContact CG2-CD1 4.05Å; V391-L564 HydrophobicContact CG2-CD2 3.56Å; V391-L564 HydrophobicContact CG2-CG 4.42Å |
| 392 | A | 96.9 | Very high | 94.1 | Very high | 29 Ų | 29 | 27.8 Ų | 27.8 | 24% | 0.24 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -64.2 | -38.1 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | V388 G389 T395 S396 A496 | V388-A392 WeakPolarHBondContact O-CB 3.44Å; V388-A392 PolarHBondContact O-N 3.42Å; G389-A392 PolarHBondContact O-N 3.15Å; A392-T395 WeakPolarHBondContact CA-OG1 3.38Å; A392-T395 PolarHBondContact O-OG1 3.49Å; A392-T395 VanDerWaalsContact O-OG1 3.14Å; A392-S396 VanDerWaalsContact O-CB 3.29Å; A392-S396 WeakPolarHBondContact O-CB 3.34Å; A392-S396 PolarHBondContact O-N 3.19Å; A392-S396 PolarHBondContact O-OG 3.23Å; A392-A496 HydrophobicContact CB-CB 3.61Å |
| 393 | M | 96.8 | Very high | 94.1 | Very high | 0 Ų | 0 | 29.2 Ų | 29.2 | 0% | 0 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -67.9 | -47.6 | 174.2 | -71.8 | 169.6 | 59.9 | 0 | 0 | 112 | T331 G389 V391 T395 S396 L397 Y493 A496 F497 L501 | T331-M393 HydrophobicContact CG2-CE 3.95Å; T331-M393 WeakPolarHBondContact OG1-CE 3.23Å; G389-M393 WeakPolarHBondContact O-CB 3.48Å; G389-M393 VanDerWaalsContact O-CG 3.24Å; G389-M393 WeakPolarHBondContact O-CG 3.33Å; G389-M393 PolarHBondContact O-N 3.05Å; V391-M393 VanDerWaalsContact C-N 3.33Å; V391-M393 PolarHBondContact O-N 3.38Å; M393-T395 PolarHBondContact O-N 2.93Å; M393-S396 WeakPolarHBondContact CA-OG 3.17Å; M393-S396 PolarHBondContact O-N 3.14Å; M393-S396 PolarHBondContact O-OG 3Å; M393-L397 WeakPolarHBondContact O-CB 3.42Å; M393-L397 WeakPolarHBondContact O-CG 3.33Å; M393-L397 PolarHBondContact O-N 2.91Å; M393-Y493 HydrophobicContact CB-CD2 3.9Å; M393-Y493 HydrophobicContact CB-CE2 4.02Å; M393-Y493 HydrophobicContact CE-CD2 4.26Å; M393-Y493 HydrophobicContact CE-CE2 3.4Å; M393-Y493 VanDerWaalsContact CE-CE2 3.4Å; M393-Y493 HydrophobicContact CG-CD2 3.87Å; M393-Y493 HydrophobicContact CG-CE2 3.97Å; M393-Y493 HydrophobicContact SD-CE2 4.47Å; M393-A496 HydrophobicContact CG-CB 3.65Å; M393-F497 HydrophobicContact CE-CB 4.34Å; M393-F497 HydrophobicContact CE-CD2 3.77Å; M393-F497 HydrophobicContact SD-CB 3.93Å; M393-F497 HydrophobicContact SD-CD2 4.08Å; M393-L501 HydrophobicContact CE-CD1 3.58Å; M393-L501 HydrophobicContact SD-CD1 3.46Å; M393-L501 WeakPolarHBondContact SD-CD1 3.41Å; M393-L501 HydrophobicContact SD-CG 4.5Å |
| 394 | G | 97.3 | Very high | 93.6 | Very high | 0 Ų | 0 | 27.8 Ų | 27.8 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -60.4 | -46.3 | 179 | 0 | 0 | 0 | 0 | 0 | 112 | A390 V391 L397 A398 S557 | A390-G394 PolarHBondContact O-N 3.33Å; V391-G394 PolarHBondContact O-N 2.9Å; G394-L397 PolarHBondContact O-N 3.29Å; G394-A398 VanDerWaalsContact O-CB 3.28Å; G394-A398 WeakPolarHBondContact O-CB 3.21Å; G394-A398 PolarHBondContact O-N 2.86Å; G394-S557 PolarHBondContact O-OG 3.16Å |
| 395 | T | 97.5 | Very high | 93.2 | Very high | 75 Ų | 75 | 26.9 Ų | 26.9 | 46% | 0.46 | 17% | 0.169 | S | C | . | . | H | α-helix | trans | -66.5 | -42.1 | 179.1 | 51.6 | 0 | 0 | 0 | 0 | 112.9 | V391 A392 M393 A398 A399 F561 | V391-T395 HydrophobicContact CG1-CG2 4.29Å; V391-T395 WeakPolarHBondContact O-CB 3.26Å; V391-T395 VanDerWaalsContact O-CG2 3.31Å; V391-T395 WeakPolarHBondContact O-CG2 3.47Å; V391-T395 PolarHBondContact O-N 3.36Å; V391-T395 PolarHBondContact O-OG1 3.47Å; A392-T395 WeakPolarHBondContact CA-OG1 3.38Å; A392-T395 PolarHBondContact O-OG1 3.49Å; A392-T395 VanDerWaalsContact O-OG1 3.14Å; M393-T395 PolarHBondContact O-N 2.93Å; T395-A398 PolarHBondContact O-N 2.91Å; T395-A399 WeakPolarHBondContact O-CB 3.44Å; T395-A399 PolarHBondContact O-N 3.49Å; T395-F561 HydrophobicContact CG2-CZ 4.44Å |
| 396 | S | 96.6 | Very high | 92.3 | Very high | 6 Ų | 6 | 32.8 Ų | 32.8 | 4% | 0.042 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -67.9 | -37.2 | 176.7 | 54.9 | 0 | 0 | 0 | 0 | 113.1 | A392 M393 A399 L400 S489 Y493 | A392-S396 VanDerWaalsContact O-CB 3.29Å; A392-S396 WeakPolarHBondContact O-CB 3.34Å; A392-S396 PolarHBondContact O-N 3.19Å; A392-S396 PolarHBondContact O-OG 3.23Å; M393-S396 WeakPolarHBondContact CA-OG 3.17Å; M393-S396 PolarHBondContact O-N 3.14Å; M393-S396 PolarHBondContact O-OG 3Å; S396-A399 PolarHBondContact O-N 2.75Å; S396-L400 WeakPolarHBondContact O-CB 3.31Å; S396-L400 PolarHBondContact O-N 3.41Å; S396-S489 PolarHBondContact O-OG 2.87Å; S396-Y493 WeakPolarHBondContact OG-CA 3.32Å |
| 397 | L | 94.9 | Very high | 90.9 | Very high | 1 Ų | 1 | 33.7 Ų | 33.7 | 1% | 0.005 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -72.2 | -36.8 | 174.6 | -71.5 | 175.1 | 0 | 0 | 0 | 112.5 | I336 M393 G394 A399 L400 G401 Y493 M553 | I336-L397 HydrophobicContact CD1-CD2 3.76Å; M393-L397 WeakPolarHBondContact O-CB 3.42Å; M393-L397 WeakPolarHBondContact O-CG 3.33Å; M393-L397 PolarHBondContact O-N 2.91Å; G394-L397 PolarHBondContact O-N 3.29Å; L397-A399 VanDerWaalsContact C-N 3.35Å; L397-L400 PolarHBondContact O-N 3.08Å; L397-G401 PolarHBondContact O-N 2.97Å; L397-Y493 HydrophobicContact CD1-CD2 3.66Å; L397-Y493 HydrophobicContact CD1-CE2 3.44Å; L397-Y493 VanDerWaalsContact CD1-CE2 3.44Å; L397-Y493 HydrophobicContact CD2-CD2 3.82Å; L397-Y493 HydrophobicContact CD2-CE2 4.16Å; L397-Y493 HydrophobicContact CD2-CG 4.12Å; L397-Y493 HydrophobicContact CG-CD2 3.52Å; L397-Y493 HydrophobicContact CG-CE2 3.87Å; L397-Y493 HydrophobicContact CG-CG 4.27Å; L397-M553 HydrophobicContact CD2-SD 3.96Å |
| 398 | A | 96 | Very high | 88.7 | Confident | 28 Ų | 28 | 39.9 Ų | 39.9 | 23% | 0.231 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -61.1 | -45.6 | 171.7 | 0 | 0 | 0 | 0 | 0 | 110.9 | G394 T395 L400 G401 T402 | G394-A398 VanDerWaalsContact O-CB 3.28Å; G394-A398 WeakPolarHBondContact O-CB 3.21Å; G394-A398 PolarHBondContact O-N 2.86Å; T395-A398 PolarHBondContact O-N 2.91Å; A398-L400 PolarHBondContact O-N 3.23Å; A398-G401 PolarHBondContact O-N 3.35Å; A398-T402 WeakPolarHBondContact O-CG2 3.17Å; A398-T402 PolarHBondContact O-N 3.38Å; A398-T402 PolarHBondContact O-OG1 3.22Å |
| 399 | A | 94.3 | Very high | 86.4 | Confident | 37 Ų | 37 | 40.4 Ų | 40.4 | 31% | 0.306 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -58.8 | -48.1 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | T395 S396 L397 G401 T402 L403 | T395-A399 WeakPolarHBondContact O-CB 3.44Å; T395-A399 PolarHBondContact O-N 3.49Å; S396-A399 PolarHBondContact O-N 2.75Å; L397-A399 VanDerWaalsContact C-N 3.35Å; A399-G401 VanDerWaalsContact C-N 3.34Å; A399-G401 PolarHBondContact O-N 2.95Å; A399-T402 WeakPolarHBondContact CA-OG1 3.38Å; A399-T402 PolarHBondContact O-N 3.24Å; A399-T402 PolarHBondContact O-OG1 3Å; A399-L403 WeakPolarHBondContact O-CB 3.32Å; A399-L403 VanDerWaalsContact O-CG 3.24Å; A399-L403 WeakPolarHBondContact O-CG 3.32Å; A399-L403 PolarHBondContact O-N 2.72Å |
| 400 | L | 90.9 | Very high | 84 | Confident | 3 Ų | 3 | 47 Ų | 47 | 2% | 0.016 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -60.4 | -42.3 | 176.4 | -174.7 | 65.3 | 0 | 0 | 0 | 112.4 | S396 L397 A398 T402 L403 T404 L490 M553 | S396-L400 WeakPolarHBondContact O-CB 3.31Å; S396-L400 PolarHBondContact O-N 3.41Å; L397-L400 PolarHBondContact O-N 3.08Å; A398-L400 PolarHBondContact O-N 3.23Å; L400-T402 PolarHBondContact O-N 3.22Å; L400-L403 PolarHBondContact O-N 3.32Å; L400-T404 HydrophobicContact CD1-CG2 4.16Å; L400-T404 HydrophobicContact CG-CG2 4.42Å; L400-T404 WeakPolarHBondContact O-CB 3.3Å; L400-T404 VanDerWaalsContact O-CG2 3.32Å; L400-T404 WeakPolarHBondContact O-CG2 3.31Å; L400-T404 PolarHBondContact O-N 3.48Å; L400-T404 PolarHBondContact O-OG1 2.98Å; L400-L490 HydrophobicContact CD1-CG 4.34Å; L400-L490 HydrophobicContact CD2-CD1 4.3Å; L400-L490 HydrophobicContact CD2-CD2 3.45Å; L400-L490 VanDerWaalsContact CD2-CD2 3.45Å; L400-L490 HydrophobicContact CD2-CG 3.65Å; L400-M553 HydrophobicContact CD2-CG 4.03Å; L400-M553 HydrophobicContact CD2-SD 3.81Å; L400-M553 HydrophobicContact CG-CG 4.3Å |
| 401 | G | 90.7 | Very high | 81.8 | Confident | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -58.5 | -45.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | L397 A398 A399 T404 L405 | L397-G401 PolarHBondContact O-N 2.97Å; A398-G401 PolarHBondContact O-N 3.35Å; A399-G401 VanDerWaalsContact C-N 3.34Å; A399-G401 PolarHBondContact O-N 2.95Å; G401-T404 PolarHBondContact O-OG1 3.26Å; G401-T404 VanDerWaalsContact O-OG1 3.14Å; G401-L405 VanDerWaalsContact O-CB 3.28Å; G401-L405 WeakPolarHBondContact O-CB 3.31Å; G401-L405 PolarHBondContact O-N 3.43Å |
| 402 | T | 90.2 | Very high | 79.4 | Confident | 75 Ų | 75 | 50.1 Ų | 50.1 | 46% | 0.46 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -65.9 | -42.9 | 177.2 | 57.5 | 0 | 0 | 0 | 0 | 112.9 | A398 A399 L400 T404 L405 Q406 F554 | A398-T402 WeakPolarHBondContact O-CG2 3.17Å; A398-T402 PolarHBondContact O-N 3.38Å; A398-T402 PolarHBondContact O-OG1 3.22Å; A399-T402 WeakPolarHBondContact CA-OG1 3.38Å; A399-T402 PolarHBondContact O-N 3.24Å; A399-T402 PolarHBondContact O-OG1 3Å; L400-T402 PolarHBondContact O-N 3.22Å; T402-T404 VanDerWaalsContact C-N 3.34Å; T402-T404 PolarHBondContact O-N 2.8Å; T402-L405 PolarHBondContact O-N 2.88Å; T402-Q406 PolarHBondContact O-N 3.46Å; T402-Q406 VanDerWaalsContact O-N 3.16Å; T402-F554 HydrophobicContact CG2-CE1 3.94Å; T402-F554 HydrophobicContact CG2-CZ 3.75Å |
| 403 | L | 87.3 | Confident | 77.5 | Confident | 34 Ų | 34 | 50.5 Ų | 50.5 | 18% | 0.178 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -63.3 | -41.5 | 179 | -69.6 | 170 | 0 | 0 | 0 | 111.5 | A399 L400 L482 A485 | A399-L403 WeakPolarHBondContact O-CB 3.32Å; A399-L403 VanDerWaalsContact O-CG 3.24Å; A399-L403 WeakPolarHBondContact O-CG 3.32Å; A399-L403 PolarHBondContact O-N 2.72Å; L400-L403 PolarHBondContact O-N 3.32Å; L403-L482 HydrophobicContact CD2-CD2 3.71Å; L403-A485 HydrophobicContact CD1-CB 3.92Å; L403-A485 HydrophobicContact CD2-CB 4.41Å |
| 404 | T | 79.8 | Confident | 76.2 | Confident | 6 Ų | 6 | 50.9 Ų | 50.9 | 4% | 0.037 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -77.8 | -26.2 | 179.9 | 54 | 0 | 0 | 0 | 0 | 113.1 | V347 L400 G401 T402 S407 L411 | V347-T404 HydrophobicContact CG2-CG2 4.46Å; L400-T404 HydrophobicContact CD1-CG2 4.16Å; L400-T404 HydrophobicContact CG-CG2 4.42Å; L400-T404 WeakPolarHBondContact O-CB 3.3Å; L400-T404 VanDerWaalsContact O-CG2 3.32Å; L400-T404 WeakPolarHBondContact O-CG2 3.31Å; L400-T404 PolarHBondContact O-N 3.48Å; L400-T404 PolarHBondContact O-OG1 2.98Å; G401-T404 PolarHBondContact O-OG1 3.26Å; G401-T404 VanDerWaalsContact O-OG1 3.14Å; T402-T404 VanDerWaalsContact C-N 3.34Å; T402-T404 PolarHBondContact O-N 2.8Å; T404-S407 WeakPolarHBondContact CA-OG 3.24Å; T404-S407 PolarHBondContact O-OG 3.31Å; T404-L411 HydrophobicContact CG2-CD2 4.06Å |
| 405 | L | 83.1 | Confident | 74.7 | Confident | 73 Ų | 73 | 51.5 Ų | 51.5 | 38% | 0.382 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -67.8 | -40.8 | 172.2 | -172.5 | 66.4 | 0 | 0 | 0 | 111.1 | G401 T402 S407 H408 P550 F554 | G401-L405 VanDerWaalsContact O-CB 3.28Å; G401-L405 WeakPolarHBondContact O-CB 3.31Å; G401-L405 PolarHBondContact O-N 3.43Å; T402-L405 PolarHBondContact O-N 2.88Å; L405-S407 PolarHBondContact O-N 3.06Å; L405-H408 PolarHBondContact O-CD2 3.42Å; L405-H408 PolarHBondContact O-NE2 3.45Å; L405-P550 HydrophobicContact CB-CB 4.12Å; L405-P550 HydrophobicContact CD1-CB 4.31Å; L405-F554 HydrophobicContact CD2-CE2 4.42Å |
| 406 | Q | 72.7 | Confident | 72.8 | Confident | 147 Ų | 147 | 56 Ų | 56 | 69% | 0.687 | 30% | 0.302 | S | S | * | . | H | α-helix | trans | -65.7 | -24.2 | 179.9 | -168.4 | 171.1 | -9.7 | 0 | 0 | 113.1 | T402 H408 | T402-Q406 PolarHBondContact O-N 3.46Å; T402-Q406 VanDerWaalsContact O-N 3.16Å; Q406-H408 PolarHBondContact O-N 3.27Å |
| 407 | S | 64.5 | Low | 70.4 | Confident | 21 Ų | 21 | 58.7 Ų | 58.7 | 15% | 0.147 | 32% | 0.32 | C | S | . | . | S | Bend | trans | -82 | 39.3 | 179.2 | 56.5 | 0 | 0 | 0 | 0 | 114.8 | T404 L405 T409 | T404-S407 WeakPolarHBondContact CA-OG 3.24Å; T404-S407 PolarHBondContact O-OG 3.31Å; L405-S407 PolarHBondContact O-N 3.06Å; S407-T409 PolarHBondContact O-N 2.81Å |
| 408 | H | 49.1 | Very low | 68 | Low | 150 Ų | 150 | 66.7 Ų | 66.7 | 69% | 0.694 | 36% | 0.358 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -46.1 | 5.2 | -159.8 | -108.6 | -68.5 | 0 | 0 | 0 | 121.8 | L405 Q406 | L405-H408 PolarHBondContact O-CD2 3.42Å; L405-H408 PolarHBondContact O-NE2 3.45Å; Q406-H408 PolarHBondContact O-N 3.27Å |
| 409 | T | 46.1 | Very low | 65.2 | Low | 97 Ų | 97 | 70.5 Ų | 70.5 | 60% | 0.595 | 38% | 0.378 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -121.6 | -10.1 | -166.7 | 52.1 | 0 | 0 | 0 | 0 | 118.9 | S407 | S407-T409 PolarHBondContact O-N 2.81Š|
| 410 | H | 45.4 | Very low | 62.2 | Low | 142 Ų | 142 | 76.3 Ų | 76.3 | 66% | 0.657 | 40% | 0.403 | S | S | * | . | S | Bend | trans | -143.9 | -0.8 | -177.2 | -87.7 | -80.9 | 0 | 0 | 0 | 118.8 | T412 | H410-T412 PolarHBondContact O-N 2.92Š|
| 411 | L | 50.3 | Low | 59.3 | Low | 22 Ų | 22 | 81 Ų | 81 | 12% | 0.115 | 43% | 0.432 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -89.3 | 11.2 | -171.9 | -95.7 | 91.5 | 0 | 0 | 0 | 116.4 | S346 V347 T404 S413 V549 | S346-L411 WeakPolarHBondContact O-CD1 3.34Å; S346-L411 VanDerWaalsContact O-CG 3.25Å; S346-L411 WeakPolarHBondContact O-CG 3.37Å; V347-L411 HydrophobicContact CG2-CD2 4.39Å; T404-L411 HydrophobicContact CG2-CD2 4.06Å; L411-S413 VanDerWaalsContact C-N 3.28Å; L411-S413 PolarHBondContact O-N 3.28Å; L411-V549 WeakPolarHBondContact O-CG2 3.47Å |
| 412 | T | 47.7 | Very low | 56.5 | Low | 106 Ų | 106 | 87.4 Ų | 87.4 | 65% | 0.65 | 47% | 0.466 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.1 | -3 | -172.1 | 47.6 | 0 | 0 | 0 | 0 | 114.8 | H410 | H410-T412 PolarHBondContact O-N 2.92Š|
| 413 | S | 56.7 | Low | 53.6 | Low | 38 Ų | 38 | 90.4 Ų | 90.4 | 27% | 0.266 | 47% | 0.474 | S | S | . | . | trans | -145.6 | 87.8 | -175.2 | -165.5 | 0 | 0 | 0 | 0 | 112.9 | L411 C415 K416 | L411-S413 VanDerWaalsContact C-N 3.28Å; L411-S413 PolarHBondContact O-N 3.28Å; S413-C415 PolarHBondContact O-N 3.26Å; S413-C415 VanDerWaalsContact O-N 3.07Å; S413-K416 WeakPolarHBondContact OG-CB 3.32Å; S413-K416 PolarHBondContact OG-N 2.86Å | ||
| 414 | L | 68.4 | Low | 50.8 | Low | 8 Ų | 8 | 94.7 Ų | 94.7 | 4% | 0.042 | 50% | 0.502 | C | S | . | . | S | Bend | trans | -55.9 | -17.6 | 162.1 | -69.6 | 175.1 | 0 | 0 | 0 | 111.6 | R106 F540 L541 T544 V549 | R106-L414 VanDerWaalsContact CZ-O 3.27Å; R106-L414 PolarHBondContact NH1-O 3.46Å; R106-L414 PolarHBondContact NH2-O 3.2Å; L414-F540 HydrophobicContact CD1-CE1 3.98Å; L414-F540 HydrophobicContact CD1-CZ 4.26Å; L414-L541 HydrophobicContact CB-CD2 3.95Å; L414-L541 HydrophobicContact CD1-CD2 3.8Å; L414-T544 HydrophobicContact CD1-CG2 3.69Å; L414-T544 HydrophobicContact CG-CG2 4.21Å; L414-V549 HydrophobicContact CD1-CG2 4.21Å; L414-V549 HydrophobicContact CD2-CG2 4.49Å; L414-V549 HydrophobicContact CG-CG2 4.1Å |
| 415 | C | 66.4 | Low | 48.4 | Very low | 13 Ų | 13 | 103.6 Ų | 103.6 | 9% | 0.088 | 54% | 0.537 | C | S | . | . | S | Bend | trans | -106.9 | -18.9 | -171.1 | -75 | 0 | 0 | 0 | 0 | 116.3 | R106 C113 S413 S417 E545 | R106-C415 PolarHBondContact NH2-O 3.4Å; C113-C415 WeakPolarHBondContact CA-SG 3.09Å; C113-C415 HydrophobicContact CB-CB 3.62Å; C113-C415 WeakPolarHBondContact CB-SG 2.96Å; C113-C415 WeakPolarHBondContact SG-CB 3.44Å; C113-C415 CovalentContact SG-SG 2.05Å; C113-C415 PolarHBondContact SG-SG 3.4Å; S413-C415 PolarHBondContact O-N 3.26Å; S413-C415 VanDerWaalsContact O-N 3.07Å; C415-S417 PolarHBondContact O-N 2.83Å; C415-E545 HydrophobicContact CB-CG 4.38Å; C415-E545 WeakPolarHBondContact CB-OE1 3.31Å |
| 416 | K | 57.9 | Low | 45.8 | Very low | 170 Ų | 170 | 105.1 Ų | 105.1 | 74% | 0.739 | 55% | 0.553 | S | S | * | * | trans | -74 | 112.7 | 176 | -101 | -176.9 | 172.3 | 177.5 | 0 | 112 | R106 S413 Q418 | R106-K416 PolarHBondContact NH2-O 3.02Å; S413-K416 WeakPolarHBondContact OG-CB 3.32Å; S413-K416 PolarHBondContact OG-N 2.86Å; K416-Q418 PolarHBondContact O-N 3.34Å | ||
| 417 | S | 46.8 | Very low | 43.7 | Very low | 61 Ų | 61 | 102.3 Ų | 102.3 | 43% | 0.427 | 55% | 0.548 | S | S | . | . | trans | -63.7 | 124 | 166 | -178.3 | 0 | 0 | 0 | 0 | 108 | R106 C415 T419 | R106-S417 VanDerWaalsContact NH2-N 3.14Å; C415-S417 PolarHBondContact O-N 2.83Å; S417-T419 PolarHBondContact O-N 3.41Å; S417-T419 PolarHBondContact OG-OG1 3.33Å | ||
| 418 | Q | 44.4 | Very low | 42.1 | Very low | 170 Ų | 170 | 112.6 Ų | 112.6 | 79% | 0.794 | 58% | 0.584 | S | S | * | * | trans | -74.9 | 77.2 | 164.9 | -89.9 | 171.3 | -39.3 | 0 | 0 | 108.3 | K416 | K416-Q418 PolarHBondContact O-N 3.34Š| ||
| 419 | T | 36 | Very low | 41 | Very low | 108 Ų | 108 | 113 Ų | 113 | 66% | 0.663 | 59% | 0.591 | S | S | * | * | trans | -132.2 | 73.9 | 169.1 | 45.3 | 0 | 0 | 0 | 0 | 108.8 | S417 | S417-T419 PolarHBondContact O-N 3.41Å; S417-T419 PolarHBondContact OG-OG1 3.33Å | ||
| 420 | L | 31.2 | Very low | 40.3 | Very low | 158 Ų | 158 | 116.8 Ų | 116.8 | 83% | 0.827 | 61% | 0.607 | S | S | * | * | trans | -117.6 | 73.9 | 147.6 | -159.5 | 91.4 | 0 | 0 | 0 | 106.6 | ||||
| 421 | V | 30.3 | Very low | 39.4 | Very low | 102 Ų | 102 | 118.3 Ų | 118.3 | 62% | 0.618 | 62% | 0.62 | S | S | * | * | trans | -102.2 | 96.4 | 161.3 | -175.1 | 0 | 0 | 0 | 0 | 105.5 | H423 | V421-H423 HydrophobicContact CG1-CB 4.35Å; V421-H423 WeakPolarHBondContact CG1-CD2 3.33Å; V421-H423 PolarHBondContact O-N 3.38Å | ||
| 422 | N | 31.5 | Very low | 38.2 | Very low | 134 Ų | 134 | 121 Ų | 121 | 72% | 0.717 | 65% | 0.652 | S | S | * | * | trans | -62.2 | 84.7 | 158 | -88.3 | -6.3 | 0 | 0 | 0 | 107.2 | ||||
| 423 | H | 29.6 | Very low | 37 | Very low | 138 Ų | 138 | 122.4 Ų | 122.4 | 64% | 0.639 | 66% | 0.661 | S | S | * | * | trans | -94.2 | 86.2 | 156 | -89.2 | -51.1 | 0 | 0 | 0 | 107.3 | V421 Y425 | V421-H423 HydrophobicContact CG1-CB 4.35Å; V421-H423 WeakPolarHBondContact CG1-CD2 3.33Å; V421-H423 PolarHBondContact O-N 3.38Å; H423-Y425 HydrophobicContact CB-CD2 4.18Å; H423-Y425 AromaticContact ND1-CD2 3.62Å; H423-Y425 AromaticContact ND1-CE2 3.45Å; H423-Y425 WeakPolarHBondContact ND1-CE2 3.43Å; H423-Y425 PolarHBondContact O-N 3.15Å | ||
| 424 | T | 29.2 | Very low | 35.5 | Very low | 125 Ų | 125 | 125.7 Ų | 125.7 | 77% | 0.767 | 68% | 0.684 | S | S | * | * | trans | -65.2 | 89.3 | 155.5 | -32.6 | 0 | 0 | 0 | 0 | 107 | ||||
| 425 | Y | 29.5 | Very low | 33.3 | Very low | 192 Ų | 192 | 131.8 Ų | 131.8 | 75% | 0.753 | 72% | 0.721 | S | S | * | * | trans | -134.9 | 88.9 | 160.8 | -76.4 | -71.2 | 0 | 0 | 0 | 107.2 | H423 | H423-Y425 HydrophobicContact CB-CD2 4.18Å; H423-Y425 AromaticContact ND1-CD2 3.62Å; H423-Y425 AromaticContact ND1-CE2 3.45Å; H423-Y425 WeakPolarHBondContact ND1-CE2 3.43Å; H423-Y425 PolarHBondContact O-N 3.15Å | ||
| 426 | S | 27.2 | Very low | 31.3 | Very low | 105 Ų | 105 | 140.1 Ų | 140.1 | 73% | 0.734 | 76% | 0.759 | S | S | * | * | trans | -69.5 | 144.9 | 144.8 | 63 | 0 | 0 | 0 | 0 | 106.8 | ||||
| 427 | P | 30.1 | Very low | 29.6 | Very low | 88 Ų | 88 | 139.9 Ų | 139.9 | 57% | 0.571 | 77% | 0.765 | S | S | * | * | -143.3 | 172.1 | 78.8 | 19.7 | 5.7 | 0 | 0 | 0 | 114.5 | |||||
| 428 | W | 29.6 | Very low | 28.4 | Very low | 237 Ų | 237 | 145.5 Ų | 145.5 | 90% | 0.898 | 79% | 0.785 | S | S | * | * | trans | 96.5 | 84.3 | 165.1 | -38.7 | 107.9 | 0 | 0 | 0 | 117 | ||||
| 429 | D | 26.5 | Very low | 27.3 | Very low | 160 Ų | 160 | 142.8 Ų | 142.8 | 86% | 0.856 | 78% | 0.784 | S | S | * | * | trans | -51.8 | 134.3 | 148.8 | -67.8 | -55.4 | 0 | 0 | 0 | 111.7 | ||||
| 430 | L | 31.5 | Very low | 26.8 | Very low | 176 Ų | 176 | 142.3 Ų | 142.3 | 92% | 0.921 | 79% | 0.785 | S | S | * | * | trans | -144 | 120.2 | 144.8 | -90.2 | 173.9 | 0 | 0 | 0 | 109.6 | ||||
| 431 | N | 26.9 | Very low | 26.5 | Very low | 174 Ų | 174 | 143.1 Ų | 143.1 | 93% | 0.93 | 79% | 0.785 | S | S | * | * | trans | -32.7 | 130.5 | 175.9 | -83.3 | -27.7 | 0 | 0 | 0 | 115.9 | ||||
| 432 | G | 25.8 | Very low | 26.1 | Very low | 77 Ų | 77 | 146.5 Ų | 146.5 | 79% | 0.794 | 80% | 0.798 | S | S | * | * | trans | -164.7 | 99.6 | 165.8 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 433 | T | 22.4 | Very low | 25.6 | Very low | 136 Ų | 136 | 147.8 Ų | 147.8 | 83% | 0.834 | 80% | 0.797 | S | S | * | * | trans | -49.3 | 138.6 | -177.7 | 46 | 0 | 0 | 0 | 0 | 115.9 | ||||
| 434 | S | 24.2 | Very low | 25.3 | Very low | 108 Ų | 108 | 146.5 Ų | 146.5 | 76% | 0.755 | 80% | 0.804 | S | S | * | * | 124.4 | 133.3 | 123.4 | 73.6 | 0 | 0 | 0 | 0 | 118.4 | |||||
| 435 | V | 23.4 | Very low | 24.9 | Very low | 136 Ų | 136 | 145 Ų | 145 | 82% | 0.824 | 79% | 0.794 | S | S | * | * | trans | 91.5 | 102.8 | 153.2 | -161.4 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 436 | E | 22.6 | Very low | 24.6 | Very low | 188 Ų | 188 | 145 Ų | 145 | 88% | 0.879 | 80% | 0.801 | S | S | * | * | trans | -68.2 | 154.4 | 167.4 | -75.1 | 173.2 | 134.9 | 0 | 0 | 113.6 | ||||
| 437 | L | 22.7 | Very low | 24.3 | Very low | 164 Ų | 164 | 147.7 Ų | 147.7 | 86% | 0.859 | 81% | 0.807 | S | S | * | * | trans | -46.7 | 152 | 167.6 | -92.6 | 63.9 | 0 | 0 | 0 | 115.2 | ||||
| 438 | E | 21.1 | Very low | 24.3 | Very low | 180 Ų | 180 | 148.2 Ų | 148.2 | 84% | 0.841 | 81% | 0.81 | S | S | * | * | -166.8 | 131.8 | 118.4 | -114.5 | 179.2 | 154.3 | 0 | 0 | 114 | |||||
| 439 | S | 23.4 | Very low | 24 | Very low | 113 Ų | 113 | 142 Ų | 142 | 79% | 0.79 | 80% | 0.802 | S | S | * | * | trans | -166.5 | 91.4 | 133 | 20.8 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 440 | S | 23.8 | Very low | 23.8 | Very low | 98 Ų | 98 | 140.8 Ų | 140.8 | 69% | 0.685 | 79% | 0.791 | S | S | * | * | 31.2 | 140.5 | 122.1 | 10.6 | 0 | 0 | 0 | 0 | 119.9 | |||||
| 441 | E | 24.6 | Very low | 23.4 | Very low | 174 Ų | 174 | 142.6 Ų | 142.6 | 81% | 0.813 | 79% | 0.786 | S | S | * | * | cis | -162.2 | 161 | 1.4 | -62.2 | -168.3 | 136.3 | 0 | 0 | 108 | ||||
| 442 | I | 22.1 | Very low | 23.1 | Very low | 173 Ų | 173 | 139.1 Ų | 139.1 | 89% | 0.887 | 78% | 0.776 | S | S | * | * | -164.3 | 133.3 | 117.7 | -88.6 | 154.6 | 0 | 0 | 0 | 108.7 | |||||
| 443 | F | 21.1 | Very low | 22.9 | Very low | 161 Ų | 161 | 139.7 Ų | 139.7 | 71% | 0.706 | 77% | 0.773 | S | S | * | * | trans | -89.1 | 143.8 | -164.1 | 177.4 | -96.6 | 0 | 0 | 0 | 114.1 | T445 | F443-T445 HydrophobicContact CD1-CG2 4.33Å; F443-T445 HydrophobicContact CE1-CG2 3.4Å; F443-T445 VanDerWaalsContact CE1-CG2 3.4Å; F443-T445 HydrophobicContact CE2-CG2 3.92Å; F443-T445 HydrophobicContact CZ-CG2 3.18Å | ||
| 444 | S | 23.4 | Very low | 23 | Very low | 112 Ų | 112 | 141.9 Ų | 141.9 | 78% | 0.783 | 77% | 0.773 | S | S | * | * | trans | -163.8 | 96.5 | 138.5 | 11 | 0 | 0 | 0 | 0 | 111.6 | ||||
| 445 | T | 21.3 | Very low | 23 | Very low | 92 Ų | 92 | 144.3 Ų | 144.3 | 56% | 0.564 | 77% | 0.773 | S | S | * | * | trans | 7.7 | 125.4 | 142 | 47.6 | 0 | 0 | 0 | 0 | 120.4 | F443 | F443-T445 HydrophobicContact CD1-CG2 4.33Å; F443-T445 HydrophobicContact CE1-CG2 3.4Å; F443-T445 VanDerWaalsContact CE1-CG2 3.4Å; F443-T445 HydrophobicContact CE2-CG2 3.92Å; F443-T445 HydrophobicContact CZ-CG2 3.18Å | ||
| 446 | Q | 23.2 | Very low | 22.9 | Very low | 193 Ų | 193 | 141.3 Ų | 141.3 | 90% | 0.902 | 76% | 0.762 | S | S | * | * | -173.2 | 134 | 99.1 | -95.1 | 179.3 | -13.8 | 0 | 0 | 111.6 | |||||
| 447 | L | 20.3 | Very low | 22.9 | Very low | 162 Ų | 162 | 140.6 Ų | 140.6 | 85% | 0.848 | 76% | 0.759 | S | S | * | * | trans | -81.9 | -177.8 | 177.7 | -103.7 | 87.8 | 0 | 0 | 0 | 111.9 | ||||
| 448 | P | 29.9 | Very low | 22.9 | Very low | 99 Ų | 99 | 144.2 Ų | 144.2 | 64% | 0.643 | 76% | 0.761 | S | S | * | * | cis | -144.7 | -171.3 | -33.6 | 37.5 | -17.8 | 0 | 0 | 0 | 115.3 | ||||
| 449 | S | 23.2 | Very low | 23 | Very low | 105 Ų | 105 | 141.2 Ų | 141.2 | 73% | 0.734 | 76% | 0.756 | S | S | * | * | trans | 90.2 | 139.2 | 151.1 | 79.9 | 0 | 0 | 0 | 0 | 116 | ||||
| 450 | H | 22.8 | Very low | 23 | Very low | 135 Ų | 135 | 143.4 Ų | 143.4 | 63% | 0.625 | 76% | 0.759 | S | S | * | * | cis | -170.1 | 152.5 | 20.9 | -149.4 | -117.2 | 0 | 0 | 0 | 109.4 | ||||
| 451 | W | 23.3 | Very low | 23 | Very low | 215 Ų | 215 | 143 Ų | 143 | 81% | 0.814 | 76% | 0.761 | S | S | * | * | trans | 71.1 | 106 | 152.5 | -82.7 | -23.3 | 0 | 0 | 0 | 125 | ||||
| 452 | S | 21.3 | Very low | 22.9 | Very low | 101 Ų | 101 | 143.5 Ų | 143.5 | 71% | 0.706 | 76% | 0.764 | S | S | * | * | 48.1 | 133.1 | 115.2 | 53.2 | 0 | 0 | 0 | 0 | 122.5 | |||||
| 453 | A | 22 | Very low | 23 | Very low | 89 Ų | 89 | 141.1 Ų | 141.1 | 74% | 0.736 | 76% | 0.757 | S | S | * | * | trans | -50.8 | 148.9 | 167.5 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 454 | E | 24.1 | Very low | 23.1 | Very low | 181 Ų | 181 | 140.6 Ų | 140.6 | 85% | 0.846 | 76% | 0.762 | S | S | * | * | -177.2 | 146.7 | 120.1 | -97.6 | 174.7 | 154.7 | 0 | 0 | 110.9 | |||||
| 455 | E | 23.3 | Very low | 23.4 | Very low | 159 Ų | 159 | 146.7 Ų | 146.7 | 74% | 0.743 | 77% | 0.768 | S | S | * | * | trans | 60.7 | 105.4 | 153.5 | -99.8 | 65.6 | -169.6 | 0 | 0 | 123.3 | ||||
| 456 | A | 22.1 | Very low | 23.5 | Very low | 73 Ų | 73 | 146.5 Ų | 146.5 | 60% | 0.603 | 77% | 0.77 | S | S | * | * | 61.4 | 120 | 110.7 | 0 | 0 | 0 | 0 | 0 | 121.8 | |||||
| 457 | Q | 22.8 | Very low | 23.7 | Very low | 174 Ų | 174 | 148.6 Ų | 148.6 | 81% | 0.813 | 77% | 0.77 | S | S | * | * | trans | 56.6 | 105.8 | 138.4 | -77.6 | 158 | -54.7 | 0 | 0 | 118.7 | ||||
| 458 | R | 22.9 | Very low | 24.4 | Very low | 239 Ų | 239 | 144.2 Ų | 144.2 | 90% | 0.902 | 76% | 0.764 | S | S | * | * | -174.3 | 128.3 | 112 | -101.7 | 173.6 | -159.7 | 100.3 | -2.5 | 111.1 | |||||
| 459 | T | 23.2 | Very low | 24.4 | Very low | 118 Ų | 118 | 147.3 Ų | 147.3 | 72% | 0.724 | 77% | 0.774 | S | S | * | * | trans | -56.8 | 132.5 | 152.8 | 42.5 | 0 | 0 | 0 | 0 | 109.6 | ||||
| 460 | D | 21.6 | Very low | 24.6 | Very low | 159 Ų | 159 | 149.2 Ų | 149.2 | 85% | 0.85 | 78% | 0.776 | S | S | * | * | 177.7 | 154 | 112.6 | -82.5 | -24.6 | 0 | 0 | 0 | 111.3 | |||||
| 461 | A | 24.7 | Very low | 25.1 | Very low | 90 Ų | 90 | 148.5 Ų | 148.5 | 74% | 0.744 | 78% | 0.783 | S | S | * | * | trans | -54.7 | 142.5 | -165.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 462 | E | 23.2 | Very low | 25.5 | Very low | 184 Ų | 184 | 145.7 Ų | 145.7 | 86% | 0.86 | 78% | 0.779 | S | S | * | * | -176.3 | 135.8 | 118.1 | -110.9 | 168.8 | 159 | 0 | 0 | 113.1 | |||||
| 463 | T | 24.3 | Very low | 26.1 | Very low | 122 Ų | 122 | 149.4 Ų | 149.4 | 75% | 0.748 | 78% | 0.783 | S | S | * | * | trans | 71.6 | 100.3 | 151 | -29.4 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 464 | D | 23.2 | Very low | 26.5 | Very low | 150 Ų | 150 | 149.3 Ų | 149.3 | 80% | 0.802 | 77% | 0.773 | S | S | * | * | -150.3 | 112.5 | 121.1 | -140 | -11.1 | 0 | 0 | 0 | 112.5 | |||||
| 465 | R | 28.4 | Very low | 27.1 | Very low | 241 Ų | 241 | 147.8 Ų | 147.8 | 91% | 0.909 | 77% | 0.766 | S | S | * | * | trans | -89.8 | 109.5 | 162.4 | -86.2 | -176.8 | 177.5 | 165 | 0 | 106.1 | ||||
| 466 | S | 23.8 | Very low | 28 | Very low | 88 Ų | 88 | 145.1 Ų | 145.1 | 62% | 0.615 | 76% | 0.76 | S | S | * | * | trans | -150.2 | 100.9 | 165.6 | 168.6 | 0 | 0 | 0 | 0 | 111 | ||||
| 467 | W | 27.9 | Very low | 29.5 | Very low | 236 Ų | 236 | 149 Ų | 149 | 89% | 0.894 | 77% | 0.766 | S | S | * | * | trans | 54.3 | 103.6 | 151.1 | -58.2 | 99.2 | 0 | 0 | 0 | 118.8 | L469 | W467-L469 PolarHBondContact O-N 2.85Š| ||
| 468 | G | 35 | Very low | 31.3 | Very low | 71 Ų | 71 | 142.3 Ų | 142.3 | 73% | 0.732 | 74% | 0.736 | S | S | * | * | trans | -58 | 126.8 | 158.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 469 | L | 29.9 | Very low | 33.7 | Very low | 163 Ų | 163 | 133.9 Ų | 133.9 | 85% | 0.853 | 71% | 0.713 | S | S | * | * | trans | -123.4 | 102.4 | 135.1 | -91.5 | 99.1 | 0 | 0 | 0 | 105.6 | W467 P471 | W467-L469 PolarHBondContact O-N 2.85Å; L469-P471 WeakPolarHBondContact O-CD 3.28Å | ||
| 470 | D | 27.5 | Very low | 36.3 | Very low | 146 Ų | 146 | 132.1 Ų | 132.1 | 78% | 0.781 | 71% | 0.706 | S | S | * | * | trans | -56.1 | 125.8 | 157.4 | -66.8 | -50.6 | 0 | 0 | 0 | 106.9 | E472 | D470-E472 PolarHBondContact O-N 3.34Š| ||
| 471 | P | 33.5 | Very low | 39.2 | Very low | 119 Ų | 119 | 129 Ų | 129 | 77% | 0.773 | 70% | 0.696 | S | S | * | * | trans | -70.2 | 89.8 | 159.8 | 29.1 | -27 | 0 | 0 | 0 | 105.2 | L469 K473 | L469-P471 WeakPolarHBondContact O-CD 3.28Å; P471-K473 VanDerWaalsContact C-N 3.31Å; P471-K473 PolarHBondContact O-N 3.41Å | ||
| 472 | E | 31.2 | Very low | 41.9 | Very low | 157 Ų | 157 | 126.6 Ų | 126.6 | 73% | 0.734 | 67% | 0.671 | S | S | * | * | trans | -52.4 | 100.4 | 166.6 | -172.9 | 172.1 | 163.3 | 0 | 0 | 107.2 | D470 T474 | D470-E472 PolarHBondContact O-N 3.34Å; E472-T474 HydrophobicContact CG-CG2 4.41Å; E472-T474 PolarHBondContact O-N 2.92Å; E472-T474 PolarHBondContact O-OG1 2.92Å | ||
| 473 | K | 34.3 | Very low | 44.8 | Very low | 178 Ų | 178 | 119.3 Ų | 119.3 | 77% | 0.774 | 64% | 0.636 | S | S | * | * | trans | -67.1 | 79.2 | 166.8 | -77 | -179.2 | 179.1 | 174.7 | 0 | 107.2 | P471 H475 | P471-K473 VanDerWaalsContact C-N 3.31Å; P471-K473 PolarHBondContact O-N 3.41Å; K473-H475 PolarHBondContact O-N 2.89Å | ||
| 474 | T | 30.2 | Very low | 47.8 | Very low | 87 Ų | 87 | 120.9 Ų | 120.9 | 53% | 0.534 | 63% | 0.628 | S | S | . | * | trans | -72.4 | 81.8 | 166 | 7.2 | 0 | 0 | 0 | 0 | 107.6 | E472 V476 | E472-T474 HydrophobicContact CG-CG2 4.41Å; E472-T474 PolarHBondContact O-N 2.92Å; E472-T474 PolarHBondContact O-OG1 2.92Å; T474-V476 PolarHBondContact O-N 3.41Å | ||
| 475 | H | 36.1 | Very low | 51 | Low | 149 Ų | 149 | 115.3 Ų | 115.3 | 69% | 0.69 | 60% | 0.603 | S | S | * | * | trans | -64.8 | 87.7 | 156.4 | -75.3 | -90.1 | 0 | 0 | 0 | 106.7 | K473 E477 | K473-H475 PolarHBondContact O-N 2.89Å; H475-E477 PolarHBondContact O-N 3.01Å | ||
| 476 | V | 43.2 | Very low | 53.9 | Low | 104 Ų | 104 | 103.9 Ų | 103.9 | 63% | 0.63 | 56% | 0.561 | S | S | * | * | trans | -71.6 | 89.9 | 169.9 | -177.4 | 0 | 0 | 0 | 0 | 106.4 | T474 L478 | T474-V476 PolarHBondContact O-N 3.41Å; V476-L478 PolarHBondContact O-N 3.5Å; V476-L478 VanDerWaalsContact O-N 3.11Å | ||
| 477 | E | 52.4 | Low | 57.1 | Low | 154 Ų | 154 | 100.4 Ų | 100.4 | 72% | 0.72 | 54% | 0.535 | S | S | * | . | P | Polyproline II helix | trans | -57 | 116.1 | 170.7 | -71.8 | -170.7 | 159.3 | 0 | 0 | 108.3 | H475 S479 | H475-E477 PolarHBondContact O-N 3.01Å; E477-S479 PolarHBondContact O-N 2.9Å |
| 478 | L | 60.9 | Low | 60.2 | Low | 34 Ų | 34 | 93.9 Ų | 93.9 | 18% | 0.178 | 52% | 0.517 | C | S | . | . | P | Polyproline II helix | trans | -52.9 | 129.1 | 171.1 | -172.7 | 67.4 | 0 | 0 | 0 | 108 | V347 V476 S480 L482 K483 | V347-L478 WeakPolarHBondContact O-CD2 3.27Å; V476-L478 PolarHBondContact O-N 3.5Å; V476-L478 VanDerWaalsContact O-N 3.11Å; L478-S480 PolarHBondContact O-N 2.94Å; L478-L482 HydrophobicContact CD1-CB 3.91Å; L478-L482 HydrophobicContact CD1-CD1 3.65Å; L478-L482 HydrophobicContact CD1-CG 4.44Å; L478-L482 HydrophobicContact CD2-CB 3.95Å; L478-L482 HydrophobicContact CG-CB 3.74Å; L478-L482 HydrophobicContact CG-CD1 4.33Å; L478-K483 HydrophobicContact CB-CG 4Å; L478-K483 HydrophobicContact CD2-CG 3.8Å; L478-K483 HydrophobicContact CG-CG 4.09Å; L478-K483 VanDerWaalsContact O-CE 3.23Å; L478-K483 WeakPolarHBondContact O-CE 3.32Å |
| 479 | S | 72.4 | Confident | 63 | Low | 61 Ų | 61 | 91.1 Ų | 91.1 | 43% | 0.427 | 49% | 0.486 | S | S | . | . | P | Polyproline II helix | trans | -49.1 | 133.8 | 179.6 | 71.7 | 0 | 0 | 0 | 0 | 109.5 | E477 S481 L482 K483 | E477-S479 PolarHBondContact O-N 2.9Å; S479-S481 PolarHBondContact O-N 3.38Å; S479-L482 PolarHBondContact O-N 3.33Å; S479-L482 WeakPolarHBondContact OG-CD1 3.46Å; S479-L482 VanDerWaalsContact OG-CG 3.24Å; S479-L482 WeakPolarHBondContact OG-CG 3.44Å; S479-K483 PolarHBondContact O-N 3.14Å |
| 480 | S | 78.8 | Confident | 66 | Low | 82 Ų | 82 | 83.4 Ų | 83.4 | 57% | 0.573 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -52.9 | -35.7 | -173.1 | -47.8 | 0 | 0 | 0 | 0 | 111.3 | L478 L482 K483 W484 | L478-S480 PolarHBondContact O-N 2.94Å; S480-L482 PolarHBondContact O-N 3.16Å; S480-K483 WeakPolarHBondContact O-CB 3.47Å; S480-K483 PolarHBondContact O-N 2.87Å; S480-W484 PolarHBondContact O-N 3.28Å; S480-W484 VanDerWaalsContact O-N 3.12Å |
| 481 | S | 82.7 | Confident | 69.2 | Low | 93 Ų | 93 | 78.3 Ų | 78.3 | 65% | 0.65 | 42% | 0.418 | S | S | * | . | H | α-helix | trans | -57.3 | -41.3 | 174.8 | -52.5 | 0 | 0 | 0 | 0 | 114 | S479 A485 | S479-S481 PolarHBondContact O-N 3.38Å; S481-A485 VanDerWaalsContact O-CB 3.27Å; S481-A485 WeakPolarHBondContact O-CB 3.45Å; S481-A485 PolarHBondContact O-N 3.13Å |
| 482 | L | 81.7 | Confident | 72.2 | Confident | 40 Ų | 40 | 75.9 Ų | 75.9 | 21% | 0.209 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -71.9 | -35.5 | 178.5 | -71.6 | 171.2 | 0 | 0 | 0 | 112.2 | L403 L478 S479 S480 A485 S486 | L403-L482 HydrophobicContact CD2-CD2 3.71Å; L478-L482 HydrophobicContact CD1-CB 3.91Å; L478-L482 HydrophobicContact CD1-CD1 3.65Å; L478-L482 HydrophobicContact CD1-CG 4.44Å; L478-L482 HydrophobicContact CD2-CB 3.95Å; L478-L482 HydrophobicContact CG-CB 3.74Å; L478-L482 HydrophobicContact CG-CD1 4.33Å; S479-L482 PolarHBondContact O-N 3.33Å; S479-L482 WeakPolarHBondContact OG-CD1 3.46Å; S479-L482 VanDerWaalsContact OG-CG 3.24Å; S479-L482 WeakPolarHBondContact OG-CG 3.44Å; S480-L482 PolarHBondContact O-N 3.16Å; L482-A485 PolarHBondContact O-N 2.89Å; L482-S486 WeakPolarHBondContact O-CB 3.13Å; L482-S486 PolarHBondContact O-N 2.95Å; L482-S486 PolarHBondContact O-OG 3.37Å |
| 483 | K | 83.8 | Confident | 75.3 | Confident | 31 Ų | 31 | 68.5 Ų | 68.5 | 14% | 0.135 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -59.1 | -51.4 | 173.1 | -63.7 | -178.3 | 179.5 | -168.2 | 0 | 110.3 | G348 D350 L478 S479 S480 S486 L487 | G348-K483 WeakPolarHBondContact O-CD 3.45Å; G348-K483 WeakPolarHBondContact O-CE 3.32Å; G348-K483 PolarHBondContact O-NZ 2.93Å; D350-K483 IonicContact OD2-NZ 3.96Å; D350-K483 PolarHBondContact OD2-NZ 3.49Å; L478-K483 HydrophobicContact CB-CG 4Å; L478-K483 HydrophobicContact CD2-CG 3.8Å; L478-K483 HydrophobicContact CG-CG 4.09Å; L478-K483 VanDerWaalsContact O-CE 3.23Å; L478-K483 WeakPolarHBondContact O-CE 3.32Å; S479-K483 PolarHBondContact O-N 3.14Å; S480-K483 WeakPolarHBondContact O-CB 3.47Å; S480-K483 PolarHBondContact O-N 2.87Å; K483-S486 PolarHBondContact O-N 3.27Å; K483-L487 PolarHBondContact O-N 3.46Å; K483-L487 VanDerWaalsContact O-N 3.14Å |
| 484 | W | 87.9 | Confident | 78.2 | Confident | 154 Ų | 154 | 60.3 Ų | 60.3 | 58% | 0.583 | 33% | 0.331 | S | S | * | . | H | α-helix | trans | -67.2 | -38.4 | 179 | -69.5 | 111.2 | 0 | 0 | 0 | 112.8 | S480 S486 L487 I488 | S480-W484 PolarHBondContact O-N 3.28Å; S480-W484 VanDerWaalsContact O-N 3.12Å; W484-S486 VanDerWaalsContact C-N 3.33Å; W484-S486 PolarHBondContact O-N 3.31Å; W484-L487 HydrophobicContact CE3-CD2 3.92Å; W484-L487 HydrophobicContact CZ3-CD2 3.87Å; W484-L487 PolarHBondContact O-N 3.43Å; W484-I488 VanDerWaalsContact O-CG1 3.26Å; W484-I488 WeakPolarHBondContact O-CG1 3.14Å; W484-I488 PolarHBondContact O-N 3.37Å |
| 485 | A | 90.1 | Very high | 81.2 | Confident | 33 Ų | 33 | 57.4 Ų | 57.4 | 27% | 0.273 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -60.9 | -42.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 112 | L403 S481 L482 I488 S489 | L403-A485 HydrophobicContact CD1-CB 3.92Å; L403-A485 HydrophobicContact CD2-CB 4.41Å; S481-A485 VanDerWaalsContact O-CB 3.27Å; S481-A485 WeakPolarHBondContact O-CB 3.45Å; S481-A485 PolarHBondContact O-N 3.13Å; L482-A485 PolarHBondContact O-N 2.89Å; A485-I488 PolarHBondContact O-N 2.97Å; A485-S489 WeakPolarHBondContact O-CB 3.45Å; A485-S489 PolarHBondContact O-N 3.31Å |
| 486 | S | 88.7 | Confident | 84.1 | Confident | 2 Ų | 2 | 50.8 Ų | 50.8 | 1% | 0.014 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -64.5 | -42.7 | 177.2 | -60.7 | 0 | 0 | 0 | 0 | 112 | L482 K483 W484 S489 L490 | L482-S486 WeakPolarHBondContact O-CB 3.13Å; L482-S486 PolarHBondContact O-N 2.95Å; L482-S486 PolarHBondContact O-OG 3.37Å; K483-S486 PolarHBondContact O-N 3.27Å; W484-S486 VanDerWaalsContact C-N 3.33Å; W484-S486 PolarHBondContact O-N 3.31Å; S486-S489 WeakPolarHBondContact O-CB 3.36Å; S486-S489 PolarHBondContact O-N 2.92Å; S486-L490 PolarHBondContact O-N 2.77Å |
| 487 | L | 90.6 | Very high | 86.5 | Confident | 14 Ų | 14 | 46.3 Ų | 46.3 | 7% | 0.073 | 26% | 0.259 | C | S | . | . | H | α-helix | trans | -60.7 | -47.6 | 173.5 | 174.5 | 62 | 0 | 0 | 0 | 111.4 | L344 F349 A358 F362 K483 W484 S489 L490 L491 | L344-L487 HydrophobicContact CD2-CD1 3.69Å; F349-L487 HydrophobicContact CE2-CB 4.44Å; F349-L487 HydrophobicContact CZ-CB 4.45Å; F349-L487 HydrophobicContact CZ-CD2 3.98Å; A358-L487 HydrophobicContact CB-CD1 4.3Å; A358-L487 HydrophobicContact CB-CD2 4.45Å; F362-L487 HydrophobicContact CE1-CD1 4.12Å; K483-L487 PolarHBondContact O-N 3.46Å; K483-L487 VanDerWaalsContact O-N 3.14Å; W484-L487 HydrophobicContact CE3-CD2 3.92Å; W484-L487 HydrophobicContact CZ3-CD2 3.87Å; W484-L487 PolarHBondContact O-N 3.43Å; L487-S489 VanDerWaalsContact C-N 3.28Å; L487-S489 PolarHBondContact O-N 3.35Å; L487-L490 PolarHBondContact O-N 3.07Å; L487-L491 HydrophobicContact CD1-CD1 4.17Å; L487-L491 HydrophobicContact CD1-CG 4.11Å; L487-L491 HydrophobicContact CG-CD1 4.05Å; L487-L491 HydrophobicContact CG-CG 4.4Å; L487-L491 WeakPolarHBondContact O-CG 3.32Å; L487-L491 PolarHBondContact O-N 3.48Å |
| 488 | I | 93.4 | Very high | 88.4 | Confident | 100 Ų | 100 | 39 Ų | 39 | 51% | 0.513 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -59.1 | -42.7 | 178 | -69.8 | 164.8 | 0 | 0 | 0 | 110.3 | W484 A485 L490 L491 V492 | W484-I488 VanDerWaalsContact O-CG1 3.26Å; W484-I488 WeakPolarHBondContact O-CG1 3.14Å; W484-I488 PolarHBondContact O-N 3.37Å; A485-I488 PolarHBondContact O-N 2.97Å; I488-L490 VanDerWaalsContact C-N 3.35Å; I488-L490 PolarHBondContact O-N 3.15Å; I488-L491 PolarHBondContact O-N 3.42Å; I488-V492 HydrophobicContact CG2-CG2 4.28Å; I488-V492 VanDerWaalsContact O-CG2 3.31Å; I488-V492 WeakPolarHBondContact O-CG2 3.29Å; I488-V492 PolarHBondContact O-N 3.05Å |
| 489 | S | 94.1 | Very high | 89.8 | Confident | 12 Ų | 12 | 40.2 Ų | 40.2 | 8% | 0.084 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -59.6 | -44.3 | 177.3 | -143.5 | 0 | 0 | 0 | 0 | 112.3 | S396 A485 S486 L487 V492 Y493 | S396-S489 PolarHBondContact O-OG 2.87Å; A485-S489 WeakPolarHBondContact O-CB 3.45Å; A485-S489 PolarHBondContact O-N 3.31Å; S486-S489 WeakPolarHBondContact O-CB 3.36Å; S486-S489 PolarHBondContact O-N 2.92Å; L487-S489 VanDerWaalsContact C-N 3.28Å; L487-S489 PolarHBondContact O-N 3.35Å; S489-V492 PolarHBondContact O-N 3.06Å; S489-Y493 PolarHBondContact O-N 3.28Å |
| 490 | L | 93.3 | Very high | 90.7 | Very high | 1 Ų | 1 | 37.4 Ų | 37.4 | 1% | 0.005 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -64.4 | -40.6 | 175.2 | -76.6 | 166.6 | 0 | 0 | 0 | 112.5 | I336 L343 L344 F362 L400 S486 L487 I488 Y493 V494 | I336-L490 HydrophobicContact CG2-CD2 4.01Å; L343-L490 HydrophobicContact CD2-CD1 3.92Å; L343-L490 HydrophobicContact CD2-CD2 3.69Å; L343-L490 HydrophobicContact CD2-CG 4.47Å; L343-L490 HydrophobicContact CG-CD1 4.32Å; L344-L490 HydrophobicContact CD2-CD1 3.95Å; F362-L490 HydrophobicContact CE1-CB 4.14Å; F362-L490 HydrophobicContact CZ-CB 3.68Å; F362-L490 HydrophobicContact CZ-CD1 4.1Å; F362-L490 HydrophobicContact CZ-CD2 4.5Å; F362-L490 HydrophobicContact CZ-CG 4.3Å; L400-L490 HydrophobicContact CD1-CG 4.34Å; L400-L490 HydrophobicContact CD2-CD1 4.3Å; L400-L490 HydrophobicContact CD2-CD2 3.45Å; L400-L490 VanDerWaalsContact CD2-CD2 3.45Å; L400-L490 HydrophobicContact CD2-CG 3.65Å; S486-L490 PolarHBondContact O-N 2.77Å; L487-L490 PolarHBondContact O-N 3.07Å; I488-L490 VanDerWaalsContact C-N 3.35Å; I488-L490 PolarHBondContact O-N 3.15Å; L490-Y493 WeakPolarHBondContact O-CB 3.1Å; L490-Y493 PolarHBondContact O-N 3.18Å; L490-V494 WeakPolarHBondContact O-CG2 3.44Å; L490-V494 PolarHBondContact O-N 3.41Å |
| 491 | L | 94.8 | Very high | 91.2 | Very high | 40 Ų | 40 | 33.5 Ų | 33.5 | 21% | 0.209 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -65.8 | -41 | 176.5 | -68.1 | 175.1 | 0 | 0 | 0 | 111.6 | F362 V365 L487 I488 Y493 V494 A495 | F362-L491 HydrophobicContact CD1-CD2 3.51Å; F362-L491 HydrophobicContact CE1-CD2 3.94Å; F362-L491 HydrophobicContact CG-CD2 4.46Å; V365-L491 WeakPolarHBondContact CG1-O 3.34Å; V365-L491 HydrophobicContact CG2-CB 4.41Å; V365-L491 HydrophobicContact CG2-CD2 3.97Å; L487-L491 HydrophobicContact CD1-CD1 4.17Å; L487-L491 HydrophobicContact CD1-CG 4.11Å; L487-L491 HydrophobicContact CG-CD1 4.05Å; L487-L491 HydrophobicContact CG-CG 4.4Å; L487-L491 WeakPolarHBondContact O-CG 3.32Å; L487-L491 PolarHBondContact O-N 3.48Å; I488-L491 PolarHBondContact O-N 3.42Å; L491-Y493 VanDerWaalsContact C-N 3.34Å; L491-V494 PolarHBondContact O-N 3.32Å; L491-A495 WeakPolarHBondContact O-CB 3.45Å; L491-A495 PolarHBondContact O-N 2.87Å |
| 492 | V | 96.1 | Very high | 91.2 | Very high | 68 Ų | 68 | 29.5 Ų | 29.5 | 41% | 0.412 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -62.1 | -42.9 | 174.6 | 171.2 | 0 | 0 | 0 | 0 | 110.7 | I488 S489 V494 A495 A496 | I488-V492 HydrophobicContact CG2-CG2 4.28Å; I488-V492 VanDerWaalsContact O-CG2 3.31Å; I488-V492 WeakPolarHBondContact O-CG2 3.29Å; I488-V492 PolarHBondContact O-N 3.05Å; S489-V492 PolarHBondContact O-N 3.06Å; V492-V494 PolarHBondContact O-N 3.34Å; V492-A495 PolarHBondContact O-N 2.66Å; V492-A496 VanDerWaalsContact O-CB 3.28Å; V492-A496 WeakPolarHBondContact O-CB 3.41Å; V492-A496 PolarHBondContact O-N 3.49Å |
| 493 | Y | 96.2 | Very high | 91.3 | Very high | 2 Ų | 2 | 28.3 Ų | 28.3 | 1% | 0.008 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -56.9 | -50 | 173.9 | 169.6 | -96.2 | 0 | 0 | 0 | 111.9 | T331 Q333 I336 M393 S396 L397 S489 L490 L491 A495 A496 F497 | T331-Y493 PolarHBondContact O-OH 3.46Å; T331-Y493 VanDerWaalsContact O-OH 3.09Å; Q333-Y493 WeakPolarHBondContact CA-OH 3.37Å; Q333-Y493 WeakPolarHBondContact CB-OH 3.35Å; Q333-Y493 PolarHBondContact N-OH 3.07Å; I336-Y493 HydrophobicContact CB-CD1 4.49Å; I336-Y493 HydrophobicContact CB-CE1 3.94Å; I336-Y493 HydrophobicContact CD1-CD1 3.8Å; I336-Y493 HydrophobicContact CD1-CE1 3.28Å; I336-Y493 HydrophobicContact CD1-CE2 4.13Å; I336-Y493 HydrophobicContact CD1-CG 4.41Å; I336-Y493 VanDerWaalsContact CD1-CZ 3.47Å; I336-Y493 HydrophobicContact CG1-CE1 4.19Å; I336-Y493 HydrophobicContact CG2-CD1 3.9Å; I336-Y493 HydrophobicContact CG2-CE1 3.82Å; M393-Y493 HydrophobicContact CB-CD2 3.9Å; M393-Y493 HydrophobicContact CB-CE2 4.02Å; M393-Y493 HydrophobicContact CE-CD2 4.26Å; M393-Y493 HydrophobicContact CE-CE2 3.4Å; M393-Y493 VanDerWaalsContact CE-CE2 3.4Å; M393-Y493 HydrophobicContact CG-CD2 3.87Å; M393-Y493 HydrophobicContact CG-CE2 3.97Å; M393-Y493 HydrophobicContact SD-CE2 4.47Å; S396-Y493 WeakPolarHBondContact OG-CA 3.32Å; L397-Y493 HydrophobicContact CD1-CD2 3.66Å; L397-Y493 HydrophobicContact CD1-CE2 3.44Å; L397-Y493 VanDerWaalsContact CD1-CE2 3.44Å; L397-Y493 HydrophobicContact CD2-CD2 3.82Å; L397-Y493 HydrophobicContact CD2-CE2 4.16Å; L397-Y493 HydrophobicContact CD2-CG 4.12Å; L397-Y493 HydrophobicContact CG-CD2 3.52Å; L397-Y493 HydrophobicContact CG-CE2 3.87Å; L397-Y493 HydrophobicContact CG-CG 4.27Å; S489-Y493 PolarHBondContact O-N 3.28Å; L490-Y493 WeakPolarHBondContact O-CB 3.1Å; L490-Y493 PolarHBondContact O-N 3.18Å; L491-Y493 VanDerWaalsContact C-N 3.34Å; Y493-A495 PolarHBondContact O-N 3.48Å; Y493-A496 PolarHBondContact O-N 2.65Å; Y493-F497 PolarHBondContact O-N 3.12Å |
| 494 | V | 94.5 | Very high | 91.5 | Very high | 6 Ų | 6 | 26.9 Ų | 26.9 | 4% | 0.036 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -63.2 | -42.2 | 179 | 173.7 | 0 | 0 | 0 | 0 | 111.1 | L337 F362 V365 K366 L490 L491 V492 F497 S498 | L337-V494 HydrophobicContact CD2-CG2 4.26Å; F362-V494 HydrophobicContact CB-CG1 4.42Å; F362-V494 HydrophobicContact CB-CG2 4.38Å; F362-V494 HydrophobicContact CD2-CG2 3.74Å; F362-V494 HydrophobicContact CE2-CG2 4.18Å; F362-V494 HydrophobicContact CG-CG2 4.08Å; V365-V494 HydrophobicContact CG1-CB 4.48Å; V365-V494 HydrophobicContact CG1-CG1 4.3Å; K366-V494 HydrophobicContact CB-CG1 4.34Å; L490-V494 WeakPolarHBondContact O-CG2 3.44Å; L490-V494 PolarHBondContact O-N 3.41Å; L491-V494 PolarHBondContact O-N 3.32Å; V492-V494 PolarHBondContact O-N 3.34Å; V494-F497 PolarHBondContact O-N 3.06Å; V494-S498 WeakPolarHBondContact O-CB 3.14Å; V494-S498 PolarHBondContact O-N 3.26Å; V494-S498 PolarHBondContact O-OG 2.99Å |
| 495 | A | 94.6 | Very high | 91.6 | Very high | 26 Ų | 26 | 19.6 Ų | 19.6 | 22% | 0.215 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -59.5 | -49.3 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | V365 L491 V492 Y493 F497 S498 I499 | V365-A495 HydrophobicContact CG1-CB 3.42Å; V365-A495 VanDerWaalsContact CG1-CB 3.42Å; L491-A495 WeakPolarHBondContact O-CB 3.45Å; L491-A495 PolarHBondContact O-N 2.87Å; V492-A495 PolarHBondContact O-N 2.66Å; Y493-A495 PolarHBondContact O-N 3.48Å; A495-F497 PolarHBondContact O-N 2.75Å; A495-S498 PolarHBondContact O-N 3.16Å; A495-I499 WeakPolarHBondContact O-CG1 3.49Å; A495-I499 PolarHBondContact O-N 3.35Å |
| 496 | A | 95.4 | Very high | 91.3 | Very high | 9 Ų | 9 | 22.8 Ų | 22.8 | 7% | 0.074 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -60.9 | -45.1 | -179.2 | 0 | 0 | 0 | 0 | 0 | 111.5 | A392 M393 V492 Y493 S498 I499 S500 | A392-A496 HydrophobicContact CB-CB 3.61Å; M393-A496 HydrophobicContact CG-CB 3.65Å; V492-A496 VanDerWaalsContact O-CB 3.28Å; V492-A496 WeakPolarHBondContact O-CB 3.41Å; V492-A496 PolarHBondContact O-N 3.49Å; Y493-A496 PolarHBondContact O-N 2.65Å; A496-S498 VanDerWaalsContact C-N 3.34Å; A496-S498 PolarHBondContact O-N 3.12Å; A496-I499 PolarHBondContact O-N 3.04Å; A496-S500 WeakPolarHBondContact O-CB 3.33Å; A496-S500 PolarHBondContact O-N 2.61Å; A496-S500 VanDerWaalsContact O-N 3.1Å; A496-S500 PolarHBondContact O-OG 3.25Å |
| 497 | F | 93.9 | Very high | 91.1 | Very high | 10 Ų | 10 | 24.5 Ų | 24.5 | 4% | 0.044 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -60.4 | -44.3 | 174.9 | -176.9 | -84.8 | 0 | 0 | 0 | 112 | Q328 Q333 M393 Y493 V494 A495 I499 S500 L501 G502 | Q328-F497 HydrophobicContact CG-CE2 4.06Å; Q328-F497 HydrophobicContact CG-CZ 4.24Å; Q333-F497 HydrophobicContact CB-CD2 3.67Å; Q333-F497 HydrophobicContact CB-CE1 4.48Å; Q333-F497 HydrophobicContact CB-CE2 3.47Å; Q333-F497 VanDerWaalsContact CB-CE2 3.47Å; Q333-F497 HydrophobicContact CB-CG 4.26Å; Q333-F497 HydrophobicContact CB-CZ 3.92Å; Q333-F497 HydrophobicContact CG-CD1 3.73Å; Q333-F497 HydrophobicContact CG-CD2 3.66Å; Q333-F497 HydrophobicContact CG-CE1 3.63Å; Q333-F497 HydrophobicContact CG-CE2 3.54Å; Q333-F497 HydrophobicContact CG-CG 3.76Å; Q333-F497 HydrophobicContact CG-CZ 3.53Å; M393-F497 HydrophobicContact CE-CB 4.34Å; M393-F497 HydrophobicContact CE-CD2 3.77Å; M393-F497 HydrophobicContact SD-CB 3.93Å; M393-F497 HydrophobicContact SD-CD2 4.08Å; Y493-F497 PolarHBondContact O-N 3.12Å; V494-F497 PolarHBondContact O-N 3.06Å; A495-F497 PolarHBondContact O-N 2.75Å; F497-I499 VanDerWaalsContact C-N 3.31Å; F497-I499 PolarHBondContact O-N 3.3Å; F497-S500 CarbonylContact O-C 3.59Å; F497-S500 PolarHBondContact O-N 3.49Å; F497-L501 HydrophobicContact CD2-CB 3.83Å; F497-L501 HydrophobicContact CD2-CD1 3.92Å; F497-L501 HydrophobicContact CE2-CB 3.64Å; F497-L501 HydrophobicContact CE2-CD1 4.09Å; F497-L501 HydrophobicContact CG-CB 4.5Å; F497-L501 HydrophobicContact CZ-CB 4.16Å; F497-L501 PolarHBondContact O-N 3.11Å; F497-G502 PolarHBondContact O-N 2.83Å; F497-G502 VanDerWaalsContact O-N 3.09Å |
| 498 | S | 91.8 | Very high | 91 | Very high | 2 Ų | 2 | 23.9 Ų | 23.9 | 1% | 0.014 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -66.2 | -33.2 | -176.8 | -53.8 | 0 | 0 | 0 | 0 | 113 | K366 V494 A495 A496 P503 | K366-S498 WeakPolarHBondContact CA-OG 3.45Å; K366-S498 VanDerWaalsContact CG-OG 3.32Å; K366-S498 WeakPolarHBondContact CG-OG 3.43Å; V494-S498 WeakPolarHBondContact O-CB 3.14Å; V494-S498 PolarHBondContact O-N 3.26Å; V494-S498 PolarHBondContact O-OG 2.99Å; A495-S498 PolarHBondContact O-N 3.16Å; A496-S498 VanDerWaalsContact C-N 3.34Å; A496-S498 PolarHBondContact O-N 3.12Å; S498-P503 VanDerWaalsContact O-CD 3.3Å; S498-P503 WeakPolarHBondContact O-CD 3.47Å |
| 499 | I | 91.3 | Very high | 90.6 | Very high | 59 Ų | 59 | 19.3 Ų | 19.3 | 30% | 0.303 | 11% | 0.108 | S | C | . | . | H | α-helix | trans | -79.3 | -26.2 | 177.3 | -66.9 | 162.8 | 0 | 0 | 0 | 111.7 | G369 A373 F385 A495 A496 F497 | G369-I499 WeakPolarHBondContact O-CG1 3.43Å; A373-I499 WeakPolarHBondContact CB-O 3.29Å; F385-I499 HydrophobicContact CD1-CG2 3.72Å; F385-I499 HydrophobicContact CE1-CG2 3.77Å; A495-I499 WeakPolarHBondContact O-CG1 3.49Å; A495-I499 PolarHBondContact O-N 3.35Å; A496-I499 PolarHBondContact O-N 3.04Å; F497-I499 VanDerWaalsContact C-N 3.31Å; F497-I499 PolarHBondContact O-N 3.3Å |
| 500 | S | 91.9 | Very high | 89.9 | Confident | 1 Ų | 1 | 20.9 Ų | 20.9 | 1% | 0.007 | 12% | 0.119 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -113.7 | -97.2 | -171.7 | 65.6 | 0 | 0 | 0 | 0 | 112.9 | F385 G389 A496 F497 G502 P503 M504 | F385-S500 WeakPolarHBondContact O-CB 3.12Å; G389-S500 VanDerWaalsContact CA-CB 3.49Å; G389-S500 VanDerWaalsContact CA-OG 3.29Å; G389-S500 WeakPolarHBondContact CA-OG 3.42Å; A496-S500 WeakPolarHBondContact O-CB 3.33Å; A496-S500 PolarHBondContact O-N 2.61Å; A496-S500 VanDerWaalsContact O-N 3.1Å; A496-S500 PolarHBondContact O-OG 3.25Å; F497-S500 CarbonylContact O-C 3.59Å; F497-S500 PolarHBondContact O-N 3.49Å; S500-G502 VanDerWaalsContact C-N 3.25Å; S500-G502 PolarHBondContact O-N 3.35Å; S500-G502 VanDerWaalsContact O-N 3.14Å; S500-P503 WeakPolarHBondContact O-CD 3.34Å; S500-M504 WeakPolarHBondContact O-CB 3.45Å; S500-M504 WeakPolarHBondContact O-CG 3.42Å; S500-M504 PolarHBondContact O-N 3.13Å |
| 501 | L | 87.6 | Confident | 89.5 | Confident | 0 Ų | 0 | 23.8 Ų | 23.8 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -56.1 | -36.4 | -167.5 | -74.6 | 161 | 0 | 0 | 0 | 113.4 | Q328 T331 L386 M393 F497 V505 L563 | Q328-L501 HydrophobicContact CB-CD2 4.23Å; Q328-L501 HydrophobicContact CG-CB 4.24Å; Q328-L501 HydrophobicContact CG-CD2 4.4Å; T331-L501 HydrophobicContact CG2-CD1 4.21Å; L386-L501 HydrophobicContact CD2-CD2 3.8Å; L386-L501 HydrophobicContact CD2-CG 4.37Å; M393-L501 HydrophobicContact CE-CD1 3.58Å; M393-L501 HydrophobicContact SD-CD1 3.46Å; M393-L501 WeakPolarHBondContact SD-CD1 3.41Å; M393-L501 HydrophobicContact SD-CG 4.5Å; F497-L501 HydrophobicContact CD2-CB 3.83Å; F497-L501 HydrophobicContact CD2-CD1 3.92Å; F497-L501 HydrophobicContact CE2-CB 3.64Å; F497-L501 HydrophobicContact CE2-CD1 4.09Å; F497-L501 HydrophobicContact CG-CB 4.5Å; F497-L501 HydrophobicContact CZ-CB 4.16Å; F497-L501 PolarHBondContact O-N 3.11Å; L501-V505 HydrophobicContact CD2-CG2 3.84Å; L501-V505 WeakPolarHBondContact O-CB 3.39Å; L501-V505 VanDerWaalsContact O-CG2 3.27Å; L501-V505 WeakPolarHBondContact O-CG2 3.43Å; L501-V505 PolarHBondContact O-N 2.95Å; L501-L563 HydrophobicContact CD1-CD2 3.52Å; L501-L563 HydrophobicContact CD2-CD1 4.16Å; L501-L563 HydrophobicContact CD2-CD2 3.53Å; L501-L563 HydrophobicContact CD2-CG 4.42Å; L501-L563 HydrophobicContact CG-CD2 4Å |
| 502 | G | 83.6 | Confident | 89 | Confident | 10 Ų | 10 | 22 Ų | 22 | 10% | 0.103 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -51.7 | -71.3 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | F497 S500 Y506 | F497-G502 PolarHBondContact O-N 2.83Å; F497-G502 VanDerWaalsContact O-N 3.09Å; S500-G502 VanDerWaalsContact C-N 3.25Å; S500-G502 PolarHBondContact O-N 3.35Å; S500-G502 VanDerWaalsContact O-N 3.14Å; G502-Y506 VanDerWaalsContact O-CD2 3.3Å; G502-Y506 WeakPolarHBondContact O-CD2 3.42Å |
| 503 | P | 83.8 | Confident | 88.4 | Confident | 15 Ų | 15 | 18.7 Ų | 18.7 | 10% | 0.097 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -78.1 | -34.9 | -179.9 | 27.3 | -33 | 0 | 0 | 0 | 113.6 | A373 S498 S500 V505 Y506 V507 | A373-P503 HydrophobicContact CB-CG 3.96Å; S498-P503 VanDerWaalsContact O-CD 3.3Å; S498-P503 WeakPolarHBondContact O-CD 3.47Å; S500-P503 WeakPolarHBondContact O-CD 3.34Å; P503-V505 PolarHBondContact O-N 3.49Å; P503-Y506 PolarHBondContact O-N 3.32Å; P503-V507 WeakPolarHBondContact O-CG2 3.23Å; P503-V507 PolarHBondContact O-N 2.97Å |
| 504 | M | 87.9 | Confident | 87.6 | Confident | 1 Ų | 1 | 20 Ų | 20 | 1% | 0.005 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -70.7 | -33.7 | -167.6 | -63.7 | -57.1 | 108.2 | 0 | 0 | 113.2 | A373 V377 T382 F385 L386 S500 Y506 V507 V508 | A373-M504 HydrophobicContact CB-CE 4.41Å; V377-M504 HydrophobicContact CB-CE 3.81Å; V377-M504 HydrophobicContact CB-SD 4.18Å; V377-M504 HydrophobicContact CG2-CE 3.63Å; V377-M504 HydrophobicContact CG2-SD 3.45Å; V377-M504 WeakPolarHBondContact CG2-SD 3.25Å; T382-M504 HydrophobicContact CG2-CB 3.69Å; T382-M504 HydrophobicContact CG2-CG 4.18Å; T382-M504 WeakPolarHBondContact CG2-O 3.43Å; T382-M504 HydrophobicContact CG2-SD 3.79Å; F385-M504 HydrophobicContact CB-CG 3.6Å; F385-M504 HydrophobicContact CB-SD 3.82Å; F385-M504 HydrophobicContact CD2-SD 3.95Å; F385-M504 HydrophobicContact CG-CG 4.38Å; F385-M504 HydrophobicContact CG-SD 4.09Å; L386-M504 HydrophobicContact CD1-CB 4.48Å; L386-M504 HydrophobicContact CD2-CB 3.66Å; L386-M504 HydrophobicContact CG-CB 3.82Å; S500-M504 WeakPolarHBondContact O-CB 3.45Å; S500-M504 WeakPolarHBondContact O-CG 3.42Å; S500-M504 PolarHBondContact O-N 3.13Å; M504-Y506 PolarHBondContact O-N 3.15Å; M504-V507 PolarHBondContact O-N 3.2Å; M504-V508 WeakPolarHBondContact O-CG2 3.36Å; M504-V508 PolarHBondContact O-N 3.04Å |
| 505 | V | 89.9 | Confident | 86.5 | Confident | 0 Ų | 0 | 24.4 Ų | 24.4 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -62.7 | -44.7 | -179.7 | 171.4 | 0 | 0 | 0 | 0 | 110.7 | L324 V325 Q328 L386 L501 P503 V507 V508 L509 | L324-V505 HydrophobicContact CD1-CG2 4.15Å; L324-V505 HydrophobicContact CD2-CB 4.32Å; L324-V505 HydrophobicContact CD2-CG1 3.9Å; L324-V505 HydrophobicContact CD2-CG2 4.1Å; L324-V505 HydrophobicContact CG-CB 4.44Å; L324-V505 HydrophobicContact CG-CG1 3.9Å; L324-V505 HydrophobicContact CG-CG2 3.9Å; V325-V505 HydrophobicContact CG1-CG1 3.81Å; Q328-V505 VanDerWaalsContact OE1-CB 3.24Å; Q328-V505 VanDerWaalsContact OE1-CG1 3.24Å; Q328-V505 VanDerWaalsContact OE1-CG2 3.27Å; L386-V505 HydrophobicContact CD2-CG2 4.08Å; L501-V505 HydrophobicContact CD2-CG2 3.84Å; L501-V505 WeakPolarHBondContact O-CB 3.39Å; L501-V505 VanDerWaalsContact O-CG2 3.27Å; L501-V505 WeakPolarHBondContact O-CG2 3.43Å; L501-V505 PolarHBondContact O-N 2.95Å; P503-V505 PolarHBondContact O-N 3.49Å; V505-V507 VanDerWaalsContact C-N 3.33Å; V505-V507 PolarHBondContact O-N 3.32Å; V505-V508 PolarHBondContact O-N 3.27Å; V505-L509 HydrophobicContact CG1-CD1 4.16Å; V505-L509 HydrophobicContact CG1-CG 4.4Å; V505-L509 VanDerWaalsContact O-CG 3.29Å; V505-L509 WeakPolarHBondContact O-CG 3.38Å; V505-L509 PolarHBondContact O-N 3.39Å |
| 506 | Y | 84.9 | Confident | 85.3 | Confident | 101 Ų | 101 | 23.9 Ų | 23.9 | 40% | 0.396 | 13% | 0.131 | S | C | . | . | H | α-helix | trans | -67 | -33.1 | 177.7 | -64.2 | -74.9 | 0 | 0 | 0 | 113 | G502 P503 M504 L509 S510 | G502-Y506 VanDerWaalsContact O-CD2 3.3Å; G502-Y506 WeakPolarHBondContact O-CD2 3.42Å; P503-Y506 PolarHBondContact O-N 3.32Å; M504-Y506 PolarHBondContact O-N 3.15Å; Y506-L509 HydrophobicContact CD1-CD1 4.36Å; Y506-L509 PolarHBondContact O-N 3.03Å; Y506-S510 PolarHBondContact O-N 2.95Å |
| 507 | V | 83.8 | Confident | 84.5 | Confident | 38 Ų | 38 | 23.7 Ų | 23.7 | 23% | 0.23 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -61.7 | -51.3 | 171.7 | 174.3 | 0 | 0 | 0 | 0 | 110.2 | T382 P503 M504 V505 L509 S510 E511 | T382-V507 HydrophobicContact CG2-CB 4.14Å; T382-V507 HydrophobicContact CG2-CG1 4.07Å; P503-V507 WeakPolarHBondContact O-CG2 3.23Å; P503-V507 PolarHBondContact O-N 2.97Å; M504-V507 PolarHBondContact O-N 3.2Å; V505-V507 VanDerWaalsContact C-N 3.33Å; V505-V507 PolarHBondContact O-N 3.32Å; V507-L509 VanDerWaalsContact C-N 3.33Å; V507-L509 PolarHBondContact O-N 3.41Å; V507-S510 PolarHBondContact O-N 2.92Å; V507-S510 PolarHBondContact O-OG 3.27Å; V507-E511 HydrophobicContact CG1-CG 4.46Å; V507-E511 WeakPolarHBondContact O-CG 3.45Å; V507-E511 PolarHBondContact O-N 2.71Å; V507-E511 VanDerWaalsContact O-N 3.08Å |
| 508 | V | 87.2 | Confident | 83.8 | Confident | 1 Ų | 1 | 26.4 Ų | 26.4 | 1% | 0.006 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -55.8 | -47.7 | 176.4 | 175.8 | 0 | 0 | 0 | 0 | 111 | L324 T382 L386 M504 V505 S510 E511 I512 V571 | L324-V508 HydrophobicContact CD2-CB 4.09Å; L324-V508 HydrophobicContact CD2-CG1 4Å; L324-V508 HydrophobicContact CD2-CG2 4.48Å; T382-V508 HydrophobicContact CG2-CG2 3.43Å; T382-V508 VanDerWaalsContact CG2-CG2 3.43Å; L386-V508 HydrophobicContact CD1-CG2 3.94Å; M504-V508 WeakPolarHBondContact O-CG2 3.36Å; M504-V508 PolarHBondContact O-N 3.04Å; V505-V508 PolarHBondContact O-N 3.27Å; V508-S510 PolarHBondContact O-N 3.26Å; V508-E511 PolarHBondContact O-N 3.47Å; V508-I512 HydrophobicContact CG1-CG2 3.84Å; V508-I512 WeakPolarHBondContact O-CG1 3.26Å; V508-I512 WeakPolarHBondContact O-CG2 3.36Å; V508-I512 PolarHBondContact O-N 3.31Å; V508-V571 HydrophobicContact CG1-CG1 4.23Å; V508-V571 HydrophobicContact CG2-CG1 4.28Å |
| 509 | L | 85.7 | Confident | 83 | Confident | 3 Ų | 3 | 29.1 Ų | 29.1 | 2% | 0.016 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -58.5 | -37.8 | 179 | -67.5 | 176.4 | 0 | 0 | 0 | 112 | G321 V325 V505 Y506 V507 E511 I512 F513 V525 | G321-L509 VanDerWaalsContact CA-CD2 3.48Å; V325-L509 HydrophobicContact CG1-CD1 4Å; V505-L509 HydrophobicContact CG1-CD1 4.16Å; V505-L509 HydrophobicContact CG1-CG 4.4Å; V505-L509 VanDerWaalsContact O-CG 3.29Å; V505-L509 WeakPolarHBondContact O-CG 3.38Å; V505-L509 PolarHBondContact O-N 3.39Å; Y506-L509 HydrophobicContact CD1-CD1 4.36Å; Y506-L509 PolarHBondContact O-N 3.03Å; V507-L509 VanDerWaalsContact C-N 3.33Å; V507-L509 PolarHBondContact O-N 3.41Å; L509-E511 VanDerWaalsContact C-N 3.34Å; L509-I512 HydrophobicContact CD2-CD1 4.14Å; L509-F513 HydrophobicContact CD2-CE2 4.22Å; L509-F513 WeakPolarHBondContact O-CD2 3.4Å; L509-V525 HydrophobicContact CD1-CG1 3.59Å; L509-V525 HydrophobicContact CD2-CG1 3.79Å; L509-V525 HydrophobicContact CD2-CG2 4.33Å; L509-V525 HydrophobicContact CG-CG1 4.36Å |
| 510 | S | 80.4 | Confident | 82.5 | Confident | 46 Ų | 46 | 30.1 Ų | 30.1 | 32% | 0.322 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -72 | -26.2 | 177.8 | 78.7 | 0 | 0 | 0 | 0 | 113.7 | Y506 V507 V508 R518 | Y506-S510 PolarHBondContact O-N 2.95Å; V507-S510 PolarHBondContact O-N 2.92Å; V507-S510 PolarHBondContact O-OG 3.27Å; V508-S510 PolarHBondContact O-N 3.26Å; S510-R518 PolarHBondContact O-NE 3.23Å; S510-R518 VanDerWaalsContact O-NE 3.11Å; S510-R518 PolarHBondContact O-NH1 3.07Å; S510-R518 PolarHBondContact O-NH2 2.68Å |
| 511 | E | 84.2 | Confident | 82.2 | Confident | 62 Ų | 62 | 30 Ų | 30 | 29% | 0.29 | 17% | 0.166 | S | C | . | . | H | α-helix | trans | -91.9 | -28.7 | -176.3 | -68.8 | 174.4 | 144.7 | 0 | 0 | 113.1 | V507 V508 L509 T574 L579 | V507-E511 HydrophobicContact CG1-CG 4.46Å; V507-E511 WeakPolarHBondContact O-CG 3.45Å; V507-E511 PolarHBondContact O-N 2.71Å; V507-E511 VanDerWaalsContact O-N 3.08Å; V508-E511 PolarHBondContact O-N 3.47Å; L509-E511 VanDerWaalsContact C-N 3.34Å; E511-T574 HydrophobicContact CB-CG2 3.89Å; E511-T574 WeakPolarHBondContact OE2-CB 3.35Å; E511-T574 WeakPolarHBondContact OE2-CG2 3.32Å; E511-T574 PolarHBondContact OE2-OG1 3.18Å; E511-L579 WeakPolarHBondContact O-CD1 3.37Å |
| 512 | I | 84.4 | Confident | 82 | Confident | 1 Ų | 1 | 32.3 Ų | 32.3 | 1% | 0.005 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -79.1 | -22.7 | -178.5 | 65.5 | 179.2 | 0 | 0 | 0 | 113.7 | R317 V508 L509 P572 | R317-I512 WeakPolarHBondContact CD-O 3.48Å; R317-I512 VanDerWaalsContact CZ-O 3.32Å; R317-I512 PolarHBondContact NE-O 3.29Å; V508-I512 HydrophobicContact CG1-CG2 3.84Å; V508-I512 WeakPolarHBondContact O-CG1 3.26Å; V508-I512 WeakPolarHBondContact O-CG2 3.36Å; V508-I512 PolarHBondContact O-N 3.31Å; L509-I512 HydrophobicContact CD2-CD1 4.14Å; I512-P572 HydrophobicContact CG2-CG 4.32Å |
| 513 | F | 83.6 | Confident | 82.1 | Confident | 0 Ų | 0 | 34.2 Ų | 34.2 | 0% | 0 | 19% | 0.191 | C | C | . | . | S | Bend | trans | -101.9 | 135.2 | -175.9 | -65.7 | -61.7 | 0 | 0 | 0 | 113.3 | L307 R317 L318 L509 R518 A521 V525 | L307-F513 HydrophobicContact CD1-CE1 4.44Å; R317-F513 HydrophobicContact CB-CD1 4.09Å; R317-F513 HydrophobicContact CB-CE1 3.68Å; R317-F513 HydrophobicContact CB-CZ 4.48Å; L318-F513 HydrophobicContact CB-CE1 4.5Å; L318-F513 HydrophobicContact CD1-CZ 4.34Å; L509-F513 HydrophobicContact CD2-CE2 4.22Å; L509-F513 WeakPolarHBondContact O-CD2 3.4Å; F513-R518 HydrophobicContact CB-CB 4.05Å; F513-R518 HydrophobicContact CB-CG 4.12Å; F513-R518 PolarHBondContact O-NE 2.88Å; F513-R518 VanDerWaalsContact O-NE 3.13Å; F513-R518 PolarHBondContact O-NH2 2.95Å; F513-A521 HydrophobicContact CB-CB 4.37Å; F513-A521 HydrophobicContact CD1-CB 3.54Å; F513-A521 HydrophobicContact CD2-CB 3.62Å; F513-A521 HydrophobicContact CE1-CB 3.61Å; F513-A521 HydrophobicContact CE2-CB 3.71Å; F513-A521 HydrophobicContact CG-CB 3.58Å; F513-A521 HydrophobicContact CZ-CB 3.72Å; F513-V525 HydrophobicContact CE2-CG2 4.4Å; F513-V525 HydrophobicContact CZ-CG2 4.41Å |
| 514 | P | 79.9 | Confident | 82.3 | Confident | 30 Ų | 30 | 34.7 Ų | 34.7 | 20% | 0.195 | 19% | 0.194 | C | C | . | . | trans | -61 | 147.5 | 171.1 | -4.1 | 11.5 | 0 | 0 | 0 | 112 | L314 G516 V517 R518 L579 | L314-P514 HydrophobicContact CD2-CG 3.81Å; P514-G516 VanDerWaalsContact C-N 3.32Å; P514-G516 PolarHBondContact O-N 3.33Å; P514-V517 HydrophobicContact CB-CG2 4.14Å; P514-V517 HydrophobicContact CG-CG2 3.68Å; P514-V517 PolarHBondContact O-N 2.76Å; P514-R518 VanDerWaalsContact O-CB 3.27Å; P514-R518 WeakPolarHBondContact O-CB 3.35Å; P514-R518 PolarHBondContact O-N 3.11Å; P514-L579 HydrophobicContact CB-CD2 3.65Å; P514-L579 HydrophobicContact CG-CD2 4.08Å | ||
| 515 | M | 69.9 | Low | 82.5 | Confident | 97 Ų | 97 | 34.7 Ų | 34.7 | 48% | 0.478 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -51.7 | -46.3 | -177.6 | -71.5 | -63.4 | -62.1 | 0 | 0 | 113.1 | V517 R518 | M515-V517 VanDerWaalsContact C-N 3.29Å; M515-V517 PolarHBondContact O-N 2.7Å; M515-R518 PolarHBondContact O-N 2.9Å; M515-R518 PolarHBondContact SD-NH1 3.35Å; M515-R518 PolarHBondContact SD-NH2 3.43Å; M515-R518 VanDerWaalsContact SD-NH2 3.4Å |
| 516 | G | 71 | Confident | 82.4 | Confident | 16 Ų | 16 | 36 Ų | 36 | 17% | 0.165 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -63.3 | -25.5 | -176.7 | 0 | 0 | 0 | 0 | 0 | 115.8 | P514 | P514-G516 VanDerWaalsContact C-N 3.32Å; P514-G516 PolarHBondContact O-N 3.33Å |
| 517 | V | 77.5 | Confident | 82.7 | Confident | 4 Ų | 4 | 32 Ų | 32 | 2% | 0.024 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -115.5 | -7.1 | -179.1 | -62 | 0 | 0 | 0 | 0 | 113.6 | H302 L314 P514 M515 G519 R520 A521 | H302-V517 HydrophobicContact CB-CG1 3.82Å; L314-V517 HydrophobicContact CD2-CG2 3.96Å; P514-V517 HydrophobicContact CB-CG2 4.14Å; P514-V517 HydrophobicContact CG-CG2 3.68Å; P514-V517 PolarHBondContact O-N 2.76Å; M515-V517 VanDerWaalsContact C-N 3.29Å; M515-V517 PolarHBondContact O-N 2.7Å; V517-G519 PolarHBondContact O-N 3.22Å; V517-R520 PolarHBondContact O-N 3.26Å; V517-A521 PolarHBondContact O-N 3.49Å |
| 518 | R | 79.9 | Confident | 83.2 | Confident | 68 Ų | 68 | 32 Ų | 32 | 26% | 0.257 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -56.6 | -45.5 | -173.5 | -177.4 | 180 | -59 | 176.1 | 2 | 112.7 | S510 F513 P514 M515 R520 A521 V522 | S510-R518 PolarHBondContact O-NE 3.23Å; S510-R518 VanDerWaalsContact O-NE 3.11Å; S510-R518 PolarHBondContact O-NH1 3.07Å; S510-R518 PolarHBondContact O-NH2 2.68Å; F513-R518 HydrophobicContact CB-CB 4.05Å; F513-R518 HydrophobicContact CB-CG 4.12Å; F513-R518 PolarHBondContact O-NE 2.88Å; F513-R518 VanDerWaalsContact O-NE 3.13Å; F513-R518 PolarHBondContact O-NH2 2.95Å; P514-R518 VanDerWaalsContact O-CB 3.27Å; P514-R518 WeakPolarHBondContact O-CB 3.35Å; P514-R518 PolarHBondContact O-N 3.11Å; M515-R518 PolarHBondContact O-N 2.9Å; M515-R518 PolarHBondContact SD-NH1 3.35Å; M515-R518 PolarHBondContact SD-NH2 3.43Å; M515-R518 VanDerWaalsContact SD-NH2 3.4Å; R518-R520 VanDerWaalsContact C-N 3.3Å; R518-R520 PolarHBondContact O-N 3.42Å; R518-A521 PolarHBondContact O-N 3.24Å; R518-V522 HydrophobicContact CG-CG2 4.04Å; R518-V522 WeakPolarHBondContact O-CB 3.25Å; R518-V522 VanDerWaalsContact O-CG2 3.27Å; R518-V522 WeakPolarHBondContact O-CG2 3.3Å; R518-V522 PolarHBondContact O-N 3.49Å |
| 519 | G | 74.6 | Confident | 83.5 | Confident | 58 Ų | 58 | 32.3 Ų | 32.3 | 60% | 0.598 | 19% | 0.193 | S | C | * | . | H | α-helix | trans | -57.8 | -43.6 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | V517 S523 | V517-G519 PolarHBondContact O-N 3.22Å; G519-S523 PolarHBondContact O-N 3.21Å; G519-S523 VanDerWaalsContact O-N 3.16Å |
| 520 | R | 81.3 | Confident | 83.8 | Confident | 80 Ų | 80 | 33.7 Ų | 33.7 | 30% | 0.302 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -70.6 | -42.1 | 178.2 | -64.3 | 176.8 | -177.2 | 157.6 | 2.2 | 112 | H302 S303 F304 V517 R518 S523 V524 | H302-R520 VanDerWaalsContact O-CZ 3.3Å; H302-R520 PolarHBondContact O-NH1 2.77Å; H302-R520 PolarHBondContact O-NH2 3.38Å; S303-R520 VanDerWaalsContact CA-NH1 3.3Å; S303-R520 PolarHBondContact O-NH1 3.36Å; F304-R520 HydrophobicContact CD2-CB 4.06Å; F304-R520 HydrophobicContact CD2-CG 4.18Å; F304-R520 HydrophobicContact CE2-CB 4.43Å; F304-R520 VanDerWaalsContact N-NH1 3.12Å; V517-R520 PolarHBondContact O-N 3.26Å; R518-R520 VanDerWaalsContact C-N 3.3Å; R518-R520 PolarHBondContact O-N 3.42Å; R520-S523 WeakPolarHBondContact O-CB 3.14Å; R520-S523 PolarHBondContact O-N 3.03Å; R520-V524 PolarHBondContact O-N 3.41Å; R520-V524 VanDerWaalsContact O-N 3.15Å |
| 521 | A | 85.2 | Confident | 84.5 | Confident | 0 Ų | 0 | 33.3 Ų | 33.3 | 0% | 0 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -61 | -47.8 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | L307 F513 V517 R518 S523 V524 V525 | L307-A521 HydrophobicContact CD1-CB 3.58Å; L307-A521 HydrophobicContact CD2-CB 4.26Å; F513-A521 HydrophobicContact CB-CB 4.37Å; F513-A521 HydrophobicContact CD1-CB 3.54Å; F513-A521 HydrophobicContact CD2-CB 3.62Å; F513-A521 HydrophobicContact CE1-CB 3.61Å; F513-A521 HydrophobicContact CE2-CB 3.71Å; F513-A521 HydrophobicContact CG-CB 3.58Å; F513-A521 HydrophobicContact CZ-CB 3.72Å; V517-A521 PolarHBondContact O-N 3.49Å; R518-A521 PolarHBondContact O-N 3.24Å; A521-S523 VanDerWaalsContact C-N 3.28Å; A521-S523 PolarHBondContact O-N 2.89Å; A521-V524 PolarHBondContact O-N 3.44Å; A521-V525 WeakPolarHBondContact O-CG2 3.45Å; A521-V525 PolarHBondContact O-N 3.32Å |
| 522 | V | 83.8 | Confident | 85 | Confident | 47 Ų | 47 | 30.9 Ų | 30.9 | 29% | 0.285 | 19% | 0.187 | S | C | . | . | H | α-helix | trans | -62.6 | -35.6 | 178 | 171.6 | 0 | 0 | 0 | 0 | 111.2 | R518 S526 | R518-V522 HydrophobicContact CG-CG2 4.04Å; R518-V522 WeakPolarHBondContact O-CB 3.25Å; R518-V522 VanDerWaalsContact O-CG2 3.27Å; R518-V522 WeakPolarHBondContact O-CG2 3.3Å; R518-V522 PolarHBondContact O-N 3.49Å; V522-S526 VanDerWaalsContact O-CB 3.24Å; V522-S526 WeakPolarHBondContact O-CB 3.49Å; V522-S526 PolarHBondContact O-N 2.98Å; V522-S526 PolarHBondContact O-OG 3.4Å |
| 523 | S | 84.5 | Confident | 85.5 | Confident | 50 Ų | 50 | 31.4 Ų | 31.4 | 35% | 0.35 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -62.4 | -49.1 | 174.7 | -178.8 | 0 | 0 | 0 | 0 | 112.4 | G519 R520 A521 V525 S526 A527 | G519-S523 PolarHBondContact O-N 3.21Å; G519-S523 VanDerWaalsContact O-N 3.16Å; R520-S523 WeakPolarHBondContact O-CB 3.14Å; R520-S523 PolarHBondContact O-N 3.03Å; A521-S523 VanDerWaalsContact C-N 3.28Å; A521-S523 PolarHBondContact O-N 2.89Å; S523-V525 PolarHBondContact O-N 3.36Å; S523-S526 PolarHBondContact O-N 3.12Å; S523-A527 PolarHBondContact O-N 3.49Å |
| 524 | V | 88.9 | Confident | 86.1 | Confident | 26 Ų | 26 | 32.4 Ų | 32.4 | 16% | 0.158 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -60.7 | -46.6 | 177.4 | 175.5 | 0 | 0 | 0 | 0 | 111 | F304 L307 L318 M322 R520 A521 S526 A527 V528 | F304-V524 HydrophobicContact CE2-CG2 3.88Å; F304-V524 HydrophobicContact CZ-CG2 3.75Å; L307-V524 HydrophobicContact CD2-CB 4.47Å; L307-V524 HydrophobicContact CD2-CG2 4.04Å; L318-V524 HydrophobicContact CD1-CB 4.31Å; L318-V524 HydrophobicContact CD1-CG1 4.12Å; M322-V524 HydrophobicContact SD-CG1 4.23Å; R520-V524 PolarHBondContact O-N 3.41Å; R520-V524 VanDerWaalsContact O-N 3.15Å; A521-V524 PolarHBondContact O-N 3.44Å; V524-S526 VanDerWaalsContact C-N 3.31Å; V524-S526 PolarHBondContact O-N 2.82Å; V524-A527 PolarHBondContact O-N 2.75Å; V524-V528 PolarHBondContact O-N 3.39Å; V524-V528 VanDerWaalsContact O-N 3.12Å |
| 525 | V | 91.3 | Very high | 86.8 | Confident | 0 Ų | 0 | 36.1 Ų | 36.1 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -62.7 | -39.1 | 177.6 | 174.2 | 0 | 0 | 0 | 0 | 111.4 | L318 M322 V325 L509 F513 A521 S523 V528 N529 | L318-V525 HydrophobicContact CD1-CG2 4.02Å; M322-V525 HydrophobicContact CG-CG2 4.14Å; V325-V525 HydrophobicContact CB-CG1 4.29Å; V325-V525 HydrophobicContact CG1-CG1 3.49Å; V325-V525 VanDerWaalsContact CG1-CG1 3.49Å; V325-V525 HydrophobicContact CG2-CG1 3.77Å; L509-V525 HydrophobicContact CD1-CG1 3.59Å; L509-V525 HydrophobicContact CD2-CG1 3.79Å; L509-V525 HydrophobicContact CD2-CG2 4.33Å; L509-V525 HydrophobicContact CG-CG1 4.36Å; F513-V525 HydrophobicContact CE2-CG2 4.4Å; F513-V525 HydrophobicContact CZ-CG2 4.41Å; A521-V525 WeakPolarHBondContact O-CG2 3.45Å; A521-V525 PolarHBondContact O-N 3.32Å; S523-V525 PolarHBondContact O-N 3.36Å; V525-V528 PolarHBondContact O-N 2.91Å; V525-N529 PolarHBondContact O-N 3.34Å |
| 526 | S | 88.4 | Confident | 88 | Confident | 28 Ų | 28 | 32.5 Ų | 32.5 | 20% | 0.196 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -66.2 | -38.3 | 177.2 | -60.3 | 0 | 0 | 0 | 0 | 112.1 | V522 S523 V524 V528 N529 W530 | V522-S526 VanDerWaalsContact O-CB 3.24Å; V522-S526 WeakPolarHBondContact O-CB 3.49Å; V522-S526 PolarHBondContact O-N 2.98Å; V522-S526 PolarHBondContact O-OG 3.4Å; S523-S526 PolarHBondContact O-N 3.12Å; V524-S526 VanDerWaalsContact C-N 3.31Å; V524-S526 PolarHBondContact O-N 2.82Å; S526-V528 VanDerWaalsContact C-N 3.34Å; S526-V528 PolarHBondContact O-N 3.34Å; S526-N529 WeakPolarHBondContact O-CB 3.4Å; S526-N529 PolarHBondContact O-N 3.17Å; S526-W530 PolarHBondContact O-N 2.95Å |
| 527 | A | 91.1 | Very high | 89 | Confident | 16 Ų | 16 | 31.7 Ų | 31.7 | 13% | 0.132 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -61.6 | -43.4 | 174 | 0 | 0 | 0 | 0 | 0 | 111.4 | L128 L132 S523 V524 N529 W530 A531 | L128-A527 WeakPolarHBondContact CD1-O 3.31Å; L132-A527 HydrophobicContact CD2-CB 3.95Å; S523-A527 PolarHBondContact O-N 3.49Å; V524-A527 PolarHBondContact O-N 2.75Å; A527-N529 VanDerWaalsContact C-N 3.32Å; A527-N529 PolarHBondContact O-N 2.95Å; A527-W530 PolarHBondContact O-N 2.75Å; A527-A531 VanDerWaalsContact O-CB 3.27Å; A527-A531 WeakPolarHBondContact O-CB 3.44Å; A527-A531 PolarHBondContact O-N 2.94Å |
| 528 | V | 93.8 | Very high | 89.7 | Confident | 40 Ų | 40 | 34.9 Ų | 34.9 | 24% | 0.242 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -62.1 | -40.7 | 173.9 | 175.4 | 0 | 0 | 0 | 0 | 111.3 | M322 V325 V524 V525 S526 A531 T532 | M322-V528 HydrophobicContact CB-CG1 4.44Å; M322-V528 HydrophobicContact CG-CG2 4.07Å; M322-V528 HydrophobicContact SD-CG2 3.99Å; V325-V528 HydrophobicContact CG2-CB 4.36Å; V325-V528 HydrophobicContact CG2-CG1 4.08Å; V524-V528 PolarHBondContact O-N 3.39Å; V524-V528 VanDerWaalsContact O-N 3.12Å; V525-V528 PolarHBondContact O-N 2.91Å; S526-V528 VanDerWaalsContact C-N 3.34Å; S526-V528 PolarHBondContact O-N 3.34Å; V528-A531 PolarHBondContact O-N 3.18Å; V528-T532 VanDerWaalsContact O-CB 3.31Å; V528-T532 WeakPolarHBondContact O-CB 3.44Å; V528-T532 PolarHBondContact O-N 3.04Å; V528-T532 PolarHBondContact O-OG1 3.04Å |
| 529 | N | 93.1 | Very high | 90.3 | Very high | 6 Ų | 6 | 34 Ų | 34 | 3% | 0.032 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -58.5 | -52 | 176.5 | -179.5 | 65.8 | 0 | 0 | 0 | 111.7 | V325 Q329 V525 S526 A527 T532 N533 | V325-N529 HydrophobicContact CB-CB 4.03Å; V325-N529 HydrophobicContact CG1-CB 4.41Å; V325-N529 HydrophobicContact CG2-CB 4.19Å; Q329-N529 WeakPolarHBondContact CG-OD1 3.44Å; Q329-N529 PolarHBondContact OE1-OD1 2.88Å; V525-N529 PolarHBondContact O-N 3.34Å; S526-N529 WeakPolarHBondContact O-CB 3.4Å; S526-N529 PolarHBondContact O-N 3.17Å; A527-N529 VanDerWaalsContact C-N 3.32Å; A527-N529 PolarHBondContact O-N 2.95Å; N529-T532 PolarHBondContact O-N 3.37Å; N529-N533 VanDerWaalsContact O-CB 3.28Å; N529-N533 WeakPolarHBondContact O-CB 3.25Å; N529-N533 PolarHBondContact O-N 3.41Å |
| 530 | W | 93.2 | Very high | 91.1 | Very high | 32 Ų | 32 | 31.5 Ų | 31.5 | 12% | 0.121 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -67.8 | -37.6 | 179.6 | -68.2 | 114.5 | 0 | 0 | 0 | 113 | M95 L124 A127 L128 C131 S526 A527 N533 L534 | M95-W530 HydrophobicContact CE-CH2 4.38Å; L124-W530 HydrophobicContact CD2-CE3 4.04Å; L124-W530 HydrophobicContact CD2-CZ3 3.81Å; A127-W530 HydrophobicContact CB-CD2 3.81Å; A127-W530 HydrophobicContact CB-CE3 3.72Å; A127-W530 HydrophobicContact CB-CG 4.34Å; A127-W530 HydrophobicContact CB-CH2 4.35Å; A127-W530 HydrophobicContact CB-CZ2 4.41Å; A127-W530 HydrophobicContact CB-CZ3 4.01Å; L128-W530 HydrophobicContact CB-CB 4.16Å; L128-W530 HydrophobicContact CD1-CB 4.23Å; C131-W530 PolarHBondContact SG-NE1 2.76Å; S526-W530 PolarHBondContact O-N 2.95Å; A527-W530 PolarHBondContact O-N 2.75Å; W530-N533 PolarHBondContact O-N 3.43Å; W530-L534 VanDerWaalsContact O-CB 3.32Å; W530-L534 WeakPolarHBondContact O-CB 3.46Å; W530-L534 PolarHBondContact O-N 2.82Å |
| 531 | A | 95.4 | Very high | 91.5 | Very high | 39 Ų | 39 | 27.7 Ų | 27.7 | 32% | 0.322 | 16% | 0.163 | S | C | . | . | H | α-helix | trans | -64.2 | -43.5 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | L128 A527 V528 L534 L535 | L128-A531 HydrophobicContact CD1-CB 4.03Å; L128-A531 HydrophobicContact CD2-CB 4.16Å; A527-A531 VanDerWaalsContact O-CB 3.27Å; A527-A531 WeakPolarHBondContact O-CB 3.44Å; A527-A531 PolarHBondContact O-N 2.94Å; V528-A531 PolarHBondContact O-N 3.18Å; A531-L534 PolarHBondContact O-N 3.49Å; A531-L535 WeakPolarHBondContact O-CB 3.27Å; A531-L535 PolarHBondContact O-N 3.22Å |
| 532 | T | 95.3 | Very high | 91.6 | Very high | 10 Ų | 10 | 29.5 Ų | 29.5 | 6% | 0.061 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -66.6 | -42 | 177.1 | -52.1 | 0 | 0 | 0 | 0 | 110.7 | F326 Q329 V528 N529 L534 L535 I536 | F326-T532 HydrophobicContact CD2-CG2 3.42Å; F326-T532 VanDerWaalsContact CD2-CG2 3.42Å; F326-T532 HydrophobicContact CE2-CG2 3.82Å; F326-T532 HydrophobicContact CG-CG2 4.23Å; Q329-T532 HydrophobicContact CB-CG2 3.81Å; Q329-T532 HydrophobicContact CG-CG2 4.47Å; V528-T532 VanDerWaalsContact O-CB 3.31Å; V528-T532 WeakPolarHBondContact O-CB 3.44Å; V528-T532 PolarHBondContact O-N 3.04Å; V528-T532 PolarHBondContact O-OG1 3.04Å; N529-T532 PolarHBondContact O-N 3.37Å; T532-L534 VanDerWaalsContact C-N 3.35Å; T532-L534 PolarHBondContact O-N 2.92Å; T532-L535 PolarHBondContact O-N 3.32Å; T532-I536 HydrophobicContact CG2-CD1 3.66Å; T532-I536 HydrophobicContact CG2-CG1 4.36Å; T532-I536 WeakPolarHBondContact O-CB 3.39Å; T532-I536 WeakPolarHBondContact O-CG1 3.24Å; T532-I536 PolarHBondContact O-N 3.29Å |
| 533 | N | 94.7 | Very high | 91.9 | Very high | 13 Ų | 13 | 30.5 Ų | 30.5 | 7% | 0.07 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -58.5 | -47.3 | 175.4 | -167.6 | -1.2 | 0 | 0 | 0 | 111.6 | L124 Q329 P334 N529 W530 L535 I536 S537 | L124-N533 HydrophobicContact CD1-CB 4.28Å; L124-N533 WeakPolarHBondContact CD1-OD1 3.31Å; L124-N533 WeakPolarHBondContact CD2-ND2 3.2Å; Q329-N533 HydrophobicContact CG-CB 4.41Å; Q329-N533 VanDerWaalsContact NE2-CG 3.26Å; Q329-N533 PolarHBondContact NE2-ND2 2.9Å; P334-N533 WeakPolarHBondContact CB-OD1 3.36Å; P334-N533 WeakPolarHBondContact CG-OD1 3.42Å; N529-N533 VanDerWaalsContact O-CB 3.28Å; N529-N533 WeakPolarHBondContact O-CB 3.25Å; N529-N533 PolarHBondContact O-N 3.41Å; W530-N533 PolarHBondContact O-N 3.43Å; N533-L535 PolarHBondContact O-N 3.3Å; N533-I536 PolarHBondContact O-N 2.78Å; N533-S537 VanDerWaalsContact O-CB 3.31Å; N533-S537 WeakPolarHBondContact O-CB 3.5Å; N533-S537 PolarHBondContact O-N 3.48Å; N533-S537 PolarHBondContact O-OG 2.89Å; N533-S537 PolarHBondContact OD1-OG 3.39Å |
| 534 | L | 95.5 | Very high | 92 | Very high | 21 Ų | 21 | 28.2 Ų | 28.2 | 11% | 0.11 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -57.9 | -48.8 | 176.4 | 176.2 | 66.7 | 0 | 0 | 0 | 111.4 | S121 L124 L125 L128 W530 A531 T532 I536 S537 M538 | S121-L534 VanDerWaalsContact O-CD1 3.27Å; S121-L534 WeakPolarHBondContact O-CD1 3.41Å; L124-L534 HydrophobicContact CB-CB 4.15Å; L124-L534 HydrophobicContact CB-CD1 4.04Å; L125-L534 HydrophobicContact CB-CD1 4.09Å; L125-L534 HydrophobicContact CB-CD2 4.39Å; L125-L534 HydrophobicContact CD1-CD2 3.98Å; L128-L534 HydrophobicContact CD2-CD2 4.04Å; W530-L534 VanDerWaalsContact O-CB 3.32Å; W530-L534 WeakPolarHBondContact O-CB 3.46Å; W530-L534 PolarHBondContact O-N 2.82Å; A531-L534 PolarHBondContact O-N 3.49Å; T532-L534 VanDerWaalsContact C-N 3.35Å; T532-L534 PolarHBondContact O-N 2.92Å; L534-I536 PolarHBondContact O-N 3.24Å; L534-S537 PolarHBondContact O-N 2.81Å; L534-M538 HydrophobicContact CD1-CE 4.07Å; L534-M538 HydrophobicContact CD1-CG 4.17Å; L534-M538 HydrophobicContact CD1-SD 4.2Å; L534-M538 WeakPolarHBondContact O-CB 3.25Å; L534-M538 PolarHBondContact O-N 3.27Å |
| 535 | L | 94.8 | Very high | 91.8 | Very high | 107 Ų | 107 | 31.3 Ų | 31.3 | 56% | 0.56 | 17% | 0.174 | S | C | * | . | H | α-helix | trans | -60.4 | -47.4 | -179.6 | 178.6 | 63.9 | 0 | 0 | 0 | 112.1 | A531 T532 N533 S537 T539 | A531-L535 WeakPolarHBondContact O-CB 3.27Å; A531-L535 PolarHBondContact O-N 3.22Å; T532-L535 PolarHBondContact O-N 3.32Å; N533-L535 PolarHBondContact O-N 3.3Å; L535-S537 VanDerWaalsContact C-N 3.32Å; L535-S537 PolarHBondContact O-N 3.09Å; L535-T539 HydrophobicContact CD1-CG2 4.47Å; L535-T539 WeakPolarHBondContact O-CG2 3.29Å; L535-T539 PolarHBondContact O-N 3.26Å; L535-T539 PolarHBondContact O-OG1 3.06Å |
| 536 | I | 94 | Very high | 91.5 | Very high | 21 Ų | 21 | 39.5 Ų | 39.5 | 11% | 0.108 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -68.1 | -34.5 | -178.7 | -70.3 | 171.5 | 0 | 0 | 0 | 111.4 | Q329 A330 N335 T532 N533 L534 T539 F540 | Q329-I536 HydrophobicContact CB-CD1 3.87Å; Q329-I536 WeakPolarHBondContact O-CD1 3.34Å; A330-I536 HydrophobicContact CB-CD1 4.28Å; N335-I536 WeakPolarHBondContact ND2-CG2 3.39Å; N335-I536 PolarHBondContact ND2-O 3.12Å; T532-I536 HydrophobicContact CG2-CD1 3.66Å; T532-I536 HydrophobicContact CG2-CG1 4.36Å; T532-I536 WeakPolarHBondContact O-CB 3.39Å; T532-I536 WeakPolarHBondContact O-CG1 3.24Å; T532-I536 PolarHBondContact O-N 3.29Å; N533-I536 PolarHBondContact O-N 2.78Å; L534-I536 PolarHBondContact O-N 3.24Å; I536-T539 PolarHBondContact O-OG1 3.33Å; I536-F540 PolarHBondContact O-N 3.43Å |
| 537 | S | 93.1 | Very high | 91.4 | Very high | 0 Ų | 0 | 41.7 Ų | 41.7 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -74.2 | -39.6 | 177.9 | -56.9 | 0 | 0 | 0 | 0 | 112.5 | S121 L124 N335 N533 L534 L535 T539 | S121-S537 VanDerWaalsContact OG-C 3.22Å; S121-S537 WeakPolarHBondContact OG-CB 3.46Å; L124-S537 WeakPolarHBondContact CD1-OG 3.37Å; N335-S537 VanDerWaalsContact OD1-CA 3.25Å; N335-S537 WeakPolarHBondContact OD1-CA 3.36Å; N335-S537 PolarHBondContact OD1-OG 3.28Å; N533-S537 VanDerWaalsContact O-CB 3.31Å; N533-S537 WeakPolarHBondContact O-CB 3.5Å; N533-S537 PolarHBondContact O-N 3.48Å; N533-S537 PolarHBondContact O-OG 2.89Å; N533-S537 PolarHBondContact OD1-OG 3.39Å; L534-S537 PolarHBondContact O-N 2.81Å; L535-S537 VanDerWaalsContact C-N 3.32Å; L535-S537 PolarHBondContact O-N 3.09Å; S537-T539 PolarHBondContact O-N 3.48Å |
| 538 | M | 92.9 | Very high | 91.2 | Very high | 70 Ų | 70 | 41.4 Ų | 41.4 | 35% | 0.345 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -70.2 | -16.6 | 178.6 | -82.1 | -163.5 | 161 | 0 | 0 | 114 | L118 S121 L534 | L118-M538 HydrophobicContact CD1-CE 3.95Å; S121-M538 WeakPolarHBondContact OG-CA 3.48Å; S121-M538 VanDerWaalsContact OG-CG 3.25Å; S121-M538 WeakPolarHBondContact OG-CG 3.48Å; S121-M538 PolarHBondContact OG-N 3.33Å; S121-M538 VanDerWaalsContact OG-N 3.12Å; L534-M538 HydrophobicContact CD1-CE 4.07Å; L534-M538 HydrophobicContact CD1-CG 4.17Å; L534-M538 HydrophobicContact CD1-SD 4.2Å; L534-M538 WeakPolarHBondContact O-CB 3.25Å; L534-M538 PolarHBondContact O-N 3.27Å |
| 539 | T | 92.1 | Very high | 90.8 | Very high | 51 Ų | 51 | 39.6 Ų | 39.6 | 31% | 0.313 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -108.6 | -7.1 | -176.3 | 53.2 | 0 | 0 | 0 | 0 | 113.3 | L535 I536 S537 I543 | L535-T539 HydrophobicContact CD1-CG2 4.47Å; L535-T539 WeakPolarHBondContact O-CG2 3.29Å; L535-T539 PolarHBondContact O-N 3.26Å; L535-T539 PolarHBondContact O-OG1 3.06Å; I536-T539 PolarHBondContact O-OG1 3.33Å; S537-T539 PolarHBondContact O-N 3.48Å; T539-I543 WeakPolarHBondContact O-CB 3.29Å; T539-I543 WeakPolarHBondContact O-CD1 3.1Å; T539-I543 WeakPolarHBondContact O-CG1 3.47Å; T539-I543 PolarHBondContact O-N 2.83Å |
| 540 | F | 91.4 | Very high | 90.5 | Very high | 4 Ų | 4 | 40 Ų | 40 | 2% | 0.018 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -61 | -56 | -169.2 | 178.4 | -118.1 | 0 | 0 | 0 | 113.9 | E117 N335 Y339 L414 I536 T544 V552 Y556 | E117-F540 PolarHBondContact OE1-N 3.15Å; N335-F540 HydrophobicContact CB-CB 4.33Å; N335-F540 HydrophobicContact CB-CD1 4.12Å; N335-F540 HydrophobicContact CB-CD2 3.64Å; N335-F540 HydrophobicContact CB-CE1 4.37Å; N335-F540 HydrophobicContact CB-CE2 3.9Å; N335-F540 HydrophobicContact CB-CG 3.74Å; N335-F540 HydrophobicContact CB-CZ 4.26Å; N335-F540 VanDerWaalsContact ND2-CB 3.31Å; N335-F540 WeakPolarHBondContact ND2-CB 3.36Å; N335-F540 VanDerWaalsContact ND2-CD2 3.3Å; N335-F540 WeakPolarHBondContact ND2-CD2 3.38Å; N335-F540 WeakPolarHBondContact ND2-CG 3.49Å; Y339-F540 HydrophobicContact CD1-CD1 4.38Å; Y339-F540 HydrophobicContact CD1-CE1 4.42Å; Y339-F540 AromaticContact CD2-CD1 3.22Å; Y339-F540 HydrophobicContact CD2-CD1 3.22Å; Y339-F540 AromaticContact CD2-CE1 3.49Å; Y339-F540 HydrophobicContact CD2-CE1 3.49Å; Y339-F540 VanDerWaalsContact CD2-CE1 3.49Å; Y339-F540 HydrophobicContact CD2-CG 4.18Å; Y339-F540 HydrophobicContact CE2-CB 4.24Å; Y339-F540 AromaticContact CE2-CD1 3.43Å; Y339-F540 HydrophobicContact CE2-CD1 3.43Å; Y339-F540 VanDerWaalsContact CE2-CD1 3.43Å; Y339-F540 HydrophobicContact CE2-CE1 4.18Å; Y339-F540 HydrophobicContact CE2-CG 4.17Å; Y339-F540 AromaticContact CG-CD1 3.75Å; Y339-F540 HydrophobicContact CG-CD1 3.75Å; Y339-F540 AromaticContact CG-CE1 3.63Å; Y339-F540 HydrophobicContact CG-CE1 3.63Å; L414-F540 HydrophobicContact CD1-CE1 3.98Å; L414-F540 HydrophobicContact CD1-CZ 4.26Å; I536-F540 PolarHBondContact O-N 3.43Å; F540-T544 VanDerWaalsContact O-CB 3.3Å; F540-T544 WeakPolarHBondContact O-CB 3.49Å; F540-T544 PolarHBondContact O-N 3.26Å; F540-T544 PolarHBondContact O-OG1 3.17Å; F540-V552 HydrophobicContact CD2-CG1 4.3Å; F540-V552 HydrophobicContact CE2-CG1 3.88Å; F540-Y556 HydrophobicContact CD2-CE2 4.41Å; F540-Y556 WeakPolarHBondContact CD2-OH 3.04Å; F540-Y556 HydrophobicContact CE2-CE2 4.09Å |
| 541 | L | 88.3 | Confident | 90.4 | Very high | 1 Ų | 1 | 42.3 Ų | 42.3 | 1% | 0.005 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -71.9 | -39.2 | -174.6 | -62.2 | 176 | 0 | 0 | 0 | 110.4 | C113 Q116 E117 Y339 L414 I543 T544 E545 | C113-L541 WeakPolarHBondContact SG-CB 3.4Å; Q116-L541 HydrophobicContact CB-CD1 3.69Å; E117-L541 HydrophobicContact CG-CB 3.73Å; E117-L541 HydrophobicContact CG-CD1 3.87Å; E117-L541 HydrophobicContact CG-CG 3.94Å; E117-L541 WeakPolarHBondContact OE1-CA 3.43Å; E117-L541 PolarHBondContact OE1-N 3.13Å; Y339-L541 HydrophobicContact CD1-CD1 4.33Å; Y339-L541 HydrophobicContact CD1-CD2 3.94Å; Y339-L541 HydrophobicContact CD1-CG 4.33Å; Y339-L541 HydrophobicContact CE1-CD1 3.52Å; Y339-L541 HydrophobicContact CE1-CD2 3.88Å; Y339-L541 HydrophobicContact CE1-CG 3.75Å; Y339-L541 HydrophobicContact CG-CD2 4.49Å; L414-L541 HydrophobicContact CB-CD2 3.95Å; L414-L541 HydrophobicContact CD1-CD2 3.8Å; L541-I543 PolarHBondContact O-N 2.87Å; L541-T544 CarbonylContact O-C 3.56Å; L541-T544 PolarHBondContact O-N 2.97Å; L541-T544 VanDerWaalsContact O-N 3.15Å; L541-E545 WeakPolarHBondContact O-CG 3.34Å; L541-E545 PolarHBondContact O-N 3.18Å |
| 542 | T | 88.3 | Confident | 90.2 | Very high | 37 Ų | 37 | 40.6 Ų | 40.6 | 23% | 0.227 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -60.5 | -42.9 | 175.6 | -69.3 | 0 | 0 | 0 | 0 | 111.7 | E117 K546 | E117-T542 PolarHBondContact OE1-N 3.36Å; E117-T542 PolarHBondContact OE1-OG1 3.14Å; E117-T542 PolarHBondContact OE2-OG1 3.48Å; T542-K546 WeakPolarHBondContact O-CG 3.31Å; T542-K546 PolarHBondContact O-N 3.27Å |
| 543 | I | 89.3 | Confident | 90.1 | Very high | 68 Ų | 68 | 40.1 Ų | 40.1 | 35% | 0.349 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -67.3 | -44.7 | 174.3 | -69.5 | 169.9 | 0 | 0 | 0 | 109.3 | T539 L541 E545 K546 I547 V552 | T539-I543 WeakPolarHBondContact O-CB 3.29Å; T539-I543 WeakPolarHBondContact O-CD1 3.1Å; T539-I543 WeakPolarHBondContact O-CG1 3.47Å; T539-I543 PolarHBondContact O-N 2.83Å; L541-I543 PolarHBondContact O-N 2.87Å; I543-E545 VanDerWaalsContact C-N 3.29Å; I543-E545 PolarHBondContact O-N 3.33Å; I543-K546 PolarHBondContact O-N 3.39Å; I543-I547 HydrophobicContact CG2-CD1 3.59Å; I543-I547 HydrophobicContact CG2-CG1 3.8Å; I543-I547 WeakPolarHBondContact O-CG1 3.35Å; I543-I547 PolarHBondContact O-N 3.03Å; I543-V552 HydrophobicContact CG2-CG2 3.83Å |
| 544 | T | 87.3 | Confident | 90.1 | Very high | 2 Ų | 2 | 42.9 Ų | 42.9 | 1% | 0.012 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -60.9 | -35.8 | -179.4 | -57.4 | 0 | 0 | 0 | 0 | 112.8 | L414 F540 L541 G548 V549 | L414-T544 HydrophobicContact CD1-CG2 3.69Å; L414-T544 HydrophobicContact CG-CG2 4.21Å; F540-T544 VanDerWaalsContact O-CB 3.3Å; F540-T544 WeakPolarHBondContact O-CB 3.49Å; F540-T544 PolarHBondContact O-N 3.26Å; F540-T544 PolarHBondContact O-OG1 3.17Å; L541-T544 CarbonylContact O-C 3.56Å; L541-T544 PolarHBondContact O-N 2.97Å; L541-T544 VanDerWaalsContact O-N 3.15Å; T544-G548 CarbonylContact O-C 3.54Å; T544-G548 WeakPolarHBondContact O-CA 3.37Å; T544-G548 PolarHBondContact O-N 3.49Å; T544-V549 HydrophobicContact CG2-CB 4.24Å; T544-V549 HydrophobicContact CG2-CG2 3.42Å; T544-V549 VanDerWaalsContact CG2-CG2 3.42Å |
| 545 | E | 84.1 | Confident | 90.1 | Very high | 91 Ų | 91 | 46.1 Ų | 46.1 | 43% | 0.425 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -66.7 | -35 | 173.4 | -76.4 | -169.1 | 147.3 | 0 | 0 | 112.7 | C113 C415 L541 I543 | C113-E545 PolarHBondContact SG-OE1 2.96Å; C113-E545 VanDerWaalsContact SG-OE1 3.34Å; C415-E545 HydrophobicContact CB-CG 4.38Å; C415-E545 WeakPolarHBondContact CB-OE1 3.31Å; L541-E545 WeakPolarHBondContact O-CG 3.34Å; L541-E545 PolarHBondContact O-N 3.18Å; I543-E545 VanDerWaalsContact C-N 3.29Å; I543-E545 PolarHBondContact O-N 3.33Å |
| 546 | K | 85.9 | Confident | 90.2 | Very high | 173 Ų | 173 | 41.8 Ų | 41.8 | 75% | 0.752 | 21% | 0.211 | S | C | * | . | H | α-helix | trans | -79.3 | -45.1 | -177 | -73 | 180 | -179.6 | -176.2 | 0 | 113.3 | T542 I543 | T542-K546 WeakPolarHBondContact O-CG 3.31Å; T542-K546 PolarHBondContact O-N 3.27Å; I543-K546 PolarHBondContact O-N 3.39Å |
| 547 | I | 86.5 | Confident | 90.3 | Very high | 74 Ų | 74 | 41.2 Ų | 41.2 | 38% | 0.379 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -110.1 | -10.1 | -173.5 | 69.2 | 172.9 | 0 | 0 | 0 | 112.9 | I543 N551 V552 | I543-I547 HydrophobicContact CG2-CD1 3.59Å; I543-I547 HydrophobicContact CG2-CG1 3.8Å; I543-I547 WeakPolarHBondContact O-CG1 3.35Å; I543-I547 PolarHBondContact O-N 3.03Å; I547-N551 HydrophobicContact CB-CB 4.15Å; I547-N551 HydrophobicContact CD1-CB 4.02Å; I547-N551 HydrophobicContact CG1-CB 4.02Å; I547-N551 WeakPolarHBondContact O-CB 3.43Å; I547-N551 PolarHBondContact O-ND2 2.66Å; I547-V552 HydrophobicContact CD1-CG2 3.93Å; I547-V552 HydrophobicContact CG1-CG2 3.89Å |
| 548 | G | 85.5 | Confident | 90.5 | Very high | 9 Ų | 9 | 42.7 Ų | 42.7 | 9% | 0.093 | 22% | 0.224 | C | C | . | . | trans | 86.2 | 154.1 | -179 | 0 | 0 | 0 | 0 | 0 | 114.1 | T544 P550 N551 V552 | T544-G548 CarbonylContact O-C 3.54Å; T544-G548 WeakPolarHBondContact O-CA 3.37Å; T544-G548 PolarHBondContact O-N 3.49Å; G548-P550 VanDerWaalsContact C-CD 3.46Å; G548-N551 PolarHBondContact O-N 2.92Å; G548-V552 PolarHBondContact O-N 3.17Å | ||
| 549 | V | 85.3 | Confident | 90.7 | Very high | 2 Ų | 2 | 41.7 Ų | 41.7 | 1% | 0.012 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -53.7 | -46.6 | 177.8 | 178.4 | 0 | 0 | 0 | 0 | 112.8 | L343 L411 L414 T544 N551 V552 M553 | L343-V549 HydrophobicContact CD1-CG1 3.73Å; L411-V549 WeakPolarHBondContact O-CG2 3.47Å; L414-V549 HydrophobicContact CD1-CG2 4.21Å; L414-V549 HydrophobicContact CD2-CG2 4.49Å; L414-V549 HydrophobicContact CG-CG2 4.1Å; T544-V549 HydrophobicContact CG2-CB 4.24Å; T544-V549 HydrophobicContact CG2-CG2 3.42Å; T544-V549 VanDerWaalsContact CG2-CG2 3.42Å; V549-N551 VanDerWaalsContact C-N 3.31Å; V549-N551 PolarHBondContact O-N 3.31Å; V549-V552 PolarHBondContact O-N 3.33Å; V549-M553 HydrophobicContact CG1-CE 4.26Å; V549-M553 HydrophobicContact CG1-CG 4.4Å; V549-M553 WeakPolarHBondContact O-CG 3.42Å; V549-M553 PolarHBondContact O-N 2.97Å; V549-M553 VanDerWaalsContact O-N 3.08Å |
| 550 | P | 88.5 | Confident | 91 | Very high | 16 Ų | 16 | 39.2 Ų | 39.2 | 10% | 0.104 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -59.6 | -41.6 | -177.2 | -22.8 | 33.3 | 0 | 0 | 0 | 112.6 | L405 G548 M553 F554 | L405-P550 HydrophobicContact CB-CB 4.12Å; L405-P550 HydrophobicContact CD1-CB 4.31Å; G548-P550 VanDerWaalsContact C-CD 3.46Å; P550-M553 PolarHBondContact O-N 2.87Å; P550-F554 WeakPolarHBondContact O-CD2 3.46Å; P550-F554 PolarHBondContact O-N 3.5Å |
| 551 | N | 90.5 | Very high | 91.3 | Very high | 79 Ų | 79 | 43 Ų | 43 | 42% | 0.422 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -69.9 | -34.3 | -178.7 | -70.9 | -29.3 | 0 | 0 | 0 | 112.3 | I547 G548 V549 F554 L555 | I547-N551 HydrophobicContact CB-CB 4.15Å; I547-N551 HydrophobicContact CD1-CB 4.02Å; I547-N551 HydrophobicContact CG1-CB 4.02Å; I547-N551 WeakPolarHBondContact O-CB 3.43Å; I547-N551 PolarHBondContact O-ND2 2.66Å; G548-N551 PolarHBondContact O-N 2.92Å; V549-N551 VanDerWaalsContact C-N 3.31Å; V549-N551 PolarHBondContact O-N 3.31Å; N551-F554 PolarHBondContact O-N 3.28Å; N551-L555 WeakPolarHBondContact O-CB 3.4Å; N551-L555 PolarHBondContact O-N 2.83Å |
| 552 | V | 91.9 | Very high | 91.7 | Very high | 4 Ų | 4 | 46.5 Ų | 46.5 | 2% | 0.024 | 24% | 0.242 | C | C | . | . | H | α-helix | trans | -65.3 | -39.9 | 172.3 | 177.3 | 0 | 0 | 0 | 0 | 111.2 | F540 I543 I547 G548 V549 L555 Y556 | F540-V552 HydrophobicContact CD2-CG1 4.3Å; F540-V552 HydrophobicContact CE2-CG1 3.88Å; I543-V552 HydrophobicContact CG2-CG2 3.83Å; I547-V552 HydrophobicContact CD1-CG2 3.93Å; I547-V552 HydrophobicContact CG1-CG2 3.89Å; G548-V552 PolarHBondContact O-N 3.17Å; V549-V552 PolarHBondContact O-N 3.33Å; V552-L555 WeakPolarHBondContact O-CB 3.44Å; V552-L555 PolarHBondContact O-N 3.46Å; V552-Y556 HydrophobicContact CG1-CD2 4.03Å; V552-Y556 HydrophobicContact CG1-CE2 3.57Å; V552-Y556 PolarHBondContact O-N 3.43Å |
| 553 | M | 92.7 | Very high | 92.1 | Very high | 0 Ų | 0 | 44.8 Ų | 44.8 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -64.4 | -40.3 | 175.2 | -61.5 | -55.6 | 125.1 | 0 | 0 | 111.9 | L343 L397 L400 V549 P550 L555 Y556 S557 | L343-M553 HydrophobicContact CD1-CE 4.45Å; L397-M553 HydrophobicContact CD2-SD 3.96Å; L400-M553 HydrophobicContact CD2-CG 4.03Å; L400-M553 HydrophobicContact CD2-SD 3.81Å; L400-M553 HydrophobicContact CG-CG 4.3Å; V549-M553 HydrophobicContact CG1-CE 4.26Å; V549-M553 HydrophobicContact CG1-CG 4.4Å; V549-M553 WeakPolarHBondContact O-CG 3.42Å; V549-M553 PolarHBondContact O-N 2.97Å; V549-M553 VanDerWaalsContact O-N 3.08Å; P550-M553 PolarHBondContact O-N 2.87Å; M553-L555 VanDerWaalsContact C-N 3.35Å; M553-Y556 PolarHBondContact O-N 2.91Å; M553-S557 WeakPolarHBondContact O-CB 3.49Å; M553-S557 PolarHBondContact O-N 3.41Å |
| 554 | F | 95.1 | Very high | 92.5 | Very high | 70 Ų | 70 | 42.9 Ų | 42.9 | 31% | 0.307 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -64.1 | -38 | 172.6 | -72.6 | -56.7 | 0 | 0 | 0 | 112.8 | T402 L405 P550 N551 S557 G558 | T402-F554 HydrophobicContact CG2-CE1 3.94Å; T402-F554 HydrophobicContact CG2-CZ 3.75Å; L405-F554 HydrophobicContact CD2-CE2 4.42Å; P550-F554 WeakPolarHBondContact O-CD2 3.46Å; P550-F554 PolarHBondContact O-N 3.5Å; N551-F554 PolarHBondContact O-N 3.28Å; F554-S557 WeakPolarHBondContact O-CB 3.18Å; F554-S557 PolarHBondContact O-N 3.48Å; F554-G558 PolarHBondContact O-N 2.83Å |
| 555 | L | 95.4 | Very high | 92.9 | Very high | 90 Ų | 90 | 46.7 Ų | 46.7 | 47% | 0.471 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -62.5 | -46.6 | 175.4 | -175.4 | 146.6 | 0 | 0 | 0 | 111.3 | N551 V552 M553 S557 G558 M559 | N551-L555 WeakPolarHBondContact O-CB 3.4Å; N551-L555 PolarHBondContact O-N 2.83Å; V552-L555 WeakPolarHBondContact O-CB 3.44Å; V552-L555 PolarHBondContact O-N 3.46Å; M553-L555 VanDerWaalsContact C-N 3.35Å; L555-S557 PolarHBondContact O-N 2.87Å; L555-G558 PolarHBondContact O-N 3.02Å; L555-M559 HydrophobicContact CD2-CG 4.41Å; L555-M559 WeakPolarHBondContact O-CG 3.29Å; L555-M559 PolarHBondContact O-N 3.37Å |
| 556 | Y | 95.8 | Very high | 93.5 | Very high | 15 Ų | 15 | 43.6 Ų | 43.6 | 6% | 0.059 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -66.1 | -35 | 175.6 | -69 | -24.1 | 0 | 0 | 0 | 113.4 | A330 T331 N335 I336 F540 V552 M553 M559 S560 | A330-Y556 WeakPolarHBondContact O-CD1 3.36Å; T331-Y556 WeakPolarHBondContact O-CB 3.28Å; N335-Y556 PolarHBondContact ND2-OH 2.94Å; I336-Y556 HydrophobicContact CD1-CD2 4.41Å; F540-Y556 HydrophobicContact CD2-CE2 4.41Å; F540-Y556 WeakPolarHBondContact CD2-OH 3.04Å; F540-Y556 HydrophobicContact CE2-CE2 4.09Å; V552-Y556 HydrophobicContact CG1-CD2 4.03Å; V552-Y556 HydrophobicContact CG1-CE2 3.57Å; V552-Y556 PolarHBondContact O-N 3.43Å; M553-Y556 PolarHBondContact O-N 2.91Å; Y556-M559 PolarHBondContact O-N 3.32Å; Y556-S560 PolarHBondContact O-N 3.15Å; Y556-S560 PolarHBondContact O-OG 2.9Å |
| 557 | S | 97.3 | Very high | 93.9 | Very high | 9 Ų | 9 | 35.4 Ų | 35.4 | 6% | 0.063 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -59.4 | -49.7 | 169.5 | 166.4 | 0 | 0 | 0 | 0 | 111.3 | G394 M553 F554 L555 M559 S560 F561 | G394-S557 PolarHBondContact O-OG 3.16Å; M553-S557 WeakPolarHBondContact O-CB 3.49Å; M553-S557 PolarHBondContact O-N 3.41Å; F554-S557 WeakPolarHBondContact O-CB 3.18Å; F554-S557 PolarHBondContact O-N 3.48Å; L555-S557 PolarHBondContact O-N 2.87Å; S557-M559 VanDerWaalsContact C-N 3.34Å; S557-M559 PolarHBondContact O-N 2.82Å; S557-S560 WeakPolarHBondContact O-CA 3.32Å; S557-S560 VanDerWaalsContact O-CB 3.31Å; S557-S560 WeakPolarHBondContact O-CB 3.41Å; S557-S560 PolarHBondContact O-N 2.93Å; S557-F561 WeakPolarHBondContact O-CD2 3.43Å; S557-F561 PolarHBondContact O-N 3.07Å; S557-F561 VanDerWaalsContact O-N 3.15Å |
| 558 | G | 97.5 | Very high | 94.2 | Very high | 32 Ų | 32 | 36 Ų | 36 | 33% | 0.33 | 20% | 0.198 | S | C | . | . | H | α-helix | trans | -57 | -45.7 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.4 | F554 L555 S560 F561 V562 | F554-G558 PolarHBondContact O-N 2.83Å; L555-G558 PolarHBondContact O-N 3.02Å; G558-S560 VanDerWaalsContact C-N 3.26Å; G558-S560 PolarHBondContact O-N 2.94Å; G558-F561 PolarHBondContact O-N 3.31Å; G558-F561 VanDerWaalsContact O-N 3.13Å; G558-V562 WeakPolarHBondContact O-CG2 3.3Å; G558-V562 PolarHBondContact O-N 2.75Å |
| 559 | M | 97.2 | Very high | 94.4 | Very high | 48 Ų | 48 | 40 Ų | 40 | 24% | 0.236 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -62.9 | -31.3 | 175.6 | -68.2 | -51.9 | -63.1 | 0 | 0 | 113 | L327 A330 L555 Y556 S557 V562 L563 | L327-M559 HydrophobicContact CD2-CE 3.71Å; A330-M559 HydrophobicContact CB-CB 4.46Å; A330-M559 HydrophobicContact CB-CE 3.74Å; A330-M559 HydrophobicContact CB-CG 4.41Å; L555-M559 HydrophobicContact CD2-CG 4.41Å; L555-M559 WeakPolarHBondContact O-CG 3.29Å; L555-M559 PolarHBondContact O-N 3.37Å; Y556-M559 PolarHBondContact O-N 3.32Å; S557-M559 VanDerWaalsContact C-N 3.34Å; S557-M559 PolarHBondContact O-N 2.82Å; M559-V562 PolarHBondContact O-N 2.76Å; M559-L563 WeakPolarHBondContact O-CB 3.49Å; M559-L563 PolarHBondContact O-N 3.4Å |
| 560 | S | 97.1 | Very high | 94.6 | Very high | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -67.5 | -36.2 | 174.2 | -57.9 | 0 | 0 | 0 | 0 | 112 | Y556 S557 G558 L563 L564 | Y556-S560 PolarHBondContact O-N 3.15Å; Y556-S560 PolarHBondContact O-OG 2.9Å; S557-S560 WeakPolarHBondContact O-CA 3.32Å; S557-S560 VanDerWaalsContact O-CB 3.31Å; S557-S560 WeakPolarHBondContact O-CB 3.41Å; S557-S560 PolarHBondContact O-N 2.93Å; G558-S560 VanDerWaalsContact C-N 3.26Å; G558-S560 PolarHBondContact O-N 2.94Å; S560-L563 WeakPolarHBondContact O-CB 3.37Å; S560-L563 PolarHBondContact O-N 3.46Å; S560-L564 PolarHBondContact O-N 2.89Å |
| 561 | F | 97.4 | Very high | 94.6 | Very high | 84 Ų | 84 | 43.2 Ų | 43.2 | 37% | 0.368 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -73.1 | -35.3 | 172.9 | -69 | -68.1 | 0 | 0 | 0 | 112.8 | T395 S557 G558 L563 L564 V565 | T395-F561 HydrophobicContact CG2-CZ 4.44Å; S557-F561 WeakPolarHBondContact O-CD2 3.43Å; S557-F561 PolarHBondContact O-N 3.07Å; S557-F561 VanDerWaalsContact O-N 3.15Å; G558-F561 PolarHBondContact O-N 3.31Å; G558-F561 VanDerWaalsContact O-N 3.13Å; F561-L563 VanDerWaalsContact C-N 3.3Å; F561-L563 PolarHBondContact O-N 3.29Å; F561-L564 HydrophobicContact CD1-CD2 4.3Å; F561-L564 WeakPolarHBondContact O-CB 3.19Å; F561-L564 PolarHBondContact O-N 3.4Å; F561-V565 WeakPolarHBondContact O-CG2 3.41Å; F561-V565 PolarHBondContact O-N 3.5Å |
| 562 | V | 97.8 | Very high | 94.3 | Very high | 74 Ų | 74 | 39.5 Ų | 39.5 | 45% | 0.448 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -60.4 | -43.8 | 170.6 | 174 | 0 | 0 | 0 | 0 | 110.4 | L327 G558 M559 L564 V565 F566 | L327-V562 HydrophobicContact CD2-CG1 3.9Å; G558-V562 WeakPolarHBondContact O-CG2 3.3Å; G558-V562 PolarHBondContact O-N 2.75Å; M559-V562 PolarHBondContact O-N 2.76Å; V562-L564 VanDerWaalsContact C-N 3.35Å; V562-L564 PolarHBondContact O-N 3.45Å; V562-V565 PolarHBondContact O-N 3.38Å; V562-F566 WeakPolarHBondContact O-CB 3.21Å; V562-F566 PolarHBondContact O-N 3.22Å |
| 563 | L | 96.9 | Very high | 93.9 | Very high | 1 Ų | 1 | 42 Ų | 42 | 1% | 0.005 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -58.6 | -44.1 | 172.6 | 169.2 | 68.9 | 0 | 0 | 0 | 111.9 | L324 L327 T331 A390 L501 M559 S560 F561 V565 F566 V567 | L324-L563 HydrophobicContact CD1-CD1 4.06Å; L327-L563 HydrophobicContact CB-CB 4.27Å; L327-L563 HydrophobicContact CB-CD1 3.83Å; L327-L563 HydrophobicContact CD1-CD1 4.44Å; T331-L563 HydrophobicContact CG2-CD2 3.8Å; A390-L563 HydrophobicContact CB-CD2 4.13Å; A390-L563 HydrophobicContact CB-CG 4.31Å; L501-L563 HydrophobicContact CD1-CD2 3.52Å; L501-L563 HydrophobicContact CD2-CD1 4.16Å; L501-L563 HydrophobicContact CD2-CD2 3.53Å; L501-L563 HydrophobicContact CD2-CG 4.42Å; L501-L563 HydrophobicContact CG-CD2 4Å; M559-L563 WeakPolarHBondContact O-CB 3.49Å; M559-L563 PolarHBondContact O-N 3.4Å; S560-L563 WeakPolarHBondContact O-CB 3.37Å; S560-L563 PolarHBondContact O-N 3.46Å; F561-L563 VanDerWaalsContact C-N 3.3Å; F561-L563 PolarHBondContact O-N 3.29Å; L563-V565 PolarHBondContact O-N 2.88Å; L563-F566 PolarHBondContact O-N 2.77Å; L563-V567 HydrophobicContact CD1-CG2 3.88Å; L563-V567 HydrophobicContact CG-CG2 4.36Å; L563-V567 WeakPolarHBondContact O-CB 3.31Å; L563-V567 VanDerWaalsContact O-CG2 3.26Å; L563-V567 WeakPolarHBondContact O-CG2 3.06Å; L563-V567 PolarHBondContact O-N 2.85Å |
| 564 | L | 97 | Very high | 93.2 | Very high | 28 Ų | 28 | 42.2 Ų | 42.2 | 15% | 0.147 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -57.5 | -50.3 | 176.6 | 176.3 | 65 | 0 | 0 | 0 | 111.6 | C387 A390 V391 S560 F561 V562 F566 V567 I568 | C387-L564 HydrophobicContact CB-CD1 3.8Å; A390-L564 HydrophobicContact CB-CB 3.89Å; A390-L564 HydrophobicContact CB-CD1 4.36Å; V391-L564 HydrophobicContact CG2-CD1 4.05Å; V391-L564 HydrophobicContact CG2-CD2 3.56Å; V391-L564 HydrophobicContact CG2-CG 4.42Å; S560-L564 PolarHBondContact O-N 2.89Å; F561-L564 HydrophobicContact CD1-CD2 4.3Å; F561-L564 WeakPolarHBondContact O-CB 3.19Å; F561-L564 PolarHBondContact O-N 3.4Å; V562-L564 VanDerWaalsContact C-N 3.35Å; V562-L564 PolarHBondContact O-N 3.45Å; L564-F566 VanDerWaalsContact C-N 3.32Å; L564-F566 PolarHBondContact O-N 3.03Å; L564-V567 PolarHBondContact O-N 3.49Å; L564-I568 HydrophobicContact CD1-CD1 3.95Å; L564-I568 HydrophobicContact CD1-CG1 4.41Å; L564-I568 HydrophobicContact CG-CD1 3.99Å; L564-I568 WeakPolarHBondContact O-CG1 3.09Å; L564-I568 PolarHBondContact O-N 3.06Å |
| 565 | V | 96.6 | Very high | 92.2 | Very high | 81 Ų | 81 | 43.4 Ų | 43.4 | 49% | 0.491 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -59.7 | -45.6 | 177.7 | 174 | 0 | 0 | 0 | 0 | 110.2 | F561 V562 L563 V567 I568 L569 | F561-V565 WeakPolarHBondContact O-CG2 3.41Å; F561-V565 PolarHBondContact O-N 3.5Å; V562-V565 PolarHBondContact O-N 3.38Å; L563-V565 PolarHBondContact O-N 2.88Å; V565-V567 PolarHBondContact O-N 3.47Å; V565-I568 PolarHBondContact O-N 3.01Å; V565-L569 HydrophobicContact CG1-CD1 3.68Å; V565-L569 HydrophobicContact CG1-CG 4.28Å; V565-L569 WeakPolarHBondContact O-CB 3.4Å; V565-L569 WeakPolarHBondContact O-CG 3.32Å; V565-L569 PolarHBondContact O-N 3.27Å |
| 566 | F | 95.8 | Very high | 90.8 | Very high | 27 Ų | 27 | 43.1 Ų | 43.1 | 12% | 0.118 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -59.6 | -44.1 | 177.7 | 175.9 | -95.1 | 0 | 0 | 0 | 112.5 | T320 A323 L324 L327 V562 L563 L564 L569 Y570 V571 | T320-F566 HydrophobicContact CG2-CZ 4.09Å; A323-F566 HydrophobicContact CB-CE1 4.4Å; A323-F566 HydrophobicContact CB-CE2 3.73Å; A323-F566 HydrophobicContact CB-CZ 3.58Å; L324-F566 HydrophobicContact CB-CE1 4.11Å; L324-F566 HydrophobicContact CD1-CE1 4.31Å; L327-F566 HydrophobicContact CD1-CB 3.64Å; L327-F566 HydrophobicContact CD1-CD1 3.67Å; L327-F566 HydrophobicContact CD1-CD2 4.04Å; L327-F566 HydrophobicContact CD1-CE1 4.35Å; L327-F566 HydrophobicContact CD1-CG 3.49Å; L327-F566 VanDerWaalsContact CD1-CG 3.49Å; V562-F566 WeakPolarHBondContact O-CB 3.21Å; V562-F566 PolarHBondContact O-N 3.22Å; L563-F566 PolarHBondContact O-N 2.77Å; L564-F566 VanDerWaalsContact C-N 3.32Å; L564-F566 PolarHBondContact O-N 3.03Å; F566-L569 PolarHBondContact O-N 2.91Å; F566-Y570 AromaticContact CD2-CD2 3.4Å; F566-Y570 HydrophobicContact CD2-CD2 3.4Å; F566-Y570 VanDerWaalsContact CD2-CD2 3.4Å; F566-Y570 HydrophobicContact CD2-CE2 4.16Å; F566-Y570 HydrophobicContact CD2-CG 4.01Å; F566-Y570 AromaticContact CE2-CD2 3.75Å; F566-Y570 HydrophobicContact CE2-CD2 3.75Å; F566-Y570 AromaticContact CE2-CG 3.87Å; F566-Y570 HydrophobicContact CE2-CG 3.87Å; F566-Y570 HydrophobicContact CG-CD2 4.19Å; F566-Y570 WeakPolarHBondContact O-CB 3.4Å; F566-Y570 PolarHBondContact O-N 3.44Å; F566-V571 HydrophobicContact CD1-CG2 4.26Å; F566-V571 HydrophobicContact CE1-CG2 3.91Å |
| 567 | V | 94.4 | Very high | 89.6 | Confident | 0 Ų | 0 | 47.8 Ų | 47.8 | 0% | 0 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -64.7 | -41.9 | 178.6 | 170.6 | 0 | 0 | 0 | 0 | 111.1 | L324 K383 L386 L563 L564 V565 V571 | L324-V567 HydrophobicContact CD1-CG2 4.41Å; K383-V567 WeakPolarHBondContact CE-O 3.28Å; K383-V567 HydrophobicContact CG-CG1 4Å; K383-V567 PolarHBondContact NZ-O 3.2Å; L386-V567 HydrophobicContact CB-CG1 3.76Å; L386-V567 HydrophobicContact CB-CG2 4.12Å; L386-V567 HydrophobicContact CD1-CG1 4.35Å; L386-V567 HydrophobicContact CD1-CG2 4.42Å; L563-V567 HydrophobicContact CD1-CG2 3.88Å; L563-V567 HydrophobicContact CG-CG2 4.36Å; L563-V567 WeakPolarHBondContact O-CB 3.31Å; L563-V567 VanDerWaalsContact O-CG2 3.26Å; L563-V567 WeakPolarHBondContact O-CG2 3.06Å; L563-V567 PolarHBondContact O-N 2.85Å; L564-V567 PolarHBondContact O-N 3.49Å; V565-V567 PolarHBondContact O-N 3.47Å; V567-V571 HydrophobicContact CB-CG2 4.38Å; V567-V571 HydrophobicContact CG1-CB 4.26Å; V567-V571 HydrophobicContact CG2-CG2 4.18Å; V567-V571 WeakPolarHBondContact O-CB 3.19Å; V567-V571 PolarHBondContact O-N 3.45Å |
| 568 | I | 92.6 | Very high | 88.7 | Confident | 88 Ų | 88 | 50.7 Ų | 50.7 | 45% | 0.451 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -62.5 | -47.4 | 178.1 | -68.6 | 168.3 | 0 | 0 | 0 | 110.3 | K383 L564 V565 | K383-I568 PolarHBondContact NZ-O 2.9Å; L564-I568 HydrophobicContact CD1-CD1 3.95Å; L564-I568 HydrophobicContact CD1-CG1 4.41Å; L564-I568 HydrophobicContact CG-CD1 3.99Å; L564-I568 WeakPolarHBondContact O-CG1 3.09Å; L564-I568 PolarHBondContact O-N 3.06Å; V565-I568 PolarHBondContact O-N 3.01Å |
| 569 | L | 90.3 | Very high | 87.3 | Confident | 92 Ų | 92 | 52 Ų | 52 | 48% | 0.482 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -78.9 | -52.9 | -173.7 | -63.5 | 179.9 | 0 | 0 | 0 | 113 | V565 F566 K589 | V565-L569 HydrophobicContact CG1-CD1 3.68Å; V565-L569 HydrophobicContact CG1-CG 4.28Å; V565-L569 WeakPolarHBondContact O-CB 3.4Å; V565-L569 WeakPolarHBondContact O-CG 3.32Å; V565-L569 PolarHBondContact O-N 3.27Å; F566-L569 PolarHBondContact O-N 2.91Å; L569-K589 VanDerWaalsContact O-CD 3.31Å; L569-K589 WeakPolarHBondContact O-CD 3.28Å; L569-K589 VanDerWaalsContact O-CE 3.31Å; L569-K589 WeakPolarHBondContact O-CE 3.37Å; L569-K589 PolarHBondContact O-NZ 3.34Å |
| 570 | Y | 88.3 | Confident | 85.9 | Confident | 84 Ų | 84 | 57.2 Ų | 57.2 | 33% | 0.329 | 30% | 0.302 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -102.2 | -29.1 | -165.9 | -61.7 | -79.6 | 0 | 0 | 0 | 114.4 | F566 P572 E593 | F566-Y570 AromaticContact CD2-CD2 3.4Å; F566-Y570 HydrophobicContact CD2-CD2 3.4Å; F566-Y570 VanDerWaalsContact CD2-CD2 3.4Å; F566-Y570 HydrophobicContact CD2-CE2 4.16Å; F566-Y570 HydrophobicContact CD2-CG 4.01Å; F566-Y570 AromaticContact CE2-CD2 3.75Å; F566-Y570 HydrophobicContact CE2-CD2 3.75Å; F566-Y570 AromaticContact CE2-CG 3.87Å; F566-Y570 HydrophobicContact CE2-CG 3.87Å; F566-Y570 HydrophobicContact CG-CD2 4.19Å; F566-Y570 WeakPolarHBondContact O-CB 3.4Å; F566-Y570 PolarHBondContact O-N 3.44Å; Y570-P572 WeakPolarHBondContact O-CD 3.17Å; Y570-E593 VanDerWaalsContact CE1-OE1 3.24Å; Y570-E593 WeakPolarHBondContact CE1-OE1 3.3Å; Y570-E593 VanDerWaalsContact CZ-OE1 3.24Å; Y570-E593 PolarHBondContact OH-OE1 2.98Å |
| 571 | V | 88.4 | Confident | 84.8 | Confident | 1 Ų | 1 | 61.7 Ų | 61.7 | 1% | 0.006 | 32% | 0.323 | C | S | . | . | S | Bend | trans | -78 | 120.6 | 179.9 | 179.7 | 0 | 0 | 0 | 0 | 109.7 | L324 K383 L386 V508 F566 V567 | L324-V571 HydrophobicContact CD1-CG2 4.47Å; K383-V571 PolarHBondContact NZ-O 3.37Å; L386-V571 HydrophobicContact CD1-CG1 4.42Å; V508-V571 HydrophobicContact CG1-CG1 4.23Å; V508-V571 HydrophobicContact CG2-CG1 4.28Å; F566-V571 HydrophobicContact CD1-CG2 4.26Å; F566-V571 HydrophobicContact CE1-CG2 3.91Å; V567-V571 HydrophobicContact CB-CG2 4.38Å; V567-V571 HydrophobicContact CG1-CB 4.26Å; V567-V571 HydrophobicContact CG2-CG2 4.18Å; V567-V571 WeakPolarHBondContact O-CB 3.19Å; V567-V571 PolarHBondContact O-N 3.45Å |
| 572 | P | 84.4 | Confident | 83.6 | Confident | 1 Ų | 1 | 57.8 Ų | 57.8 | 1% | 0.006 | 31% | 0.306 | C | S | . | . | trans | -74.6 | 159 | 179 | 31.1 | -33.9 | 0 | 0 | 0 | 111.1 | I512 Y570 T574 I582 L586 | I512-P572 HydrophobicContact CG2-CG 4.32Å; Y570-P572 WeakPolarHBondContact O-CD 3.17Å; P572-T574 PolarHBondContact O-N 3.47Å; P572-I582 HydrophobicContact CB-CG2 4.39Å; P572-I582 HydrophobicContact CG-CG2 3.96Å; P572-L586 HydrophobicContact CG-CD2 4.28Å; P572-L586 HydrophobicContact CG-CG 4.37Å | ||
| 573 | Q | 83.1 | Confident | 82.1 | Confident | 57 Ų | 57 | 55.5 Ų | 55.5 | 27% | 0.266 | 29% | 0.293 | S | S | . | . | trans | -75.8 | 113.1 | 169.4 | -169.5 | 71.9 | 20 | 0 | 0 | 108.5 | K383 R577 | K383-Q573 VanDerWaalsContact CB-OE1 3.28Å; Q573-R577 WeakPolarHBondContact O-CD 3.47Å | ||
| 574 | T | 79.1 | Confident | 80.8 | Confident | 5 Ų | 5 | 63.4 Ų | 63.4 | 3% | 0.031 | 33% | 0.327 | C | S | . | . | trans | -91.1 | -26.6 | -176.1 | 54.5 | 0 | 0 | 0 | 0 | 113.7 | E511 P572 G576 R577 I582 | E511-T574 HydrophobicContact CB-CG2 3.89Å; E511-T574 WeakPolarHBondContact OE2-CB 3.35Å; E511-T574 WeakPolarHBondContact OE2-CG2 3.32Å; E511-T574 PolarHBondContact OE2-OG1 3.18Å; P572-T574 PolarHBondContact O-N 3.47Å; T574-G576 PolarHBondContact O-N 3.37Å; T574-G576 VanDerWaalsContact O-N 3.17Å; T574-R577 PolarHBondContact O-N 3.33Å; T574-I582 HydrophobicContact CG2-CD1 4.31Å | ||
| 575 | K | 74.8 | Confident | 79.6 | Confident | 94 Ų | 94 | 64 Ų | 64 | 41% | 0.409 | 33% | 0.329 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -56.1 | 119.9 | -176.6 | -175.6 | -171.9 | 171.5 | -166.3 | 0 | 112.1 | D378 R379 R577 | D378-K575 VanDerWaalsContact O-CE 3.29Å; D378-K575 WeakPolarHBondContact O-CE 3.43Å; R379-K575 PolarHBondContact O-NZ 3.06Å; K575-R577 PolarHBondContact O-N 2.94Å |
| 576 | G | 64.3 | Low | 78.2 | Confident | 85 Ų | 85 | 60.5 Ų | 60.5 | 88% | 0.876 | 31% | 0.308 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 69.3 | 14.4 | 172 | 0 | 0 | 0 | 0 | 0 | 114.7 | T574 | T574-G576 PolarHBondContact O-N 3.37Å; T574-G576 VanDerWaalsContact O-N 3.17Å |
| 577 | R | 72.3 | Confident | 76.7 | Confident | 112 Ų | 112 | 60.4 Ų | 60.4 | 42% | 0.423 | 31% | 0.312 | S | S | . | . | trans | -107.5 | 146.6 | -178.3 | -66.2 | -157.9 | -177.5 | 173.3 | 2.4 | 112.2 | Q573 T574 K575 E581 I582 E585 | Q573-R577 WeakPolarHBondContact O-CD 3.47Å; T574-R577 PolarHBondContact O-N 3.33Å; K575-R577 PolarHBondContact O-N 2.94Å; R577-E581 VanDerWaalsContact CA-OE2 3.27Å; R577-E581 WeakPolarHBondContact CA-OE2 3.04Å; R577-E581 HydrophobicContact CB-CB 4.31Å; R577-E581 VanDerWaalsContact CB-OE2 3.3Å; R577-E581 WeakPolarHBondContact CB-OE2 3.38Å; R577-E581 WeakPolarHBondContact CG-OE2 3.45Å; R577-I582 HydrophobicContact CB-CG1 4.19Å; R577-E585 IonicContact CZ-OE2 2.62Å; R577-E585 IonicContact NH1-OE2 3.84Å; R577-E585 PolarHBondContact NH1-OE2 2.82Å | ||
| 578 | T | 77.8 | Confident | 75.2 | Confident | 70 Ų | 70 | 64 Ų | 64 | 43% | 0.429 | 34% | 0.337 | S | S | . | . | trans | -75.4 | 158.3 | 174.7 | 67.4 | 0 | 0 | 0 | 0 | 110.8 | E580 E581 I582 | T578-E580 PolarHBondContact O-N 2.72Å; T578-E581 PolarHBondContact N-OE2 3.25Å; T578-E581 PolarHBondContact O-N 3.25Å; T578-E581 WeakPolarHBondContact OG1-CG 3.21Å; T578-E581 PolarHBondContact OG1-N 2.91Å; T578-I582 WeakPolarHBondContact O-CG1 3.14Å; T578-I582 PolarHBondContact O-N 3.07Å | ||
| 579 | L | 68.5 | Low | 73.7 | Confident | 59 Ų | 59 | 62.3 Ų | 62.3 | 31% | 0.309 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -59.5 | -30.6 | 176.6 | -172 | 72.3 | 0 | 0 | 0 | 111.8 | R317 E511 P514 S583 | R317-L579 PolarHBondContact NH2-O 3.41Å; R317-L579 VanDerWaalsContact NH2-O 3.12Å; E511-L579 WeakPolarHBondContact O-CD1 3.37Å; P514-L579 HydrophobicContact CB-CD2 3.65Å; P514-L579 HydrophobicContact CG-CD2 4.08Å; L579-S583 WeakPolarHBondContact O-CB 3.46Å; L579-S583 PolarHBondContact O-N 3.42Å; L579-S583 PolarHBondContact O-OG 2.84Å |
| 580 | E | 67.6 | Low | 72.2 | Confident | 158 Ų | 158 | 62.4 Ų | 62.4 | 74% | 0.738 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -68.1 | -45.1 | 177.1 | -67.3 | 172.9 | -176.8 | 0 | 0 | 111.5 | T578 I582 S583 K584 | T578-E580 PolarHBondContact O-N 2.72Å; E580-I582 PolarHBondContact O-N 2.87Å; E580-S583 VanDerWaalsContact O-CB 3.31Å; E580-S583 WeakPolarHBondContact O-CB 3.14Å; E580-S583 PolarHBondContact O-N 2.92Å; E580-S583 VanDerWaalsContact O-N 3.14Å; E580-K584 WeakPolarHBondContact O-CB 3.04Å; E580-K584 PolarHBondContact O-N 3.48Å |
| 581 | E | 72.6 | Confident | 70.6 | Confident | 94 Ų | 94 | 63 Ų | 63 | 44% | 0.439 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -61 | -42.9 | 174.1 | -72.6 | 166.9 | -170.4 | 0 | 0 | 112 | R577 T578 S583 K584 E585 | R577-E581 VanDerWaalsContact CA-OE2 3.27Å; R577-E581 WeakPolarHBondContact CA-OE2 3.04Å; R577-E581 HydrophobicContact CB-CB 4.31Å; R577-E581 VanDerWaalsContact CB-OE2 3.3Å; R577-E581 WeakPolarHBondContact CB-OE2 3.38Å; R577-E581 WeakPolarHBondContact CG-OE2 3.45Å; T578-E581 PolarHBondContact N-OE2 3.25Å; T578-E581 PolarHBondContact O-N 3.25Å; T578-E581 WeakPolarHBondContact OG1-CG 3.21Å; T578-E581 PolarHBondContact OG1-N 2.91Å; E581-S583 VanDerWaalsContact C-N 3.31Å; E581-S583 PolarHBondContact O-N 3.34Å; E581-K584 PolarHBondContact O-N 2.99Å; E581-E585 PolarHBondContact O-N 3.23Å |
| 582 | I | 73.9 | Confident | 68.9 | Low | 3 Ų | 3 | 69.5 Ų | 69.5 | 2% | 0.015 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -62.4 | -40.9 | 174.7 | -64.1 | 169.2 | 0 | 0 | 0 | 110.4 | P572 T574 R577 T578 E580 K584 E585 L586 | P572-I582 HydrophobicContact CB-CG2 4.39Å; P572-I582 HydrophobicContact CG-CG2 3.96Å; T574-I582 HydrophobicContact CG2-CD1 4.31Å; R577-I582 HydrophobicContact CB-CG1 4.19Å; T578-I582 WeakPolarHBondContact O-CG1 3.14Å; T578-I582 PolarHBondContact O-N 3.07Å; E580-I582 PolarHBondContact O-N 2.87Å; I582-K584 VanDerWaalsContact C-N 3.31Å; I582-K584 PolarHBondContact O-N 3.31Å; I582-E585 PolarHBondContact O-N 3.14Å; I582-L586 HydrophobicContact CG2-CD1 4.03Å; I582-L586 WeakPolarHBondContact O-CG 3.41Å; I582-L586 PolarHBondContact O-N 2.82Å; I582-L586 VanDerWaalsContact O-N 3.07Å |
| 583 | S | 66 | Low | 67.5 | Low | 26 Ų | 26 | 72.7 Ų | 72.7 | 18% | 0.182 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -61.1 | -42.1 | 176.5 | -51.1 | 0 | 0 | 0 | 0 | 111.2 | R317 L579 E580 E581 A587 | R317-S583 VanDerWaalsContact CZ-OG 3.3Å; R317-S583 PolarHBondContact NH1-OG 3.39Å; R317-S583 PolarHBondContact NH2-OG 3.31Å; L579-S583 WeakPolarHBondContact O-CB 3.46Å; L579-S583 PolarHBondContact O-N 3.42Å; L579-S583 PolarHBondContact O-OG 2.84Å; E580-S583 VanDerWaalsContact O-CB 3.31Å; E580-S583 WeakPolarHBondContact O-CB 3.14Å; E580-S583 PolarHBondContact O-N 2.92Å; E580-S583 VanDerWaalsContact O-N 3.14Å; E581-S583 VanDerWaalsContact C-N 3.31Å; E581-S583 PolarHBondContact O-N 3.34Å; S583-A587 WeakPolarHBondContact O-CB 3.33Å; S583-A587 PolarHBondContact O-N 2.77Å |
| 584 | K | 68.5 | Low | 66.3 | Low | 167 Ų | 167 | 73.8 Ų | 73.8 | 73% | 0.726 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -69.6 | -39.8 | -179.2 | -168.5 | 177.2 | -179.6 | 179.8 | 0 | 112 | E580 E581 I582 A587 S588 | E580-K584 WeakPolarHBondContact O-CB 3.04Å; E580-K584 PolarHBondContact O-N 3.48Å; E581-K584 PolarHBondContact O-N 2.99Å; I582-K584 VanDerWaalsContact C-N 3.31Å; I582-K584 PolarHBondContact O-N 3.31Å; K584-A587 PolarHBondContact O-N 3.34Å; K584-S588 WeakPolarHBondContact O-CB 3.45Å; K584-S588 PolarHBondContact O-N 3.41Å |
| 585 | E | 72.1 | Confident | 64.5 | Low | 40 Ų | 40 | 77.7 Ų | 77.7 | 19% | 0.187 | 41% | 0.406 | C | S | . | . | H | α-helix | trans | -64.5 | -47.2 | 174.9 | -171.9 | -175.6 | 155.4 | 0 | 0 | 111.5 | R577 E581 I582 A587 S588 K589 | R577-E585 IonicContact CZ-OE2 2.62Å; R577-E585 IonicContact NH1-OE2 3.84Å; R577-E585 PolarHBondContact NH1-OE2 2.82Å; E581-E585 PolarHBondContact O-N 3.23Å; I582-E585 PolarHBondContact O-N 3.14Å; E585-A587 VanDerWaalsContact C-N 3.3Å; E585-A587 PolarHBondContact O-N 3.34Å; E585-S588 PolarHBondContact O-N 3.24Å; E585-K589 PolarHBondContact O-N 3Å; E585-K589 WeakPolarHBondContact OE1-CE 3.48Å; E585-K589 IonicContact OE1-NZ 3.47Å; E585-K589 PolarHBondContact OE1-NZ 3.46Å |
| 586 | L | 68.3 | Low | 63.4 | Low | 8 Ų | 8 | 77.9 Ų | 77.9 | 4% | 0.042 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -62.5 | -37.6 | 176.9 | -72.4 | 169.8 | 0 | 0 | 0 | 111.8 | R317 P572 I582 K590 | R317-L586 HydrophobicContact CG-CD1 3.65Å; P572-L586 HydrophobicContact CG-CD2 4.28Å; P572-L586 HydrophobicContact CG-CG 4.37Å; I582-L586 HydrophobicContact CG2-CD1 4.03Å; I582-L586 WeakPolarHBondContact O-CG 3.41Å; I582-L586 PolarHBondContact O-N 2.82Å; I582-L586 VanDerWaalsContact O-N 3.07Å; L586-K590 PolarHBondContact O-N 3.47Å |
| 587 | A | 64.6 | Low | 62.4 | Low | 24 Ų | 24 | 80.8 Ų | 80.8 | 20% | 0.198 | 40% | 0.4 | C | S | . | . | H | α-helix | trans | -64.3 | -43.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | N313 S583 K584 E585 K590 N591 | N313-A587 WeakPolarHBondContact ND2-CB 3.41Å; S583-A587 WeakPolarHBondContact O-CB 3.33Å; S583-A587 PolarHBondContact O-N 2.77Å; K584-A587 PolarHBondContact O-N 3.34Å; E585-A587 VanDerWaalsContact C-N 3.3Å; E585-A587 PolarHBondContact O-N 3.34Å; A587-K590 WeakPolarHBondContact O-CB 3.27Å; A587-K590 PolarHBondContact O-N 2.05Å; A587-N591 PolarHBondContact O-N 2.7Å; A587-N591 VanDerWaalsContact O-N 3.16Å |
| 588 | S | 61.7 | Low | 61.1 | Low | 75 Ų | 75 | 84.7 Ų | 84.7 | 52% | 0.524 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -63.5 | -42.9 | 179.1 | -175.6 | 0 | 0 | 0 | 0 | 111.7 | K584 E585 K590 N591 F592 | K584-S588 WeakPolarHBondContact O-CB 3.45Å; K584-S588 PolarHBondContact O-N 3.41Å; E585-S588 PolarHBondContact O-N 3.24Å; S588-K590 PolarHBondContact O-N 2.8Å; S588-N591 WeakPolarHBondContact O-CB 3.48Å; S588-N591 PolarHBondContact O-N 2.82Å; S588-N591 VanDerWaalsContact O-N 3.12Å; S588-F592 PolarHBondContact O-N 2.9Å |
| 589 | K | 61.9 | Low | 59.6 | Low | 54 Ų | 54 | 89.1 Ų | 89.1 | 24% | 0.235 | 43% | 0.43 | C | S | . | . | H | α-helix | trans | -63.9 | -38.9 | 177 | -74.3 | -177.6 | 177.9 | -178.7 | 0 | 112.8 | L569 E585 N591 F592 E593 | L569-K589 VanDerWaalsContact O-CD 3.31Å; L569-K589 WeakPolarHBondContact O-CD 3.28Å; L569-K589 VanDerWaalsContact O-CE 3.31Å; L569-K589 WeakPolarHBondContact O-CE 3.37Å; L569-K589 PolarHBondContact O-NZ 3.34Å; E585-K589 PolarHBondContact O-N 3Å; E585-K589 WeakPolarHBondContact OE1-CE 3.48Å; E585-K589 IonicContact OE1-NZ 3.47Å; E585-K589 PolarHBondContact OE1-NZ 3.46Å; K589-N591 VanDerWaalsContact C-N 3.3Å; K589-N591 PolarHBondContact O-N 3.14Å; K589-F592 PolarHBondContact O-N 3.34Å; K589-E593 PolarHBondContact O-N 2.93Å |
| 590 | K | 57.8 | Low | 58.5 | Low | 94 Ų | 94 | 90 Ų | 90 | 41% | 0.409 | 45% | 0.446 | S | S | . | . | H | α-helix | trans | -58.7 | -42.1 | 171.6 | -173.8 | -176.8 | 177.8 | -172.8 | 0 | 111.6 | L586 A587 S588 V594 | L586-K590 PolarHBondContact O-N 3.47Å; A587-K590 WeakPolarHBondContact O-CB 3.27Å; A587-K590 PolarHBondContact O-N 2.05Å; S588-K590 PolarHBondContact O-N 2.8Å; K590-V594 VanDerWaalsContact O-CG2 3.24Å; K590-V594 WeakPolarHBondContact O-CG2 3.43Å; K590-V594 PolarHBondContact O-N 3.22Å |
| 591 | N | 55.2 | Low | 57 | Low | 97 Ų | 97 | 89.7 Ų | 89.7 | 52% | 0.519 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -69.2 | -35.2 | 177.9 | -66.5 | -18.7 | 0 | 0 | 0 | 112.2 | A587 S588 K589 N595 | A587-N591 PolarHBondContact O-N 2.7Å; A587-N591 VanDerWaalsContact O-N 3.16Å; S588-N591 WeakPolarHBondContact O-CB 3.48Å; S588-N591 PolarHBondContact O-N 2.82Å; S588-N591 VanDerWaalsContact O-N 3.12Å; K589-N591 VanDerWaalsContact C-N 3.3Å; K589-N591 PolarHBondContact O-N 3.14Å; N591-N595 WeakPolarHBondContact O-CB 3.31Å; N591-N595 VanDerWaalsContact O-CG 3.23Å; N591-N595 PolarHBondContact O-N 2.94Å; N591-N595 VanDerWaalsContact O-N 3.07Å; N591-N595 PolarHBondContact O-ND2 3.44Å |
| 592 | F | 52.9 | Low | 55.4 | Low | 137 Ų | 137 | 91 Ų | 91 | 60% | 0.601 | 46% | 0.461 | S | S | * | . | H | α-helix | trans | -64.5 | -46.5 | 174.3 | -176.5 | -98 | 0 | 0 | 0 | 111.9 | S588 K589 N595 L596 | S588-F592 PolarHBondContact O-N 2.9Å; K589-F592 PolarHBondContact O-N 3.34Å; F592-N595 PolarHBondContact O-N 3.42Å; F592-L596 HydrophobicContact CE1-CD1 4.12Å; F592-L596 HydrophobicContact CZ-CD1 4Å; F592-L596 PolarHBondContact O-N 2.89Å |
| 593 | E | 55.2 | Low | 53.7 | Low | 67 Ų | 67 | 99.7 Ų | 99.7 | 31% | 0.313 | 50% | 0.502 | S | S | . | . | H | α-helix | trans | -63.6 | -44.2 | 176.1 | -74.7 | -163.4 | 134.5 | 0 | 0 | 112.6 | Y570 K589 N595 L596 F597 | Y570-E593 VanDerWaalsContact CE1-OE1 3.24Å; Y570-E593 WeakPolarHBondContact CE1-OE1 3.3Å; Y570-E593 VanDerWaalsContact CZ-OE1 3.24Å; Y570-E593 PolarHBondContact OH-OE1 2.98Å; K589-E593 PolarHBondContact O-N 2.93Å; E593-N595 PolarHBondContact O-N 3.47Å; E593-L596 PolarHBondContact O-N 2.72Å; E593-L596 VanDerWaalsContact O-N 3.15Å; E593-F597 HydrophobicContact CB-CD2 4.47Å; E593-F597 VanDerWaalsContact O-CD2 3.26Å; E593-F597 WeakPolarHBondContact O-CD2 3.17Å; E593-F597 PolarHBondContact O-N 2.89Å |
| 594 | V | 57 | Low | 52.4 | Low | 80 Ų | 80 | 107.4 Ų | 107.4 | 49% | 0.485 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -58.6 | -38.3 | 176.4 | 170.4 | 0 | 0 | 0 | 0 | 111 | K590 R598 | K590-V594 VanDerWaalsContact O-CG2 3.24Å; K590-V594 WeakPolarHBondContact O-CG2 3.43Å; K590-V594 PolarHBondContact O-N 3.22Å; V594-R598 WeakPolarHBondContact O-CB 3.12Å; V594-R598 PolarHBondContact O-N 3.35Å |
| 595 | N | 41.3 | Very low | 51 | Low | 88 Ų | 88 | 105 Ų | 105 | 47% | 0.471 | 54% | 0.535 | S | S | . | . | H | α-helix | trans | -71.8 | -37.6 | 176.7 | -72.7 | -24.1 | 0 | 0 | 0 | 112.7 | N591 F592 E593 R598 Q599 | N591-N595 WeakPolarHBondContact O-CB 3.31Å; N591-N595 VanDerWaalsContact O-CG 3.23Å; N591-N595 PolarHBondContact O-N 2.94Å; N591-N595 VanDerWaalsContact O-N 3.07Å; N591-N595 PolarHBondContact O-ND2 3.44Å; F592-N595 PolarHBondContact O-N 3.42Å; E593-N595 PolarHBondContact O-N 3.47Å; N595-R598 PolarHBondContact O-N 3.07Å; N595-Q599 WeakPolarHBondContact O-CB 3.47Å; N595-Q599 WeakPolarHBondContact O-CG 3.42Å; N595-Q599 PolarHBondContact O-N 3.24Å |
| 596 | L | 51.5 | Low | 49.4 | Very low | 97 Ų | 97 | 111.5 Ų | 111.5 | 51% | 0.508 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -65 | -44.5 | 175.8 | -147.2 | 88.9 | 0 | 0 | 0 | 111.3 | F592 E593 Q599 A600 | F592-L596 HydrophobicContact CE1-CD1 4.12Å; F592-L596 HydrophobicContact CZ-CD1 4Å; F592-L596 PolarHBondContact O-N 2.89Å; E593-L596 PolarHBondContact O-N 2.72Å; E593-L596 VanDerWaalsContact O-N 3.15Å; L596-Q599 PolarHBondContact O-N 3.49Å; L596-A600 WeakPolarHBondContact O-CB 3.45Å; L596-A600 PolarHBondContact O-N 2.84Å |
| 597 | F | 44.3 | Very low | 48 | Very low | 147 Ų | 147 | 118.3 Ų | 118.3 | 65% | 0.645 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -68.1 | -32.6 | 175.7 | -82.6 | -72.4 | 0 | 0 | 0 | 112.8 | E593 A600 Q601 | E593-F597 HydrophobicContact CB-CD2 4.47Å; E593-F597 VanDerWaalsContact O-CD2 3.26Å; E593-F597 WeakPolarHBondContact O-CD2 3.17Å; E593-F597 PolarHBondContact O-N 2.89Å; F597-A600 PolarHBondContact O-N 3.1Å; F597-Q601 PolarHBondContact O-N 3.22Å |
| 598 | R | 43.7 | Very low | 46.8 | Very low | 194 Ų | 194 | 128.5 Ų | 128.5 | 73% | 0.732 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -72.4 | -30.9 | 174.6 | -162.7 | 178.3 | -159 | 176.3 | 5 | 112.7 | V594 N595 | V594-R598 WeakPolarHBondContact O-CB 3.12Å; V594-R598 PolarHBondContact O-N 3.35Å; N595-R598 PolarHBondContact O-N 3.07Å |
| 599 | Q | 47.7 | Very low | 45.4 | Very low | 163 Ų | 163 | 136.8 Ų | 136.8 | 76% | 0.762 | 66% | 0.657 | S | S | * | * | H | α-helix | trans | -77.3 | -21.4 | 171.4 | -77.6 | 179.3 | -25.6 | 0 | 0 | 112.9 | N595 L596 | N595-Q599 WeakPolarHBondContact O-CB 3.47Å; N595-Q599 WeakPolarHBondContact O-CG 3.42Å; N595-Q599 PolarHBondContact O-N 3.24Å; L596-Q599 PolarHBondContact O-N 3.49Å |
| 600 | A | 44 | Very low | 44.1 | Very low | 78 Ų | 78 | 139 Ų | 139 | 65% | 0.645 | 68% | 0.68 | S | S | * | * | S | Bend | trans | -88.1 | -3.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | L596 F597 | L596-A600 WeakPolarHBondContact O-CB 3.45Å; L596-A600 PolarHBondContact O-N 2.84Å; F597-A600 PolarHBondContact O-N 3.1Å |
| 601 | Q | 36.7 | Very low | 43.1 | Very low | 151 Ų | 151 | 140.8 Ų | 140.8 | 71% | 0.706 | 70% | 0.701 | S | S | * | * | S | Bend | trans | -80.3 | 127.6 | 165.5 | -75 | -151.4 | -44.4 | 0 | 0 | 109.6 | F597 Q603 | F597-Q601 PolarHBondContact O-N 3.22Å; Q601-Q603 PolarHBondContact O-N 2.84Å |
| 602 | P | 39.6 | Very low | 42.1 | Very low | 120 Ų | 120 | 141.1 Ų | 141.1 | 78% | 0.779 | 71% | 0.711 | S | S | * | * | trans | -58.3 | 129.4 | 173.3 | -16.3 | 28.2 | 0 | 0 | 0 | 109.1 | E604 | P602-E604 VanDerWaalsContact C-N 3.33Å; P602-E604 PolarHBondContact O-N 2.93Å | ||
| 603 | Q | 38.2 | Very low | 41.6 | Very low | 186 Ų | 186 | 141.1 Ų | 141.1 | 87% | 0.869 | 72% | 0.722 | S | S | * | * | trans | -58.2 | 97.7 | 165.3 | -81 | -177.7 | -43.5 | 0 | 0 | 108.3 | Q601 T605 | Q601-Q603 PolarHBondContact O-N 2.84Å; Q603-T605 VanDerWaalsContact C-N 3.31Å; Q603-T605 PolarHBondContact O-N 2.74Å | ||
| 604 | E | 38.2 | Very low | 40.6 | Very low | 189 Ų | 189 | 147.2 Ų | 147.2 | 88% | 0.883 | 75% | 0.751 | S | S | * | * | trans | -64.4 | 105.1 | 152.8 | -91 | -170.8 | 156.8 | 0 | 0 | 106.8 | P602 L606 | P602-E604 VanDerWaalsContact C-N 3.33Å; P602-E604 PolarHBondContact O-N 2.93Å; E604-L606 PolarHBondContact O-N 3.46Å | ||
| 605 | T | 39.3 | Very low | 39.5 | Very low | 117 Ų | 117 | 149.5 Ų | 149.5 | 72% | 0.718 | 77% | 0.769 | S | S | * | * | trans | -41.4 | 112.8 | 176.6 | 32.8 | 0 | 0 | 0 | 0 | 112.7 | Q603 I607 | Q603-T605 VanDerWaalsContact C-N 3.31Å; Q603-T605 PolarHBondContact O-N 2.74Å; T605-I607 PolarHBondContact O-N 2.76Å | ||
| 606 | L | 37.7 | Very low | 40.2 | Very low | 176 Ų | 176 | 151.2 Ų | 151.2 | 92% | 0.921 | 79% | 0.785 | S | S | * | * | trans | -58.6 | 96.4 | 155.1 | -85.8 | 157.8 | 0 | 0 | 0 | 109.1 | E604 R608 | E604-L606 PolarHBondContact O-N 3.46Å; L606-R608 PolarHBondContact O-N 3.41Å | ||
| 607 | I | 38.9 | Very low | 39.4 | Very low | 151 Ų | 151 | 151 Ų | 151 | 77% | 0.774 | 80% | 0.798 | S | S | * | * | trans | -73 | 114.5 | 163.4 | -65.8 | 178 | 0 | 0 | 0 | 107.7 | T605 R609 | T605-I607 PolarHBondContact O-N 2.76Å; I607-R609 PolarHBondContact O-N 2.87Å | ||
| 608 | R | 39.8 | Very low | 39.1 | Very low | 237 Ų | 237 | 154.1 Ų | 154.1 | 89% | 0.894 | 81% | 0.811 | S | S | * | * | trans | -42 | 128.8 | 166.3 | -77.9 | 177.3 | 173.2 | -166.4 | -2.2 | 111.6 | L606 | L606-R608 PolarHBondContact O-N 3.41Š| ||
| 609 | R | 33.4 | Very low | 38.7 | Very low | 249 Ų | 249 | 157.4 Ų | 157.4 | 94% | 0.94 | 84% | 0.838 | S | S | * | * | trans | -119.2 | 115.4 | 138.4 | -85.7 | -172.2 | 176.5 | -177.5 | -0.4 | 108.4 | I607 | I607-R609 PolarHBondContact O-N 2.87Š| ||
| 610 | S | 33.6 | Very low | 38.2 | Very low | 101 Ų | 101 | 157.1 Ų | 157.1 | 71% | 0.706 | 84% | 0.841 | S | S | * | * | trans | -59.5 | 144 | 170.9 | 46 | 0 | 0 | 0 | 0 | 111.3 | S612 | S610-S612 PolarHBondContact O-N 2.97Š| ||
| 611 | P | 36.5 | Very low | 37.9 | Very low | 131 Ų | 131 | 161.3 Ų | 161.3 | 85% | 0.851 | 85% | 0.852 | S | S | * | * | trans | -79.7 | 109.8 | 161.6 | 30.4 | -25.2 | 0 | 0 | 0 | 108.3 | ||||
| 612 | S | 34.9 | Very low | 38 | Very low | 105 Ų | 105 | 161.8 Ų | 161.8 | 73% | 0.734 | 86% | 0.86 | S | S | * | * | trans | -76.1 | 123.1 | 164 | 47.9 | 0 | 0 | 0 | 0 | 108.9 | S610 | S610-S612 PolarHBondContact O-N 2.97Š| ||
| 613 | T | 42.5 | Very low | 37.9 | Very low | 136 Ų | 136 | 164.3 Ų | 164.3 | 83% | 0.834 | 87% | 0.865 | S | S | * | * | trans | -24.4 | 128.9 | 159.1 | 41.7 | 0 | 0 | 0 | 0 | 115.7 | ||||
| 614 | E | 34.8 | Very low | 37.8 | Very low | 195 Ų | 195 | 162.9 Ų | 162.9 | 91% | 0.911 | 86% | 0.864 | S | S | * | * | trans | -146.3 | 124.6 | 150 | -111.1 | 173.5 | -169.2 | 0 | 0 | 110.1 | ||||
| 615 | C | 33.7 | Very low | 37.8 | Very low | 128 Ų | 128 | 161.2 Ų | 161.2 | 87% | 0.865 | 86% | 0.863 | S | S | * | * | trans | -138.2 | 161.6 | 163.7 | -110.7 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 616 | P | 55.8 | Low | 37.7 | Very low | 124 Ų | 124 | 164.4 Ų | 164.4 | 81% | 0.805 | 87% | 0.873 | S | S | * | * | -104.2 | 160.7 | -129.3 | 38.1 | -36.2 | 0 | 0 | 0 | 115.3 | |||||
| 617 | A | 34.4 | Very low | 37.7 | Very low | 94 Ų | 94 | 163.5 Ų | 163.5 | 78% | 0.777 | 87% | 0.87 | S | S | * | * | trans | -158.6 | 120.6 | 157.6 | 0 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 618 | K | 37.2 | Very low | 37.6 | Very low | 211 Ų | 211 | 164.5 Ų | 164.5 | 92% | 0.917 | 88% | 0.878 | S | S | * | * | 27.6 | 104 | 87.9 | -73.9 | -175 | 178.9 | 179.9 | 0 | 110.4 | |||||
| 619 | M | 34.8 | Very low | 37.4 | Very low | 263 Ų | 263 | 157.9 Ų | 157.9 | 100% | 1.296 | 88% | 0.876 | S | S | * | * | -175.4 | 0 | 71.9 | -161.9 | 166.2 | -169.2 | 0 | 0 | 108.2 |
Retrieved 619 of 619 residues in 125.9 ms
(Link to these results)