| 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 | 38.1 | Very low | 46.8 | Very low | 246 Ų | 246 | 135.2 Ų | 135.2 | 100% | 1.212 | 77% | 0.765 | S | S | * | * | 0 | 126.3 | 0 | -78.6 | 179.3 | 171.7 | 0 | 0 | 108.8 | |||||
| 2 | A | 46.2 | Very low | 47.2 | Very low | 102 Ų | 102 | 127.6 Ų | 127.6 | 84% | 0.843 | 73% | 0.731 | S | S | * | * | trans | 45.9 | 104.2 | 164.8 | 0 | 0 | 0 | 0 | 0 | 119.7 | ||||
| 3 | R | 40 | Very low | 48.2 | Very low | 249 Ų | 249 | 121.5 Ų | 121.5 | 94% | 0.94 | 70% | 0.698 | S | S | * | * | trans | -127.9 | 124.2 | 142.5 | -81.1 | -171.2 | 174.5 | 172.3 | -1 | 108.4 | ||||
| 4 | G | 43.7 | Very low | 48.6 | Very low | 79 Ų | 79 | 114.6 Ų | 114.6 | 81% | 0.814 | 67% | 0.667 | S | S | * | * | trans | -65.3 | 134.3 | -162.3 | 0 | 0 | 0 | 0 | 0 | 114.7 | G6 | G4-G6 VanDerWaalsContact C-N 3.34Å; G4-G6 PolarHBondContact O-N 3.09Å | ||
| 5 | L | 42.5 | Very low | 49.4 | Very low | 182 Ų | 182 | 114.9 Ų | 114.9 | 95% | 0.953 | 66% | 0.663 | S | S | * | * | trans | -74.3 | 88.6 | 159.4 | -76.1 | 154.3 | 0 | 0 | 0 | 107.6 | A7 | L5-A7 PolarHBondContact O-N 3.17Š| ||
| 6 | G | 46.7 | Very low | 49.7 | Very low | 71 Ų | 71 | 115 Ų | 115 | 73% | 0.732 | 66% | 0.66 | S | S | * | * | trans | -68.2 | 113.6 | 162.6 | 0 | 0 | 0 | 0 | 0 | 108.1 | G4 | G4-G6 VanDerWaalsContact C-N 3.34Å; G4-G6 PolarHBondContact O-N 3.09Å | ||
| 7 | A | 53 | Low | 50.3 | Low | 76 Ų | 76 | 113.1 Ų | 113.1 | 63% | 0.628 | 65% | 0.651 | S | S | * | * | trans | -52.6 | 134.9 | 169.1 | 0 | 0 | 0 | 0 | 0 | 108.7 | L5 H9 | L5-A7 PolarHBondContact O-N 3.17Å; A7-H9 PolarHBondContact O-N 3.37Å | ||
| 8 | P | 60.9 | Low | 50.5 | Low | 64 Ų | 64 | 117.3 Ų | 117.3 | 42% | 0.416 | 66% | 0.655 | S | S | . | * | trans | -62.2 | 132.6 | -179.5 | 23.5 | -30.2 | 0 | 0 | 0 | 108.9 | W10 V11 | P8-W10 PolarHBondContact O-N 3.25Å; P8-V11 HydrophobicContact CG-CB 4.47Å; P8-V11 HydrophobicContact CG-CG2 3.85Å; P8-V11 PolarHBondContact O-N 3.3Å | ||
| 9 | H | 46.9 | Very low | 51.1 | Low | 138 Ų | 138 | 113.8 Ų | 113.8 | 64% | 0.639 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -44 | -29.8 | -177.2 | -171.7 | -93.8 | 0 | 0 | 0 | 113.9 | A7 A12 V13 | A7-H9 PolarHBondContact O-N 3.37Å; H9-A12 PolarHBondContact O-N 2.72Å; H9-V13 VanDerWaalsContact O-CG2 3.23Å; H9-V13 WeakPolarHBondContact O-CG2 3.16Å; H9-V13 PolarHBondContact O-N 3.46Å |
| 10 | W | 46.5 | Very low | 51.1 | Low | 202 Ų | 202 | 110.8 Ų | 110.8 | 77% | 0.765 | 63% | 0.632 | S | S | * | * | H | α-helix | trans | -74.2 | -27 | 178.1 | -59.9 | 103.1 | 0 | 0 | 0 | 115.6 | P8 A12 V13 G14 | P8-W10 PolarHBondContact O-N 3.25Å; W10-A12 VanDerWaalsContact C-N 3.35Å; W10-V13 HydrophobicContact CE3-CB 4.48Å; W10-V13 HydrophobicContact CE3-CG1 4.44Å; W10-V13 PolarHBondContact O-N 2.9Å; W10-G14 PolarHBondContact O-N 2.83Å |
| 11 | V | 50.5 | Low | 51.4 | Low | 78 Ų | 78 | 110.2 Ų | 110.2 | 47% | 0.473 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -71 | -37.5 | 171.6 | 172.5 | 0 | 0 | 0 | 0 | 109.6 | P8 L15 | P8-V11 HydrophobicContact CG-CB 4.47Å; P8-V11 HydrophobicContact CG-CG2 3.85Å; P8-V11 PolarHBondContact O-N 3.3Å; V11-L15 HydrophobicContact CG1-CD1 3.96Å; V11-L15 WeakPolarHBondContact O-CB 3.23Å; V11-L15 VanDerWaalsContact O-CG 3.29Å; V11-L15 WeakPolarHBondContact O-CG 3.22Å; V11-L15 PolarHBondContact O-N 2.8Å |
| 12 | A | 51.4 | Low | 52.4 | Low | 44 Ų | 44 | 100.5 Ų | 100.5 | 36% | 0.364 | 59% | 0.59 | S | S | . | * | H | α-helix | trans | -66.6 | -43 | 171.6 | 0 | 0 | 0 | 0 | 0 | 111.3 | H9 W10 L16 | H9-A12 PolarHBondContact O-N 2.72Å; W10-A12 VanDerWaalsContact C-N 3.35Å; A12-L16 WeakPolarHBondContact O-CB 3.33Å; A12-L16 WeakPolarHBondContact O-CD1 3.43Å; A12-L16 WeakPolarHBondContact O-CG 3.12Å; A12-L16 PolarHBondContact O-N 3.28Å |
| 13 | V | 59.9 | Low | 53 | Low | 49 Ų | 49 | 101.7 Ų | 101.7 | 30% | 0.297 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -63.4 | -42.7 | 175.2 | 172.2 | 0 | 0 | 0 | 0 | 111.4 | H9 W10 L16 T17 | H9-V13 VanDerWaalsContact O-CG2 3.23Å; H9-V13 WeakPolarHBondContact O-CG2 3.16Å; H9-V13 PolarHBondContact O-N 3.46Å; W10-V13 HydrophobicContact CE3-CB 4.48Å; W10-V13 HydrophobicContact CE3-CG1 4.44Å; W10-V13 PolarHBondContact O-N 2.9Å; V13-L16 PolarHBondContact O-N 2.85Å; V13-T17 HydrophobicContact CG1-CG2 4.44Å; V13-T17 WeakPolarHBondContact O-CB 3.42Å; V13-T17 WeakPolarHBondContact O-CG2 3.41Å; V13-T17 PolarHBondContact O-N 2.93Å; V13-T17 PolarHBondContact O-OG1 3.01Å |
| 14 | G | 53.9 | Low | 53.3 | Low | 25 Ų | 25 | 95.1 Ų | 95.1 | 26% | 0.258 | 56% | 0.564 | S | S | . | * | H | α-helix | trans | -63.1 | -47.3 | 177 | 0 | 0 | 0 | 0 | 0 | 112.7 | W10 L16 T17 W18 | W10-G14 PolarHBondContact O-N 2.83Å; G14-L16 VanDerWaalsContact C-N 3.33Å; G14-L16 PolarHBondContact O-N 2.85Å; G14-T17 VanDerWaalsContact CA-OG1 3.3Å; G14-T17 WeakPolarHBondContact CA-OG1 3.26Å; G14-T17 PolarHBondContact O-N 3.33Å; G14-T17 PolarHBondContact O-OG1 3.28Å; G14-W18 PolarHBondContact O-N 2.9Å |
| 15 | L | 60.3 | Low | 53.8 | Low | 118 Ų | 118 | 96 Ų | 96 | 62% | 0.618 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -66.1 | -35.9 | 175.5 | -71.6 | 168.8 | 0 | 0 | 0 | 112.1 | V11 A19 | V11-L15 HydrophobicContact CG1-CD1 3.96Å; V11-L15 WeakPolarHBondContact O-CB 3.23Å; V11-L15 VanDerWaalsContact O-CG 3.29Å; V11-L15 WeakPolarHBondContact O-CG 3.22Å; V11-L15 PolarHBondContact O-N 2.8Å; L15-A19 WeakPolarHBondContact O-CB 3.47Å; L15-A19 PolarHBondContact O-N 3.41Å |
| 16 | L | 55.1 | Low | 54.4 | Low | 117 Ų | 117 | 90.3 Ų | 90.3 | 61% | 0.613 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -69.4 | -36.4 | 174.9 | -77.5 | 164.5 | 0 | 0 | 0 | 112.1 | A12 V13 G14 A20 | A12-L16 WeakPolarHBondContact O-CB 3.33Å; A12-L16 WeakPolarHBondContact O-CD1 3.43Å; A12-L16 WeakPolarHBondContact O-CG 3.12Å; A12-L16 PolarHBondContact O-N 3.28Å; V13-L16 PolarHBondContact O-N 2.85Å; G14-L16 VanDerWaalsContact C-N 3.33Å; G14-L16 PolarHBondContact O-N 2.85Å; L16-A20 WeakPolarHBondContact O-CB 3.45Å; L16-A20 PolarHBondContact O-N 3.3Å |
| 17 | T | 60.3 | Low | 54.2 | Low | 82 Ų | 82 | 89.1 Ų | 89.1 | 50% | 0.503 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -68.5 | -40 | 174.3 | 45.3 | 0 | 0 | 0 | 0 | 111.6 | V13 G14 L21 | V13-T17 HydrophobicContact CG1-CG2 4.44Å; V13-T17 WeakPolarHBondContact O-CB 3.42Å; V13-T17 WeakPolarHBondContact O-CG2 3.41Å; V13-T17 PolarHBondContact O-N 2.93Å; V13-T17 PolarHBondContact O-OG1 3.01Å; G14-T17 VanDerWaalsContact CA-OG1 3.3Å; G14-T17 WeakPolarHBondContact CA-OG1 3.26Å; G14-T17 PolarHBondContact O-N 3.33Å; G14-T17 PolarHBondContact O-OG1 3.28Å; T17-L21 WeakPolarHBondContact O-CB 3.46Å; T17-L21 PolarHBondContact O-N 2.76Å |
| 18 | W | 54.1 | Low | 54 | Low | 189 Ų | 189 | 92.2 Ų | 92.2 | 72% | 0.716 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -69 | -39.4 | 175.3 | -82.4 | 107 | 0 | 0 | 0 | 112.2 | G14 L21 G22 | G14-W18 PolarHBondContact O-N 2.9Å; W18-L21 PolarHBondContact O-N 3.43Å; W18-G22 PolarHBondContact O-N 3.42Å |
| 19 | A | 60.6 | Low | 53.2 | Low | 51 Ų | 51 | 93.2 Ų | 93.2 | 42% | 0.421 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -69 | -38.5 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | L15 G22 L23 | L15-A19 WeakPolarHBondContact O-CB 3.47Å; L15-A19 PolarHBondContact O-N 3.41Å; A19-G22 PolarHBondContact O-N 3.4Å; A19-L23 WeakPolarHBondContact O-CB 3.23Å; A19-L23 WeakPolarHBondContact O-CG 3.46Å; A19-L23 PolarHBondContact O-N 3.08Å |
| 20 | A | 52 | Low | 52.9 | Low | 54 Ų | 54 | 89.6 Ų | 89.6 | 45% | 0.446 | 54% | 0.539 | S | S | . | . | H | α-helix | trans | -67 | -37.8 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | L16 L23 L24 | L16-A20 WeakPolarHBondContact O-CB 3.45Å; L16-A20 PolarHBondContact O-N 3.3Å; A20-L23 PolarHBondContact O-N 2.88Å; A20-L24 WeakPolarHBondContact O-CB 3.44Å; A20-L24 PolarHBondContact O-N 3.49Å |
| 21 | L | 56.3 | Low | 52.6 | Low | 98 Ų | 98 | 88 Ų | 88 | 51% | 0.513 | 54% | 0.54 | S | S | . | . | H | α-helix | trans | -66.1 | -43.4 | 173.6 | -166.7 | 70.6 | 0 | 0 | 0 | 111 | T17 W18 L23 L24 V25 | T17-L21 WeakPolarHBondContact O-CB 3.46Å; T17-L21 PolarHBondContact O-N 2.76Å; W18-L21 PolarHBondContact O-N 3.43Å; L21-L23 PolarHBondContact O-N 3.4Å; L21-L24 PolarHBondContact O-N 3Å; L21-V25 VanDerWaalsContact O-CG2 3.31Å; L21-V25 WeakPolarHBondContact O-CG2 3.3Å; L21-V25 PolarHBondContact O-N 3.08Å |
| 22 | G | 59.1 | Low | 52.2 | Low | 42 Ų | 42 | 91.8 Ų | 91.8 | 43% | 0.433 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -62.5 | -38.5 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | W18 A19 A26 | W18-G22 PolarHBondContact O-N 3.42Å; A19-G22 PolarHBondContact O-N 3.4Å; G22-A26 WeakPolarHBondContact O-CB 3.3Å; G22-A26 PolarHBondContact O-N 3.46Å |
| 23 | L | 59 | Low | 51.8 | Low | 127 Ų | 127 | 97.6 Ų | 97.6 | 67% | 0.665 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -72.3 | -31.4 | 175 | -84.2 | 159.4 | 0 | 0 | 0 | 113 | A19 A20 L21 G27 | A19-L23 WeakPolarHBondContact O-CB 3.23Å; A19-L23 WeakPolarHBondContact O-CG 3.46Å; A19-L23 PolarHBondContact O-N 3.08Å; A20-L23 PolarHBondContact O-N 2.88Å; L21-L23 PolarHBondContact O-N 3.4Å; L23-G27 WeakPolarHBondContact O-CA 3.38Å; L23-G27 PolarHBondContact O-N 3.4Å |
| 24 | L | 47.8 | Very low | 50.8 | Low | 111 Ų | 111 | 102.6 Ų | 102.6 | 58% | 0.581 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -69.5 | -39.7 | 174.6 | -159.3 | 111.5 | 0 | 0 | 0 | 110.9 | A20 L21 L28 | A20-L24 WeakPolarHBondContact O-CB 3.44Å; A20-L24 PolarHBondContact O-N 3.49Å; L21-L24 PolarHBondContact O-N 3Å; L24-L28 HydrophobicContact CD2-CD1 4.15Å; L24-L28 HydrophobicContact CG-CD1 4.42Å; L24-L28 WeakPolarHBondContact O-CB 3.12Å; L24-L28 WeakPolarHBondContact O-CD1 3.2Å; L24-L28 VanDerWaalsContact O-CG 3.29Å; L24-L28 WeakPolarHBondContact O-CG 3.34Å; L24-L28 PolarHBondContact O-N 3.24Å; L24-L28 VanDerWaalsContact O-N 3.1Å |
| 25 | V | 53.1 | Low | 49.9 | Very low | 99 Ų | 99 | 110.8 Ų | 110.8 | 60% | 0.6 | 64% | 0.638 | S | S | * | * | H | α-helix | trans | -65.8 | -43.8 | 173.1 | 172.4 | 0 | 0 | 0 | 0 | 111.1 | L21 A29 | L21-V25 VanDerWaalsContact O-CG2 3.31Å; L21-V25 WeakPolarHBondContact O-CG2 3.3Å; L21-V25 PolarHBondContact O-N 3.08Å; V25-A29 PolarHBondContact O-N 3.39Å |
| 26 | A | 56.2 | Low | 48.9 | Very low | 61 Ų | 61 | 111.7 Ų | 111.7 | 50% | 0.504 | 64% | 0.644 | S | S | . | * | H | α-helix | trans | -70.4 | -33.6 | 176.9 | 0 | 0 | 0 | 0 | 0 | 113.4 | G22 A29 G30 | G22-A26 WeakPolarHBondContact O-CB 3.3Å; G22-A26 PolarHBondContact O-N 3.46Å; A26-A29 PolarHBondContact O-N 3.45Å; A26-G30 PolarHBondContact O-N 2.9Å |
| 27 | G | 40.7 | Very low | 48 | Very low | 47 Ų | 47 | 112.8 Ų | 112.8 | 49% | 0.485 | 65% | 0.65 | S | S | . | * | H | α-helix | trans | -75.3 | -27.5 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.8 | L23 | L23-G27 WeakPolarHBondContact O-CA 3.38Å; L23-G27 PolarHBondContact O-N 3.4Å |
| 28 | L | 48.8 | Very low | 46.7 | Very low | 140 Ų | 140 | 117.5 Ų | 117.5 | 73% | 0.733 | 67% | 0.671 | S | S | * | * | H | α-helix | trans | -81.1 | -21.8 | 173 | -71.1 | 168.3 | 0 | 0 | 0 | 112.7 | L24 | L24-L28 HydrophobicContact CD2-CD1 4.15Å; L24-L28 HydrophobicContact CG-CD1 4.42Å; L24-L28 WeakPolarHBondContact O-CB 3.12Å; L24-L28 WeakPolarHBondContact O-CD1 3.2Å; L24-L28 VanDerWaalsContact O-CG 3.29Å; L24-L28 WeakPolarHBondContact O-CG 3.34Å; L24-L28 PolarHBondContact O-N 3.24Å; L24-L28 VanDerWaalsContact O-N 3.1Å |
| 29 | A | 44.5 | Very low | 46 | Very low | 86 Ų | 86 | 116.4 Ų | 116.4 | 71% | 0.711 | 67% | 0.674 | S | S | * | * | S | Bend | trans | -82.8 | -11.2 | 171.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | V25 A26 | V25-A29 PolarHBondContact O-N 3.39Å; A26-A29 PolarHBondContact O-N 3.45Å |
| 30 | G | 41.8 | Very low | 44.7 | Very low | 61 Ų | 61 | 123.1 Ų | 123.1 | 63% | 0.629 | 70% | 0.697 | S | S | * | * | S | Bend | trans | -104.3 | 19.5 | -173.3 | 0 | 0 | 0 | 0 | 0 | 115.5 | A26 | A26-G30 PolarHBondContact O-N 2.9Š|
| 31 | H | 40.4 | Very low | 43.8 | Very low | 169 Ų | 169 | 126.8 Ų | 126.8 | 78% | 0.782 | 71% | 0.709 | S | S | * | * | trans | -128.9 | 36.1 | -174.9 | -133.8 | -85.7 | 0 | 0 | 0 | 114.2 | ||||
| 32 | D | 41.9 | Very low | 42.5 | Very low | 158 Ų | 158 | 132 Ų | 132 | 85% | 0.845 | 73% | 0.728 | S | S | * | * | trans | -118.8 | 82.2 | 161 | -82.3 | -34.3 | 0 | 0 | 0 | 108.6 | ||||
| 33 | D | 42.8 | Very low | 41.3 | Very low | 165 Ų | 165 | 138.5 Ų | 138.5 | 88% | 0.882 | 75% | 0.746 | S | S | * | * | trans | -159.9 | 83.1 | 159.9 | -96.3 | -30 | 0 | 0 | 0 | 108.6 | ||||
| 34 | L | 37.5 | Very low | 40 | Very low | 155 Ų | 155 | 135.1 Ų | 135.1 | 81% | 0.812 | 74% | 0.742 | S | S | * | * | trans | -171.4 | 101.4 | 139.7 | -154.7 | 76.3 | 0 | 0 | 0 | 109.4 | ||||
| 35 | H | 36.8 | Very low | 39.3 | Very low | 197 Ų | 197 | 138.8 Ų | 138.8 | 91% | 0.912 | 76% | 0.756 | S | S | * | * | trans | -159.4 | 111.8 | 138.8 | -99.5 | -64.2 | 0 | 0 | 0 | 109.9 | ||||
| 36 | D | 37.8 | Very low | 38.2 | Very low | 137 Ų | 137 | 139 Ų | 139 | 73% | 0.733 | 76% | 0.762 | S | S | * | * | trans | -59.1 | 155.8 | 169.3 | -104.4 | -28.9 | 0 | 0 | 0 | 112.8 | ||||
| 37 | D | 37.3 | Very low | 37.2 | Very low | 140 Ų | 140 | 144 Ų | 144 | 75% | 0.749 | 78% | 0.775 | S | S | * | * | trans | 65.4 | 107.2 | 154.3 | -60.4 | -32.4 | 0 | 0 | 0 | 118.4 | ||||
| 38 | L | 32.3 | Very low | 36.5 | Very low | 181 Ų | 181 | 152.8 Ų | 152.8 | 95% | 0.948 | 79% | 0.793 | S | S | * | * | -158.2 | 117.3 | 117.5 | -99.6 | 167.9 | 0 | 0 | 0 | 110.9 | |||||
| 39 | Q | 38.7 | Very low | 35.8 | Very low | 166 Ų | 166 | 153.9 Ų | 153.9 | 78% | 0.776 | 79% | 0.794 | S | S | * | * | trans | -68.2 | 122.9 | 173.9 | 178.4 | 172.1 | 3.3 | 0 | 0 | 110.6 | ||||
| 40 | E | 33.7 | Very low | 35.1 | Very low | 192 Ų | 192 | 154.5 Ų | 154.5 | 90% | 0.897 | 79% | 0.793 | S | S | * | * | trans | -136.6 | 134.1 | 154.2 | -80 | -151.6 | 159.6 | 0 | 0 | 111.5 | ||||
| 41 | D | 34.1 | Very low | 34.9 | Very low | 130 Ų | 130 | 160.5 Ų | 160.5 | 70% | 0.695 | 80% | 0.804 | S | S | * | * | trans | -71 | 121.8 | -163.2 | -65.5 | -54.4 | 0 | 0 | 0 | 113.9 | ||||
| 42 | F | 28.2 | Very low | 34.6 | Very low | 208 Ų | 208 | 160.5 Ų | 160.5 | 91% | 0.912 | 81% | 0.805 | S | S | * | * | trans | -95.8 | 101.3 | 162.5 | -110.4 | -91.4 | 0 | 0 | 0 | 110 | ||||
| 43 | H | 35.1 | Very low | 34.4 | Very low | 178 Ų | 178 | 159.1 Ų | 159.1 | 82% | 0.824 | 80% | 0.798 | S | S | * | * | trans | -76.1 | 121.3 | 162.8 | -79.8 | -48.2 | 0 | 0 | 0 | 109.9 | ||||
| 44 | G | 30.4 | Very low | 33.9 | Very low | 56 Ų | 56 | 159.8 Ų | 159.8 | 58% | 0.577 | 79% | 0.793 | S | S | * | * | trans | -78.6 | 177.7 | -174.5 | 0 | 0 | 0 | 0 | 0 | 115.3 | ||||
| 45 | H | 33.3 | Very low | 33.9 | Very low | 188 Ų | 188 | 159.2 Ų | 159.2 | 87% | 0.87 | 79% | 0.786 | S | S | * | * | trans | -157.6 | 117.3 | 133.4 | -89.7 | -61.2 | 0 | 0 | 0 | 109.4 | ||||
| 46 | S | 30.3 | Very low | 34.1 | Very low | 104 Ų | 104 | 158.6 Ų | 158.6 | 73% | 0.727 | 78% | 0.783 | S | S | * | * | trans | -79.4 | 133.9 | 168.7 | 59.8 | 0 | 0 | 0 | 0 | 110.4 | ||||
| 47 | H | 34.1 | Very low | 33.9 | Very low | 166 Ų | 166 | 155.1 Ų | 155.1 | 77% | 0.769 | 78% | 0.779 | S | S | * | * | trans | -137.5 | 112.2 | 149 | -86.8 | -74.4 | 0 | 0 | 0 | 110.1 | ||||
| 48 | R | 27 | Very low | 34 | Very low | 232 Ų | 232 | 156.6 Ų | 156.6 | 88% | 0.875 | 78% | 0.781 | S | S | * | * | trans | -102 | 122.3 | 171.7 | -168.8 | -177.3 | -172.6 | -172.1 | 2.4 | 105.8 | ||||
| 49 | H | 34.7 | Very low | 34.2 | Very low | 163 Ų | 163 | 153.1 Ų | 153.1 | 76% | 0.755 | 77% | 0.772 | S | S | * | * | trans | -128.7 | 110.8 | 164.1 | -82.8 | -72.9 | 0 | 0 | 0 | 109.4 | ||||
| 50 | S | 29.2 | Very low | 34.3 | Very low | 98 Ų | 98 | 153.8 Ų | 153.8 | 69% | 0.685 | 78% | 0.775 | S | S | * | * | trans | -82.7 | 135.1 | 162.7 | 54.3 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 51 | H | 38.4 | Very low | 34.3 | Very low | 187 Ų | 187 | 148.4 Ų | 148.4 | 87% | 0.866 | 76% | 0.763 | S | S | * | * | trans | -146.4 | 121.2 | 149.7 | -93.2 | -75.7 | 0 | 0 | 0 | 109 | ||||
| 52 | E | 32.8 | Very low | 34.6 | Very low | 169 Ų | 169 | 151.9 Ų | 151.9 | 79% | 0.79 | 77% | 0.774 | S | S | * | * | trans | -83.5 | 152 | 167.6 | -77 | 178.2 | 149.8 | 0 | 0 | 110.8 | ||||
| 53 | D | 37.7 | Very low | 34.8 | Very low | 130 Ų | 130 | 145.3 Ų | 145.3 | 70% | 0.695 | 77% | 0.766 | S | S | * | * | trans | 66.3 | 117.4 | 152.1 | -49.7 | -26 | 0 | 0 | 0 | 121.7 | ||||
| 54 | F | 31.8 | Very low | 35.1 | Very low | 179 Ų | 179 | 146.1 Ų | 146.1 | 79% | 0.785 | 77% | 0.769 | S | S | * | * | 179.2 | 121.5 | 96.5 | -120.9 | -106.7 | 0 | 0 | 0 | 111.9 | |||||
| 55 | H | 37.4 | Very low | 35.1 | Very low | 143 Ų | 143 | 147 Ų | 147 | 66% | 0.662 | 78% | 0.779 | S | S | * | * | trans | 26.6 | 127.7 | 148.4 | -60.7 | -91.8 | 0 | 0 | 0 | 122.2 | ||||
| 56 | H | 41.7 | Very low | 35.4 | Very low | 184 Ų | 184 | 146.3 Ų | 146.3 | 85% | 0.852 | 78% | 0.776 | S | S | * | * | -167 | 120.8 | 112.2 | -93.2 | -63 | 0 | 0 | 0 | 110.4 | |||||
| 57 | G | 32.9 | Very low | 35.4 | Very low | 63 Ų | 63 | 147.3 Ų | 147.3 | 65% | 0.649 | 78% | 0.778 | S | S | * | * | trans | -89.9 | 145.2 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | ||||
| 58 | H | 40.4 | Very low | 35.6 | Very low | 171 Ų | 171 | 147.1 Ų | 147.1 | 79% | 0.792 | 78% | 0.777 | S | S | * | * | trans | -147.6 | 115.5 | 153.1 | -82.3 | -66 | 0 | 0 | 0 | 109.9 | ||||
| 59 | S | 36.9 | Very low | 35.9 | Very low | 108 Ų | 108 | 144 Ų | 144 | 76% | 0.755 | 77% | 0.772 | S | S | * | * | trans | -79.8 | 136 | 166.3 | 51.7 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 60 | H | 39.3 | Very low | 36 | Very low | 181 Ų | 181 | 141 Ų | 141 | 84% | 0.838 | 77% | 0.769 | S | S | * | * | trans | -137.8 | 115.8 | 157.4 | -81 | -72.6 | 0 | 0 | 0 | 110.7 | ||||
| 61 | A | 35 | Very low | 36.3 | Very low | 78 Ų | 78 | 143.1 Ų | 143.1 | 65% | 0.645 | 77% | 0.772 | S | S | * | * | trans | -118.4 | 171.9 | 160.7 | 0 | 0 | 0 | 0 | 0 | 108.3 | ||||
| 62 | H | 39.3 | Very low | 36 | Very low | 203 Ų | 203 | 144.6 Ų | 144.6 | 94% | 0.94 | 77% | 0.77 | S | S | * | * | trans | 89.6 | 131.2 | -171.6 | -49.7 | -64.2 | 0 | 0 | 0 | 112.8 | ||||
| 63 | G | 33.5 | Very low | 36.4 | Very low | 71 Ų | 71 | 145.2 Ų | 145.2 | 73% | 0.732 | 77% | 0.772 | S | S | * | * | cis | 146 | 134 | 14 | 0 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 64 | H | 40.5 | Very low | 36.1 | Very low | 194 Ų | 194 | 142 Ų | 142 | 90% | 0.898 | 77% | 0.77 | S | S | * | * | trans | -53.3 | 158 | -171.6 | -69.8 | -91.2 | 0 | 0 | 0 | 117.4 | ||||
| 65 | G | 31.8 | Very low | 36.4 | Very low | 76 Ų | 76 | 142.1 Ų | 142.1 | 78% | 0.784 | 77% | 0.773 | S | S | * | * | trans | 166.8 | 119 | 153.1 | 0 | 0 | 0 | 0 | 0 | 115.5 | ||||
| 66 | H | 37.8 | Very low | 36.3 | Very low | 172 Ų | 172 | 141.5 Ų | 141.5 | 80% | 0.796 | 78% | 0.779 | S | S | * | * | trans | -81.9 | 161.7 | -178 | -61.3 | -94.2 | 0 | 0 | 0 | 114.2 | ||||
| 67 | T | 32 | Very low | 36.7 | Very low | 125 Ų | 125 | 141.3 Ų | 141.3 | 77% | 0.767 | 78% | 0.778 | S | S | * | * | 141.4 | 129.6 | 114.9 | 57.5 | 0 | 0 | 0 | 0 | 116.1 | |||||
| 68 | H | 36.7 | Very low | 36.9 | Very low | 162 Ų | 162 | 142 Ų | 142 | 75% | 0.75 | 79% | 0.786 | S | S | * | * | trans | 46 | 130 | 141.9 | -73.7 | -89.5 | 0 | 0 | 0 | 125.6 | ||||
| 69 | E | 33.1 | Very low | 37.1 | Very low | 166 Ų | 166 | 141.7 Ų | 141.7 | 78% | 0.776 | 78% | 0.784 | S | S | * | * | trans | 57.6 | 117.1 | 134.5 | -69.3 | -172.5 | -174.4 | 0 | 0 | 121 | ||||
| 70 | S | 37.6 | Very low | 37.1 | Very low | 100 Ų | 100 | 144.4 Ų | 144.4 | 70% | 0.699 | 79% | 0.79 | S | S | * | * | 152.7 | 153.7 | 96.2 | 61.4 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 71 | I | 35.7 | Very low | 37.4 | Very low | 144 Ų | 144 | 143.4 Ų | 143.4 | 74% | 0.738 | 79% | 0.785 | S | S | * | * | trans | 91.9 | 94.2 | 152.8 | -63.5 | 156 | 0 | 0 | 0 | 119.3 | ||||
| 72 | W | 32.9 | Very low | 37.2 | Very low | 217 Ų | 217 | 143.3 Ų | 143.3 | 82% | 0.822 | 79% | 0.792 | S | S | * | * | 34.6 | 144.3 | 128.6 | -62.9 | 101.9 | 0 | 0 | 0 | 125 | |||||
| 73 | H | 40.7 | Very low | 37.3 | Very low | 183 Ų | 183 | 142 Ų | 142 | 85% | 0.847 | 79% | 0.786 | S | S | * | * | trans | 90.5 | 132.6 | 160.1 | -54.4 | -52.4 | 0 | 0 | 0 | 115.6 | ||||
| 74 | G | 31.4 | Very low | 37.3 | Very low | 63 Ų | 63 | 143.1 Ų | 143.1 | 65% | 0.649 | 78% | 0.783 | S | S | * | * | cis | 171.5 | 156.8 | 4.5 | 0 | 0 | 0 | 0 | 0 | 108 | ||||
| 75 | H | 37.1 | Very low | 37.3 | Very low | 181 Ų | 181 | 141 Ų | 141 | 84% | 0.838 | 77% | 0.773 | S | S | * | * | trans | 17 | 139.4 | 152.2 | -62.8 | -51.9 | 0 | 0 | 0 | 119.3 | ||||
| 76 | T | 37 | Very low | 37.4 | Very low | 130 Ų | 130 | 144.7 Ų | 144.7 | 80% | 0.798 | 77% | 0.77 | S | S | * | * | cis | 179.4 | 162.8 | 35.8 | 10.7 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 77 | H | 49 | Very low | 37.8 | Very low | 180 Ų | 180 | 144.4 Ų | 144.4 | 83% | 0.833 | 77% | 0.774 | S | S | * | * | trans | -64.3 | 146.7 | 171.9 | -67.9 | -90.5 | 0 | 0 | 0 | 113.8 | ||||
| 78 | G | 36.9 | Very low | 37.9 | Very low | 78 Ų | 78 | 144.4 Ų | 144.4 | 80% | 0.804 | 77% | 0.769 | S | S | * | * | trans | -144.5 | 107.1 | 161.7 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 79 | H | 45.8 | Very low | 38.2 | Very low | 163 Ų | 163 | 146.4 Ų | 146.4 | 76% | 0.755 | 78% | 0.778 | S | S | * | * | trans | -79 | 138.8 | 162.9 | -79.6 | -89.6 | 0 | 0 | 0 | 108.6 | ||||
| 80 | D | 35.6 | Very low | 38.6 | Very low | 165 Ų | 165 | 146.7 Ų | 146.7 | 88% | 0.882 | 78% | 0.779 | S | S | * | * | trans | -152.4 | 143.4 | 142.4 | -133.4 | -19 | 0 | 0 | 0 | 112.3 | ||||
| 81 | H | 46 | Very low | 38.4 | Very low | 160 Ų | 160 | 144.8 Ų | 144.8 | 74% | 0.741 | 78% | 0.775 | S | S | * | * | trans | -103 | 151.3 | -175.9 | -78.7 | -84.7 | 0 | 0 | 0 | 110.8 | ||||
| 82 | G | 31.7 | Very low | 38.7 | Very low | 76 Ų | 76 | 146.4 Ų | 146.4 | 78% | 0.784 | 78% | 0.779 | S | S | * | * | trans | 179.1 | 108.7 | 165.8 | 0 | 0 | 0 | 0 | 0 | 114.9 | ||||
| 83 | H | 40.1 | Very low | 38.9 | Very low | 177 Ų | 177 | 141.3 Ų | 141.3 | 82% | 0.819 | 78% | 0.777 | S | S | * | * | trans | -68.3 | 158.9 | -180 | -56.6 | -91 | 0 | 0 | 0 | 113 | ||||
| 84 | S | 33.8 | Very low | 39 | Very low | 94 Ų | 94 | 140.3 Ų | 140.3 | 66% | 0.657 | 77% | 0.772 | S | S | * | * | 167.1 | 149.7 | 65.3 | 43.2 | 0 | 0 | 0 | 0 | 106.6 | |||||
| 85 | H | 41.8 | Very low | 39.1 | Very low | 150 Ų | 150 | 140.5 Ų | 140.5 | 69% | 0.694 | 77% | 0.774 | S | S | * | * | -170.9 | 127.7 | 86.9 | -90.7 | -86.7 | 0 | 0 | 0 | 107.5 | |||||
| 86 | E | 33.5 | Very low | 39.3 | Very low | 153 Ų | 153 | 139.4 Ų | 139.4 | 72% | 0.715 | 77% | 0.769 | S | S | * | * | 63.3 | 106.4 | 99.9 | -67.1 | -178.1 | 149.2 | 0 | 0 | 114.7 | |||||
| 87 | D | 45.6 | Very low | 39.2 | Very low | 166 Ų | 166 | 138.3 Ų | 138.3 | 89% | 0.888 | 77% | 0.767 | S | S | * | * | -159.7 | 131.4 | 122.7 | -93.2 | -32.2 | 0 | 0 | 0 | 111 | |||||
| 88 | L | 34.7 | Very low | 38.7 | Very low | 124 Ų | 124 | 138.7 Ų | 138.7 | 65% | 0.649 | 77% | 0.769 | S | S | * | * | trans | -69.9 | 147.1 | -177.9 | -74.5 | 80.9 | 0 | 0 | 0 | 112 | ||||
| 89 | H | 42.3 | Very low | 38.5 | Very low | 204 Ų | 204 | 143.6 Ų | 143.6 | 94% | 0.944 | 77% | 0.771 | S | S | * | * | -161.9 | 129.1 | 128.3 | -86.3 | -61 | 0 | 0 | 0 | 110.6 | |||||
| 90 | H | 41.1 | Very low | 38.1 | Very low | 173 Ų | 173 | 140.2 Ų | 140.2 | 80% | 0.801 | 77% | 0.766 | S | S | * | * | trans | -101.3 | 154.2 | -174.8 | -81.1 | -75 | 0 | 0 | 0 | 113.5 | ||||
| 91 | G | 33.2 | Very low | 38.1 | Very low | 60 Ų | 60 | 139 Ų | 139 | 62% | 0.619 | 76% | 0.758 | S | S | * | * | trans | 89.3 | 141.2 | 143.5 | 0 | 0 | 0 | 0 | 0 | 116.8 | ||||
| 92 | H | 42.1 | Very low | 37.5 | Very low | 177 Ų | 177 | 139.5 Ų | 139.5 | 82% | 0.819 | 76% | 0.759 | S | S | * | * | cis | -157.4 | 152.3 | 12.7 | -80.4 | -79.8 | 0 | 0 | 0 | 111.4 | ||||
| 93 | S | 37 | Very low | 37.8 | Very low | 111 Ų | 111 | 144.2 Ų | 144.2 | 78% | 0.776 | 76% | 0.76 | S | S | * | * | trans | -85.1 | 145.7 | 165.6 | 46.8 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 94 | H | 42.6 | Very low | 37.5 | Very low | 161 Ų | 161 | 147.2 Ų | 147.2 | 75% | 0.745 | 76% | 0.764 | S | S | * | * | trans | -131.6 | 117.2 | 164.4 | -82.5 | -78.5 | 0 | 0 | 0 | 110.1 | H96 | H94-H96 AromaticContact ND1-NE2 3.47Å; H94-H96 PolarHBondContact ND1-NE2 3.18Å | ||
| 95 | G | 33.3 | Very low | 37.6 | Very low | 68 Ų | 68 | 145.9 Ų | 145.9 | 70% | 0.701 | 77% | 0.765 | S | S | * | * | trans | -108 | 138.3 | 158.1 | 0 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 96 | H | 41.2 | Very low | 37.7 | Very low | 158 Ų | 158 | 147.7 Ų | 147.7 | 73% | 0.731 | 77% | 0.773 | S | S | * | * | trans | -140.3 | 113.9 | 166.8 | -73.4 | -68.8 | 0 | 0 | 0 | 109.8 | H94 | H94-H96 AromaticContact ND1-NE2 3.47Å; H94-H96 PolarHBondContact ND1-NE2 3.18Å | ||
| 97 | S | 35.9 | Very low | 37.9 | Very low | 107 Ų | 107 | 143.5 Ų | 143.5 | 75% | 0.748 | 77% | 0.771 | S | S | * | * | trans | -82.9 | 140.5 | 153.3 | 44.9 | 0 | 0 | 0 | 0 | 108.5 | ||||
| 98 | H | 38.5 | Very low | 37.8 | Very low | 188 Ų | 188 | 143.9 Ų | 143.9 | 87% | 0.87 | 77% | 0.767 | S | S | * | * | trans | -159.8 | 133.2 | 150.1 | -92.5 | -67.4 | 0 | 0 | 0 | 110.5 | ||||
| 99 | E | 33.7 | Very low | 37.9 | Very low | 180 Ų | 180 | 145.4 Ų | 145.4 | 84% | 0.841 | 78% | 0.776 | S | S | * | * | trans | -104.4 | 138.8 | 178 | -145.9 | -171.2 | -177.3 | 0 | 0 | 110.1 | ||||
| 100 | S | 36.4 | Very low | 38 | Very low | 93 Ų | 93 | 143.7 Ų | 143.7 | 65% | 0.65 | 77% | 0.768 | S | S | * | * | trans | 66.6 | 114.1 | 147.5 | 88.2 | 0 | 0 | 0 | 0 | 121.4 | ||||
| 101 | L | 34.7 | Very low | 38 | Very low | 138 Ų | 138 | 144.1 Ų | 144.1 | 72% | 0.723 | 77% | 0.77 | S | S | * | * | 150.6 | 133.4 | 105.5 | -89.3 | 163 | 0 | 0 | 0 | 115.4 | |||||
| 102 | F | 35 | Very low | 38.4 | Very low | 172 Ų | 172 | 149 Ų | 149 | 75% | 0.754 | 78% | 0.777 | S | S | * | * | trans | 68.4 | 111.1 | 158.8 | -68 | -68.5 | 0 | 0 | 0 | 122.3 | ||||
| 103 | H | 37.9 | Very low | 38.5 | Very low | 175 Ų | 175 | 145.7 Ų | 145.7 | 81% | 0.81 | 77% | 0.774 | S | S | * | * | 177.4 | 120.4 | 111.4 | -91.5 | -61.1 | 0 | 0 | 0 | 110.1 | |||||
| 104 | R | 32.7 | Very low | 38.9 | Very low | 239 Ų | 239 | 148.2 Ų | 148.2 | 90% | 0.902 | 77% | 0.773 | S | S | * | * | 77.7 | 113 | 101 | -161.5 | 118.7 | -177.7 | 170.7 | -0.5 | 113 | |||||
| 105 | G | 35.4 | Very low | 38.5 | Very low | 66 Ų | 66 | 143 Ų | 143 | 68% | 0.68 | 76% | 0.762 | S | S | * | * | trans | -83.2 | 178.3 | -166 | 0 | 0 | 0 | 0 | 0 | 117.4 | ||||
| 106 | H | 44.4 | Very low | 38.9 | Very low | 188 Ų | 188 | 143.5 Ų | 143.5 | 87% | 0.87 | 77% | 0.767 | S | S | * | * | trans | -144.6 | 126.7 | 151.6 | -93.4 | -71 | 0 | 0 | 0 | 107.9 | ||||
| 107 | G | 37.2 | Very low | 38.8 | Very low | 65 Ų | 65 | 145.6 Ų | 145.6 | 67% | 0.67 | 77% | 0.77 | S | S | * | * | trans | -81.7 | 151 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 108 | H | 43.6 | Very low | 39.4 | Very low | 175 Ų | 175 | 144.1 Ų | 144.1 | 81% | 0.81 | 77% | 0.772 | S | S | * | * | trans | -133.6 | 113.1 | 154 | -80.4 | -74.4 | 0 | 0 | 0 | 107.5 | ||||
| 109 | D | 38 | Very low | 39.6 | Very low | 155 Ų | 155 | 143.3 Ų | 143.3 | 83% | 0.829 | 77% | 0.768 | S | S | * | * | trans | -68.8 | 129.5 | 167.9 | -62.7 | -54.9 | 0 | 0 | 0 | 109.2 | ||||
| 110 | H | 44.6 | Very low | 40.1 | Very low | 168 Ų | 168 | 141 Ų | 141 | 78% | 0.778 | 77% | 0.772 | S | S | * | * | trans | -133.1 | 111.7 | 149.2 | -80.8 | -65.9 | 0 | 0 | 0 | 108.3 | H112 | H110-H112 PolarHBondContact O-N 3.16Š| ||
| 111 | E | 41.6 | Very low | 40.5 | Very low | 182 Ų | 182 | 138.3 Ų | 138.3 | 85% | 0.85 | 76% | 0.759 | S | S | * | * | trans | -51.9 | 123.2 | 166.8 | -83.1 | 167.6 | 93.9 | 0 | 0 | 110.9 | ||||
| 112 | H | 41 | Very low | 41.1 | Very low | 163 Ų | 163 | 134 Ų | 134 | 76% | 0.755 | 74% | 0.743 | S | S | * | * | trans | -126 | 96.9 | 146.1 | -75 | -69.4 | 0 | 0 | 0 | 108.7 | H110 H114 | H110-H112 PolarHBondContact O-N 3.16Å; H112-H114 PolarHBondContact O-N 3.05Å | ||
| 113 | S | 44.7 | Very low | 42.1 | Very low | 107 Ų | 107 | 130.7 Ų | 130.7 | 75% | 0.748 | 74% | 0.739 | S | S | * | * | trans | -59 | 109.2 | 158.1 | 161.8 | 0 | 0 | 0 | 0 | 109 | ||||
| 114 | H | 44.9 | Very low | 43 | Very low | 165 Ų | 165 | 124 Ų | 124 | 76% | 0.764 | 72% | 0.718 | S | S | * | * | trans | -124 | 113.5 | 151.6 | -78.7 | -70.3 | 0 | 0 | 0 | 108.9 | H112 | H112-H114 PolarHBondContact O-N 3.05Š| ||
| 115 | G | 32.9 | Very low | 44.3 | Very low | 50 Ų | 50 | 117.8 Ų | 117.8 | 52% | 0.515 | 70% | 0.701 | S | S | . | * | trans | -56.6 | 144.5 | 178.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | Y117 | G115-Y117 PolarHBondContact O-N 3.42Š| ||
| 116 | G | 42.1 | Very low | 45.4 | Very low | 79 Ų | 79 | 121 Ų | 121 | 81% | 0.814 | 70% | 0.697 | S | S | * | * | trans | -64.3 | 128.2 | 168.6 | 0 | 0 | 0 | 0 | 0 | 111 | ||||
| 117 | Y | 39.6 | Very low | 46.3 | Very low | 203 Ų | 203 | 118.6 Ų | 118.6 | 80% | 0.796 | 69% | 0.686 | S | S | * | * | trans | -135.3 | 109.3 | 140.6 | 7 | -86.7 | 0 | 0 | 0 | 104.8 | G115 E119 | G115-Y117 PolarHBondContact O-N 3.42Å; Y117-E119 PolarHBondContact O-N 2.85Å | ||
| 118 | G | 47.9 | Very low | 47.7 | Very low | 75 Ų | 75 | 120.7 Ų | 120.7 | 77% | 0.773 | 68% | 0.682 | S | S | * | * | trans | -66.6 | 122.7 | 171 | 0 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 119 | E | 43.6 | Very low | 48.6 | Very low | 172 Ų | 172 | 117.5 Ų | 117.5 | 80% | 0.804 | 67% | 0.67 | S | S | * | * | trans | -128.7 | 82.7 | 148.7 | -88.4 | -165.6 | 114 | 0 | 0 | 108.1 | Y117 G121 | Y117-E119 PolarHBondContact O-N 2.85Å; E119-G121 PolarHBondContact O-N 2.87Å | ||
| 120 | S | 43.6 | Very low | 50.7 | Low | 131 Ų | 131 | 116 Ų | 116 | 92% | 0.916 | 66% | 0.662 | S | S | * | * | trans | -65.5 | 66.7 | 154.7 | -47.5 | 0 | 0 | 0 | 0 | 108.6 | A122 | S120-A122 PolarHBondContact O-N 3.39Š| ||
| 121 | G | 44.5 | Very low | 52.5 | Low | 37 Ų | 37 | 110 Ų | 110 | 38% | 0.381 | 64% | 0.641 | S | S | . | * | trans | -72.8 | 115 | 170.5 | 0 | 0 | 0 | 0 | 0 | 108.6 | E119 | E119-G121 PolarHBondContact O-N 2.87Š| ||
| 122 | A | 47.9 | Very low | 54.7 | Low | 47 Ų | 47 | 106 Ų | 106 | 39% | 0.388 | 63% | 0.63 | S | S | . | * | trans | -48 | 129.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | S120 G124 I125 | S120-A122 PolarHBondContact O-N 3.39Å; A122-G124 PolarHBondContact O-N 3.01Å; A122-G124 VanDerWaalsContact O-N 3.1Å; A122-I125 HydrophobicContact CB-CB 4.44Å; A122-I125 HydrophobicContact CB-CD1 3.94Å; A122-I125 HydrophobicContact CB-CG1 4.01Å; A122-I125 PolarHBondContact O-N 2.82Å | ||
| 123 | P | 55.7 | Low | 57 | Low | 102 Ų | 102 | 101.2 Ų | 101.2 | 66% | 0.662 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -53 | -35.5 | -178.4 | -25.5 | 31.8 | 0 | 0 | 0 | 113.3 | Q127 | P123-Q127 WeakPolarHBondContact O-CG 3.5Å; P123-Q127 PolarHBondContact O-N 3.22Å |
| 124 | G | 57.5 | Low | 59.2 | Low | 36 Ų | 36 | 98 Ų | 98 | 37% | 0.371 | 59% | 0.586 | S | S | . | * | H | α-helix | trans | -68.8 | -33.6 | 178.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | A122 D128 | A122-G124 PolarHBondContact O-N 3.01Å; A122-G124 VanDerWaalsContact O-N 3.1Å; G124-D128 VanDerWaalsContact O-CB 3.26Å; G124-D128 WeakPolarHBondContact O-CB 3.29Å; G124-D128 VanDerWaalsContact O-CG 3.24Å; G124-D128 PolarHBondContact O-N 3.34Å |
| 125 | I | 60.2 | Low | 61.5 | Low | 108 Ų | 108 | 94.2 Ų | 94.2 | 55% | 0.554 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -71.2 | -42.4 | -178 | -64.4 | 176.4 | 0 | 0 | 0 | 110.4 | A122 L129 | A122-I125 HydrophobicContact CB-CB 4.44Å; A122-I125 HydrophobicContact CB-CD1 3.94Å; A122-I125 HydrophobicContact CB-CG1 4.01Å; A122-I125 PolarHBondContact O-N 2.82Å; I125-L129 HydrophobicContact CG2-CD1 3.53Å; I125-L129 WeakPolarHBondContact O-CB 3.23Å; I125-L129 WeakPolarHBondContact O-CD1 3.38Å; I125-L129 PolarHBondContact O-N 2.98Å |
| 126 | K | 58.9 | Low | 64.4 | Low | 134 Ų | 134 | 94.7 Ų | 94.7 | 58% | 0.583 | 56% | 0.564 | S | S | * | * | H | α-helix | trans | -68 | -39 | 177.9 | -70.5 | -173.6 | 176.8 | -176.7 | 0 | 112.2 | D130 | K126-D130 WeakPolarHBondContact O-CB 3.35Å; K126-D130 PolarHBondContact O-N 3.49Å |
| 127 | Q | 63.3 | Low | 66.9 | Low | 137 Ų | 137 | 96.1 Ų | 96.1 | 64% | 0.64 | 55% | 0.545 | S | S | * | . | H | α-helix | trans | -67.7 | -41 | 176.1 | -73.2 | 177 | -26.7 | 0 | 0 | 112.5 | P123 D130 A131 | P123-Q127 WeakPolarHBondContact O-CG 3.5Å; P123-Q127 PolarHBondContact O-N 3.22Å; Q127-D130 PolarHBondContact O-N 2.77Å; Q127-A131 WeakPolarHBondContact O-CB 3.38Å; Q127-A131 PolarHBondContact O-N 2.95Å |
| 128 | D | 65.1 | Low | 69.4 | Low | 109 Ų | 109 | 86.4 Ų | 86.4 | 58% | 0.583 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -67 | -40.2 | 175.8 | -77 | -17.3 | 0 | 0 | 0 | 111.7 | G124 D130 A131 V132 | G124-D128 VanDerWaalsContact O-CB 3.26Å; G124-D128 WeakPolarHBondContact O-CB 3.29Å; G124-D128 VanDerWaalsContact O-CG 3.24Å; G124-D128 PolarHBondContact O-N 3.34Å; D128-D130 VanDerWaalsContact C-N 3.33Å; D128-D130 PolarHBondContact O-N 2.98Å; D128-A131 PolarHBondContact O-N 2.85Å; D128-V132 WeakPolarHBondContact O-CB 3.33Å; D128-V132 WeakPolarHBondContact O-CG2 3.42Å; D128-V132 PolarHBondContact O-N 3.33Å |
| 129 | L | 63.4 | Low | 71.7 | Confident | 108 Ų | 108 | 85.5 Ų | 85.5 | 57% | 0.565 | 49% | 0.485 | S | S | * | . | H | α-helix | trans | -63.3 | -38.8 | 174 | -92.3 | 92.3 | 0 | 0 | 0 | 111.9 | I125 T133 | I125-L129 HydrophobicContact CG2-CD1 3.53Å; I125-L129 WeakPolarHBondContact O-CB 3.23Å; I125-L129 WeakPolarHBondContact O-CD1 3.38Å; I125-L129 PolarHBondContact O-N 2.98Å; L129-T133 WeakPolarHBondContact O-CB 3.3Å; L129-T133 PolarHBondContact O-N 2.81Å; L129-T133 PolarHBondContact O-OG1 3.23Å |
| 130 | D | 81.6 | Confident | 74.2 | Confident | 122 Ų | 122 | 79.3 Ų | 79.3 | 65% | 0.652 | 47% | 0.467 | S | S | * | . | H | α-helix | trans | -68 | -42.3 | 176.6 | -117.8 | 17.4 | 0 | 0 | 0 | 111.7 | K126 Q127 D128 T133 L134 | K126-D130 WeakPolarHBondContact O-CB 3.35Å; K126-D130 PolarHBondContact O-N 3.49Å; Q127-D130 PolarHBondContact O-N 2.77Å; D128-D130 VanDerWaalsContact C-N 3.33Å; D128-D130 PolarHBondContact O-N 2.98Å; D130-T133 PolarHBondContact O-N 2.95Å; D130-L134 VanDerWaalsContact O-CB 3.3Å; D130-L134 WeakPolarHBondContact O-CB 3.29Å; D130-L134 PolarHBondContact O-N 3.04Å |
| 131 | A | 83.6 | Confident | 76.6 | Confident | 42 Ų | 42 | 73.6 Ų | 73.6 | 35% | 0.347 | 43% | 0.427 | S | S | . | . | H | α-helix | trans | -64.3 | -46.7 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q127 D128 T133 L134 W135 | Q127-A131 WeakPolarHBondContact O-CB 3.38Å; Q127-A131 PolarHBondContact O-N 2.95Å; D128-A131 PolarHBondContact O-N 2.85Å; A131-T133 VanDerWaalsContact C-N 3.3Å; A131-T133 PolarHBondContact O-N 2.63Å; A131-L134 WeakPolarHBondContact O-CB 3.49Å; A131-L134 PolarHBondContact O-N 3.27Å; A131-W135 WeakPolarHBondContact O-CB 3.18Å; A131-W135 PolarHBondContact O-N 3.09Å |
| 132 | V | 87.6 | Confident | 79 | Confident | 100 Ų | 100 | 71.8 Ų | 71.8 | 61% | 0.606 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -62.2 | -40.6 | 176.8 | 171.1 | 0 | 0 | 0 | 0 | 110.9 | D128 W135 A136 | D128-V132 WeakPolarHBondContact O-CB 3.33Å; D128-V132 WeakPolarHBondContact O-CG2 3.42Å; D128-V132 PolarHBondContact O-N 3.33Å; V132-W135 PolarHBondContact O-N 3.47Å; V132-A136 VanDerWaalsContact O-CB 3.27Å; V132-A136 WeakPolarHBondContact O-CB 3.08Å; V132-A136 PolarHBondContact O-N 3.18Å |
| 133 | T | 89.6 | Confident | 81.3 | Confident | 62 Ų | 62 | 73.4 Ų | 73.4 | 38% | 0.38 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -65.9 | -43.3 | 178.4 | -60.9 | 0 | 0 | 0 | 0 | 111.7 | L129 D130 A131 A136 Y137 | L129-T133 WeakPolarHBondContact O-CB 3.3Å; L129-T133 PolarHBondContact O-N 2.81Å; L129-T133 PolarHBondContact O-OG1 3.23Å; D130-T133 PolarHBondContact O-N 2.95Å; A131-T133 VanDerWaalsContact C-N 3.3Å; A131-T133 PolarHBondContact O-N 2.63Å; T133-A136 PolarHBondContact O-N 3.32Å; T133-Y137 HydrophobicContact CG2-CD2 3.64Å; T133-Y137 HydrophobicContact CG2-CE2 3.26Å; T133-Y137 WeakPolarHBondContact O-CD2 3.19Å; T133-Y137 PolarHBondContact O-N 3.34Å |
| 134 | L | 90 | Very high | 83 | Confident | 40 Ų | 40 | 72.5 Ų | 72.5 | 21% | 0.209 | 40% | 0.403 | C | S | . | . | H | α-helix | trans | -57.5 | -51.4 | 173.7 | 171 | 69.3 | 0 | 0 | 0 | 111.4 | D130 A131 A136 Y137 A138 F341 R342 L399 | D130-L134 VanDerWaalsContact O-CB 3.3Å; D130-L134 WeakPolarHBondContact O-CB 3.29Å; D130-L134 PolarHBondContact O-N 3.04Å; A131-L134 WeakPolarHBondContact O-CB 3.49Å; A131-L134 PolarHBondContact O-N 3.27Å; L134-A136 VanDerWaalsContact C-N 3.31Å; L134-A136 PolarHBondContact O-N 2.88Å; L134-Y137 PolarHBondContact O-N 2.89Å; L134-A138 WeakPolarHBondContact O-CB 3.39Å; L134-A138 PolarHBondContact O-N 3.42Å; L134-F341 VanDerWaalsContact CD1-C 3.45Å; L134-F341 HydrophobicContact CD1-CB 3.78Å; L134-F341 WeakPolarHBondContact CD1-O 3.43Å; L134-R342 HydrophobicContact CD1-CG 4.35Å; L134-R342 HydrophobicContact CD2-CG 3.83Å; L134-L399 HydrophobicContact CD1-CD2 4.49Å; L134-L399 HydrophobicContact CD2-CD2 4.06Å; L134-L399 HydrophobicContact CG-CD2 4.04Å |
| 135 | W | 92.9 | Very high | 84.7 | Confident | 85 Ų | 85 | 70.8 Ų | 70.8 | 32% | 0.322 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -61.5 | -41.1 | 178.8 | -84.3 | 66.9 | 0 | 0 | 0 | 111.8 | A131 V132 L139 L399 L400 | A131-W135 WeakPolarHBondContact O-CB 3.18Å; A131-W135 PolarHBondContact O-N 3.09Å; V132-W135 PolarHBondContact O-N 3.47Å; W135-L139 HydrophobicContact CE3-CD1 4.04Å; W135-L139 VanDerWaalsContact O-CB 3.26Å; W135-L139 WeakPolarHBondContact O-CB 3.28Å; W135-L139 VanDerWaalsContact O-CG 3.27Å; W135-L139 WeakPolarHBondContact O-CG 3.45Å; W135-L139 PolarHBondContact O-N 2.86Å; W135-L399 HydrophobicContact CB-CD1 4.47Å; W135-L399 HydrophobicContact CD2-CB 4.23Å; W135-L399 HydrophobicContact CD2-CD1 3.7Å; W135-L399 HydrophobicContact CE3-CD1 3.96Å; W135-L399 HydrophobicContact CG-CD1 3.93Å; W135-L399 HydrophobicContact CH2-CB 4.17Å; W135-L399 HydrophobicContact CZ2-CB 3.61Å; W135-L399 HydrophobicContact CZ3-CD1 4.46Å; W135-L400 HydrophobicContact CH2-CD2 3.62Å; W135-L400 HydrophobicContact CH2-CG 3.72Å; W135-L400 HydrophobicContact CZ2-CD2 3.77Å; W135-L400 HydrophobicContact CZ2-CG 4.02Å |
| 136 | A | 93.9 | Very high | 86.1 | Confident | 60 Ų | 60 | 66 Ų | 66 | 50% | 0.496 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -63.6 | -43.4 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | V132 T133 L134 G140 | V132-A136 VanDerWaalsContact O-CB 3.27Å; V132-A136 WeakPolarHBondContact O-CB 3.08Å; V132-A136 PolarHBondContact O-N 3.18Å; T133-A136 PolarHBondContact O-N 3.32Å; L134-A136 VanDerWaalsContact C-N 3.31Å; L134-A136 PolarHBondContact O-N 2.88Å; A136-G140 WeakPolarHBondContact O-CA 3.38Å; A136-G140 PolarHBondContact O-N 3.09Å |
| 137 | Y | 93.9 | Very high | 87.6 | Confident | 108 Ų | 108 | 61.3 Ų | 61.3 | 42% | 0.424 | 35% | 0.348 | S | S | . | . | H | α-helix | trans | -67 | -47 | 177.2 | -75.9 | -49.2 | 0 | 0 | 0 | 112.4 | T133 L134 G140 A141 | T133-Y137 HydrophobicContact CG2-CD2 3.64Å; T133-Y137 HydrophobicContact CG2-CE2 3.26Å; T133-Y137 WeakPolarHBondContact O-CD2 3.19Å; T133-Y137 PolarHBondContact O-N 3.34Å; L134-Y137 PolarHBondContact O-N 2.89Å; Y137-G140 PolarHBondContact O-N 3.17Å; Y137-A141 VanDerWaalsContact O-CB 3.32Å; Y137-A141 WeakPolarHBondContact O-CB 3.26Å; Y137-A141 PolarHBondContact O-N 3.39Å |
| 138 | A | 93.6 | Very high | 88.7 | Confident | 0 Ų | 0 | 55.8 Ų | 55.8 | 0% | 0 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -63.6 | -51.2 | -179.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | L134 G140 A141 T142 F341 T395 L399 | L134-A138 WeakPolarHBondContact O-CB 3.39Å; L134-A138 PolarHBondContact O-N 3.42Å; A138-G140 VanDerWaalsContact C-N 3.31Å; A138-G140 PolarHBondContact O-N 3.42Å; A138-A141 WeakPolarHBondContact O-CB 3.23Å; A138-A141 PolarHBondContact O-N 3.1Å; A138-T142 PolarHBondContact O-N 3.17Å; A138-T142 PolarHBondContact O-OG1 3.16Å; A138-F341 HydrophobicContact CB-CB 4.09Å; A138-F341 HydrophobicContact CB-CD2 3.97Å; A138-F341 HydrophobicContact CB-CG 4.17Å; A138-T395 HydrophobicContact CB-CG2 3.84Å; A138-L399 HydrophobicContact CB-CD1 3.9Å; A138-L399 HydrophobicContact CB-CD2 4.27Å |
| 139 | L | 95.4 | Very high | 89.5 | Confident | 56 Ų | 56 | 50.6 Ų | 50.6 | 29% | 0.293 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -65.2 | -35.7 | 177.3 | -66.6 | 174.3 | 0 | 0 | 0 | 112.2 | W135 T142 V143 L392 T395 | W135-L139 HydrophobicContact CE3-CD1 4.04Å; W135-L139 VanDerWaalsContact O-CB 3.26Å; W135-L139 WeakPolarHBondContact O-CB 3.28Å; W135-L139 VanDerWaalsContact O-CG 3.27Å; W135-L139 WeakPolarHBondContact O-CG 3.45Å; W135-L139 PolarHBondContact O-N 2.86Å; L139-T142 PolarHBondContact O-N 3.38Å; L139-V143 VanDerWaalsContact O-CG2 3.31Å; L139-V143 WeakPolarHBondContact O-CG2 3.32Å; L139-V143 PolarHBondContact O-N 3.02Å; L139-L392 HydrophobicContact CD2-CD2 4.09Å; L139-T395 HydrophobicContact CD2-CG2 4.1Å |
| 140 | G | 95.9 | Very high | 90.4 | Very high | 42 Ų | 42 | 47.1 Ų | 47.1 | 43% | 0.433 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -63 | -43.2 | 175 | 0 | 0 | 0 | 0 | 0 | 112.3 | A136 Y137 A138 V143 L144 | A136-G140 WeakPolarHBondContact O-CA 3.38Å; A136-G140 PolarHBondContact O-N 3.09Å; Y137-G140 PolarHBondContact O-N 3.17Å; A138-G140 VanDerWaalsContact C-N 3.31Å; A138-G140 PolarHBondContact O-N 3.42Å; G140-V143 PolarHBondContact O-N 2.93Å; G140-L144 WeakPolarHBondContact O-CB 3.49Å; G140-L144 PolarHBondContact O-N 3.49Å |
| 141 | A | 95.2 | Very high | 90.4 | Very high | 10 Ų | 10 | 48.6 Ų | 48.6 | 8% | 0.083 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -62.8 | -44.7 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112 | Y137 A138 V143 L144 I145 I337 F341 T352 | Y137-A141 VanDerWaalsContact O-CB 3.32Å; Y137-A141 WeakPolarHBondContact O-CB 3.26Å; Y137-A141 PolarHBondContact O-N 3.39Å; A138-A141 WeakPolarHBondContact O-CB 3.23Å; A138-A141 PolarHBondContact O-N 3.1Å; A141-V143 PolarHBondContact O-N 2.96Å; A141-L144 WeakPolarHBondContact O-CA 3.17Å; A141-L144 WeakPolarHBondContact O-CB 3.29Å; A141-L144 PolarHBondContact O-N 2.62Å; A141-L144 VanDerWaalsContact O-N 3.08Å; A141-I145 PolarHBondContact O-N 3.33Å; A141-I337 HydrophobicContact CB-CG2 3.99Å; A141-F341 HydrophobicContact CB-CE2 3.55Å; A141-F341 HydrophobicContact CB-CZ 4.04Å; A141-T352 HydrophobicContact CB-CG2 3.68Å; A141-T352 WeakPolarHBondContact CB-OG1 3.44Å |
| 142 | T | 94.9 | Very high | 90.2 | Very high | 0 Ų | 0 | 49.2 Ų | 49.2 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -61.4 | -43.4 | 176.9 | -50.3 | 0 | 0 | 0 | 0 | 112 | A138 L139 L144 I145 S146 A391 L392 T395 | A138-T142 PolarHBondContact O-N 3.17Å; A138-T142 PolarHBondContact O-OG1 3.16Å; L139-T142 PolarHBondContact O-N 3.38Å; T142-L144 VanDerWaalsContact C-N 3.29Å; T142-L144 PolarHBondContact O-N 3.09Å; T142-I145 WeakPolarHBondContact O-CG1 3.46Å; T142-I145 PolarHBondContact O-N 3.46Å; T142-S146 PolarHBondContact O-N 3Å; T142-S146 VanDerWaalsContact O-N 3.14Å; T142-S146 PolarHBondContact O-OG 3.39Å; T142-A391 VanDerWaalsContact CG2-C 3.48Å; T142-A391 HydrophobicContact CG2-CB 3.53Å; T142-L392 HydrophobicContact CG2-CD2 3.88Å; T142-L392 HydrophobicContact CG2-CG 4.26Å; T142-T395 WeakPolarHBondContact CG2-OG1 3.35Å; T142-T395 PolarHBondContact OG1-OG1 2.86Å |
| 143 | V | 94.6 | Very high | 89.8 | Confident | 80 Ų | 80 | 44.5 Ų | 44.5 | 49% | 0.485 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -63.6 | -37.4 | 174 | 170.7 | 0 | 0 | 0 | 0 | 111.1 | L139 G140 A141 S146 A147 L392 | L139-V143 VanDerWaalsContact O-CG2 3.31Å; L139-V143 WeakPolarHBondContact O-CG2 3.32Å; L139-V143 PolarHBondContact O-N 3.02Å; G140-V143 PolarHBondContact O-N 2.93Å; A141-V143 PolarHBondContact O-N 2.96Å; V143-S146 PolarHBondContact O-N 3.48Å; V143-A147 WeakPolarHBondContact O-CB 3.47Å; V143-A147 PolarHBondContact O-N 2.99Å; V143-L392 HydrophobicContact CG2-CD2 4.03Å |
| 144 | L | 92.9 | Very high | 89.2 | Confident | 84 Ų | 84 | 48.8 Ų | 48.8 | 44% | 0.44 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -63 | -49.2 | 178 | 178.7 | 66.9 | 0 | 0 | 0 | 111.5 | G140 A141 T142 S146 A147 A148 | G140-L144 WeakPolarHBondContact O-CB 3.49Å; G140-L144 PolarHBondContact O-N 3.49Å; A141-L144 WeakPolarHBondContact O-CA 3.17Å; A141-L144 WeakPolarHBondContact O-CB 3.29Å; A141-L144 PolarHBondContact O-N 2.62Å; A141-L144 VanDerWaalsContact O-N 3.08Å; T142-L144 VanDerWaalsContact C-N 3.29Å; T142-L144 PolarHBondContact O-N 3.09Å; L144-S146 VanDerWaalsContact C-N 3.28Å; L144-S146 PolarHBondContact O-N 3.45Å; L144-A147 PolarHBondContact O-N 3.2Å; L144-A148 VanDerWaalsContact O-CB 3.23Å; L144-A148 WeakPolarHBondContact O-CB 3.36Å; L144-A148 PolarHBondContact O-N 2.85Å |
| 145 | I | 91.9 | Very high | 88.6 | Confident | 0 Ų | 0 | 53.4 Ų | 53.4 | 0% | 0 | 29% | 0.288 | C | S | . | . | H | α-helix | trans | -62.9 | -36.5 | 179.1 | 63.6 | 156.5 | 0 | 0 | 0 | 111.7 | A141 T142 P149 D333 I337 T352 V355 L356 | A141-I145 PolarHBondContact O-N 3.33Å; T142-I145 WeakPolarHBondContact O-CG1 3.46Å; T142-I145 PolarHBondContact O-N 3.46Å; I145-P149 WeakPolarHBondContact O-CD 3.47Å; I145-P149 WeakPolarHBondContact O-CG 3.4Å; I145-D333 HydrophobicContact CD1-CB 4.37Å; I145-I337 HydrophobicContact CD1-CD1 3.5Å; I145-I337 HydrophobicContact CG1-CD1 4.09Å; I145-I337 HydrophobicContact CG2-CD1 4.1Å; I145-T352 HydrophobicContact CG2-CG2 3.89Å; I145-V355 HydrophobicContact CB-CG1 4.4Å; I145-V355 HydrophobicContact CD1-CG1 3.59Å; I145-V355 HydrophobicContact CG2-CG1 4.19Å; I145-L356 HydrophobicContact CG2-CB 4.12Å |
| 146 | S | 90.9 | Very high | 87.6 | Confident | 6 Ų | 6 | 50.6 Ų | 50.6 | 4% | 0.042 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -77.7 | -26.7 | 178.5 | -58.2 | 0 | 0 | 0 | 0 | 112.9 | T142 V143 L144 F150 | T142-S146 PolarHBondContact O-N 3Å; T142-S146 VanDerWaalsContact O-N 3.14Å; T142-S146 PolarHBondContact O-OG 3.39Å; V143-S146 PolarHBondContact O-N 3.48Å; L144-S146 VanDerWaalsContact C-N 3.28Å; L144-S146 PolarHBondContact O-N 3.45Å; S146-F150 WeakPolarHBondContact O-CD2 3.44Å; S146-F150 WeakPolarHBondContact O-CE2 3.49Å |
| 147 | A | 88.8 | Confident | 86.4 | Confident | 37 Ų | 37 | 52.1 Ų | 52.1 | 31% | 0.306 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -91.1 | -31.4 | -178.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | V143 L144 F150 F151 | V143-A147 WeakPolarHBondContact O-CB 3.47Å; V143-A147 PolarHBondContact O-N 2.99Å; L144-A147 PolarHBondContact O-N 3.2Å; A147-F150 WeakPolarHBondContact O-CB 3.33Å; A147-F150 PolarHBondContact O-N 3.43Å; A147-F151 WeakPolarHBondContact O-CD2 3.45Å |
| 148 | A | 86.5 | Confident | 85 | Confident | 20 Ų | 20 | 48.3 Ų | 48.3 | 17% | 0.165 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -60.1 | -42.5 | -176 | 0 | 0 | 0 | 0 | 0 | 114.1 | L144 F150 F151 L356 | L144-A148 VanDerWaalsContact O-CB 3.23Å; L144-A148 WeakPolarHBondContact O-CB 3.36Å; L144-A148 PolarHBondContact O-N 2.85Å; A148-F150 PolarHBondContact O-N 3.26Å; A148-F151 WeakPolarHBondContact O-CB 3.38Å; A148-F151 PolarHBondContact O-N 2.99Å; A148-F151 VanDerWaalsContact O-N 3.09Å; A148-L356 HydrophobicContact CB-CD1 3.45Å; A148-L356 VanDerWaalsContact CB-CD1 3.45Å |
| 149 | P | 82.3 | Confident | 83.2 | Confident | 1 Ų | 1 | 55.9 Ų | 55.9 | 1% | 0.006 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -58.4 | -30.8 | 177.2 | -25.9 | 34.6 | 0 | 0 | 0 | 113.2 | I145 F151 V152 L153 E359 V360 E363 | I145-P149 WeakPolarHBondContact O-CD 3.47Å; I145-P149 WeakPolarHBondContact O-CG 3.4Å; P149-F151 VanDerWaalsContact C-N 3.27Å; P149-F151 PolarHBondContact O-N 3.42Å; P149-V152 WeakPolarHBondContact O-CB 3.24Å; P149-V152 PolarHBondContact O-N 3.35Å; P149-L153 VanDerWaalsContact O-CG 3.3Å; P149-L153 WeakPolarHBondContact O-CG 3.31Å; P149-L153 PolarHBondContact O-N 3.17Å; P149-E359 HydrophobicContact CG-CG 3.97Å; P149-V360 HydrophobicContact CG-CG2 4.16Å; P149-E363 HydrophobicContact CB-CB 3.53Å; P149-E363 HydrophobicContact CB-CG 3.67Å; P149-E363 HydrophobicContact CG-CB 4.17Å; P149-E363 HydrophobicContact CG-CG 3.85Å |
| 150 | F | 82.9 | Confident | 81.2 | Confident | 34 Ų | 34 | 58.2 Ų | 58.2 | 15% | 0.149 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -60.5 | -35.1 | 177.2 | -73.1 | -94.8 | 0 | 0 | 0 | 113.5 | S146 A147 A148 V152 L153 F154 M381 Q384 L385 | S146-F150 WeakPolarHBondContact O-CD2 3.44Å; S146-F150 WeakPolarHBondContact O-CE2 3.49Å; A147-F150 WeakPolarHBondContact O-CB 3.33Å; A147-F150 PolarHBondContact O-N 3.43Å; A148-F150 PolarHBondContact O-N 3.26Å; F150-V152 VanDerWaalsContact C-N 3.31Å; F150-L153 PolarHBondContact O-N 3.08Å; F150-F154 WeakPolarHBondContact O-CB 3.43Å; F150-F154 PolarHBondContact O-N 2.79Å; F150-M381 HydrophobicContact CD1-CB 4.49Å; F150-M381 HydrophobicContact CD1-CE 4.01Å; F150-M381 HydrophobicContact CE1-CB 4.13Å; F150-M381 WeakPolarHBondContact CE1-O 3.35Å; F150-Q384 HydrophobicContact CZ-CB 4.06Å; F150-L385 HydrophobicContact CE1-CB 3.94Å; F150-L385 HydrophobicContact CE1-CD1 4.43Å; F150-L385 HydrophobicContact CE2-CB 4.37Å; F150-L385 HydrophobicContact CE2-CD1 3.85Å; F150-L385 HydrophobicContact CZ-CB 3.51Å; F150-L385 HydrophobicContact CZ-CD1 3.81Å; F150-L385 HydrophobicContact CZ-CG 4.22Å |
| 151 | F | 81.6 | Confident | 79.2 | Confident | 154 Ų | 154 | 63.8 Ų | 63.8 | 68% | 0.675 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -66.1 | -39.4 | 176.5 | -68 | -84.8 | 0 | 0 | 0 | 110.7 | A147 A148 P149 L155 | A147-F151 WeakPolarHBondContact O-CD2 3.45Å; A148-F151 WeakPolarHBondContact O-CB 3.38Å; A148-F151 PolarHBondContact O-N 2.99Å; A148-F151 VanDerWaalsContact O-N 3.09Å; P149-F151 VanDerWaalsContact C-N 3.27Å; P149-F151 PolarHBondContact O-N 3.42Å; F151-L155 WeakPolarHBondContact O-CG 2.91Å |
| 152 | V | 79.1 | Confident | 77.6 | Confident | 55 Ų | 55 | 65.9 Ų | 65.9 | 33% | 0.333 | 36% | 0.362 | S | S | . | . | H | α-helix | trans | -67.1 | -46.9 | 176.1 | -177.5 | 0 | 0 | 0 | 0 | 110.4 | P149 F150 F154 L155 I156 V360 V364 | P149-V152 WeakPolarHBondContact O-CB 3.24Å; P149-V152 PolarHBondContact O-N 3.35Å; F150-V152 VanDerWaalsContact C-N 3.31Å; V152-F154 VanDerWaalsContact C-N 3.29Å; V152-F154 PolarHBondContact O-N 3.1Å; V152-L155 WeakPolarHBondContact O-CB 3.49Å; V152-L155 PolarHBondContact O-N 2.88Å; V152-L155 VanDerWaalsContact O-N 3.08Å; V152-I156 PolarHBondContact O-N 2.8Å; V152-V360 HydrophobicContact CB-CG1 4.36Å; V152-V360 HydrophobicContact CG1-CG1 4.22Å; V152-V360 HydrophobicContact CG2-CG1 3.91Å; V152-V364 HydrophobicContact CG1-CG2 4.11Å |
| 153 | L | 79 | Confident | 76.2 | Confident | 0 Ų | 0 | 71.1 Ų | 71.1 | 0% | 0 | 40% | 0.396 | C | S | . | . | H | α-helix | trans | -63.1 | -32.4 | 178.6 | -66.4 | 176.6 | 0 | 0 | 0 | 113.3 | P149 F150 L155 I156 V364 F367 K377 | P149-L153 VanDerWaalsContact O-CG 3.3Å; P149-L153 WeakPolarHBondContact O-CG 3.31Å; P149-L153 PolarHBondContact O-N 3.17Å; F150-L153 PolarHBondContact O-N 3.08Å; L153-L155 VanDerWaalsContact C-N 3.27Å; L153-L155 PolarHBondContact O-N 3.28Å; L153-I156 HydrophobicContact CD2-CD1 4.06Å; L153-I156 PolarHBondContact O-N 3.44Å; L153-V364 HydrophobicContact CD2-CG2 4.01Å; L153-F367 HydrophobicContact CD1-CB 4.46Å; L153-F367 HydrophobicContact CD2-CB 3.6Å; L153-F367 HydrophobicContact CD2-CD1 4.06Å; L153-F367 HydrophobicContact CD2-CD2 4.29Å; L153-F367 HydrophobicContact CD2-CG 3.73Å; L153-K377 WeakPolarHBondContact O-CE 3.33Å; L153-K377 PolarHBondContact O-NZ 2.88Å |
| 154 | F | 77.9 | Confident | 75 | Confident | 152 Ų | 152 | 76.2 Ų | 76.2 | 67% | 0.667 | 41% | 0.406 | S | S | * | . | H | α-helix | trans | -60.4 | -41 | 174.5 | -174.7 | -98.5 | 0 | 0 | 0 | 111.2 | F150 V152 I156 K377 | F150-F154 WeakPolarHBondContact O-CB 3.43Å; F150-F154 PolarHBondContact O-N 2.79Å; V152-F154 VanDerWaalsContact C-N 3.29Å; V152-F154 PolarHBondContact O-N 3.1Å; F154-I156 VanDerWaalsContact C-N 3.3Å; F154-I156 PolarHBondContact O-N 3.47Å; F154-K377 PolarHBondContact O-NZ 3.08Å |
| 155 | L | 76 | Confident | 74.1 | Confident | 138 Ų | 138 | 74.8 Ų | 74.8 | 72% | 0.723 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -71.3 | -19.4 | -179.2 | -62.8 | 173.9 | 0 | 0 | 0 | 113.7 | F151 V152 L153 P157 | F151-L155 WeakPolarHBondContact O-CG 2.91Å; V152-L155 WeakPolarHBondContact O-CB 3.49Å; V152-L155 PolarHBondContact O-N 2.88Å; V152-L155 VanDerWaalsContact O-N 3.08Å; L153-L155 VanDerWaalsContact C-N 3.27Å; L153-L155 PolarHBondContact O-N 3.28Å; L155-P157 WeakPolarHBondContact O-CD 3.23Å |
| 156 | I | 73.4 | Confident | 73.4 | Confident | 26 Ų | 26 | 82.8 Ų | 82.8 | 13% | 0.133 | 43% | 0.428 | C | S | . | . | S | Bend | trans | -74.3 | 114.8 | 178.8 | -53.7 | -178.8 | 0 | 0 | 0 | 109.5 | V152 L153 F154 V158 V364 K377 | V152-I156 PolarHBondContact O-N 2.8Å; L153-I156 HydrophobicContact CD2-CD1 4.06Å; L153-I156 PolarHBondContact O-N 3.44Å; F154-I156 VanDerWaalsContact C-N 3.3Å; F154-I156 PolarHBondContact O-N 3.47Å; I156-V158 VanDerWaalsContact C-N 3.32Å; I156-V158 HydrophobicContact CG2-CG2 3.66Å; I156-V158 PolarHBondContact O-N 2.86Å; I156-V364 HydrophobicContact CD1-CG1 3.94Å; I156-V364 HydrophobicContact CD1-CG2 4.05Å; I156-K377 PolarHBondContact O-NZ 3.44Å |
| 157 | P | 67.3 | Low | 73.1 | Confident | 91 Ų | 91 | 84.4 Ų | 84.4 | 59% | 0.591 | 44% | 0.439 | S | S | * | . | trans | -79.4 | 79.2 | -177.6 | 33 | -33 | 0 | 0 | 0 | 110.4 | L155 | L155-P157 WeakPolarHBondContact O-CD 3.23Š| ||
| 158 | V | 64.3 | Low | 72.8 | Confident | 29 Ų | 29 | 86 Ų | 86 | 18% | 0.176 | 44% | 0.442 | C | S | . | . | trans | -96.3 | 89.4 | 171.7 | -175.1 | 0 | 0 | 0 | 0 | 109.4 | I156 F367 V371 | I156-V158 VanDerWaalsContact C-N 3.32Å; I156-V158 HydrophobicContact CG2-CG2 3.66Å; I156-V158 PolarHBondContact O-N 2.86Å; V158-F367 HydrophobicContact CB-CE1 4.28Å; V158-F367 HydrophobicContact CB-CZ 4.27Å; V158-F367 HydrophobicContact CG2-CE1 3.64Å; V158-F367 HydrophobicContact CG2-CZ 4.11Å; V158-V371 HydrophobicContact CG1-CG1 4.16Å | ||
| 159 | E | 57.4 | Low | 72.6 | Confident | 158 Ų | 158 | 86.5 Ų | 86.5 | 74% | 0.738 | 44% | 0.441 | S | S | * | . | trans | -104.7 | 147.5 | 166.7 | -70.4 | -171.3 | 166.7 | 0 | 0 | 111 | H165 | E159-H165 PolarHBondContact O-CE1 3.49Å; E159-H165 PolarHBondContact O-ND1 3.26Å | ||
| 160 | S | 52.1 | Low | 72.8 | Confident | 105 Ų | 105 | 87.5 Ų | 87.5 | 73% | 0.734 | 45% | 0.446 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -69.4 | 138.5 | -168 | -178.1 | 0 | 0 | 0 | 0 | 113.7 | ||
| 161 | N | 53.9 | Low | 73 | Confident | 159 Ų | 159 | 87.9 Ų | 87.9 | 85% | 0.85 | 45% | 0.449 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 82.7 | 21.6 | 159.8 | -64.7 | -28.9 | 0 | 0 | 0 | 121.4 | ||
| 162 | S | 62.7 | Low | 73.3 | Confident | 54 Ų | 54 | 82.1 Ų | 82.1 | 38% | 0.378 | 43% | 0.425 | S | S | . | . | trans | -97.3 | 136.6 | 168.1 | -173.4 | 0 | 0 | 0 | 0 | 112.7 | R164 H165 | S162-R164 PolarHBondContact O-N 2.96Å; S162-R164 VanDerWaalsContact O-N 3.08Å; S162-H165 PolarHBondContact O-N 2.96Å | ||
| 163 | P | 65.1 | Low | 73.6 | Confident | 111 Ų | 111 | 79.5 Ų | 79.5 | 72% | 0.721 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -54.2 | -29.7 | 175.6 | -24.2 | 32 | 0 | 0 | 0 | 113.7 | H165 R166 S167 | P163-H165 VanDerWaalsContact C-N 3.33Å; P163-H165 PolarHBondContact O-N 3.1Å; P163-R166 PolarHBondContact O-N 3.41Å; P163-S167 PolarHBondContact O-N 3.4Å |
| 164 | R | 68.6 | Low | 74.2 | Confident | 186 Ų | 186 | 79.7 Ų | 79.7 | 70% | 0.702 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -68.5 | -30.4 | 179.2 | -162.2 | 175.9 | -177 | 123.4 | 1.3 | 112.8 | S162 L168 | S162-R164 PolarHBondContact O-N 2.96Å; S162-R164 VanDerWaalsContact O-N 3.08Å; R164-L168 PolarHBondContact O-N 3.49Å |
| 165 | H | 74.5 | Confident | 74.8 | Confident | 55 Ų | 55 | 74.9 Ų | 74.9 | 26% | 0.255 | 39% | 0.39 | S | S | . | . | H | α-helix | trans | -76.4 | -30.5 | 178.3 | -63.7 | 176.2 | 0 | 0 | 0 | 111.6 | E159 S162 P163 L168 L169 | E159-H165 PolarHBondContact O-CE1 3.49Å; E159-H165 PolarHBondContact O-ND1 3.26Å; S162-H165 PolarHBondContact O-N 2.96Å; P163-H165 VanDerWaalsContact C-N 3.33Å; P163-H165 PolarHBondContact O-N 3.1Å; H165-L168 PolarHBondContact O-N 3.3Å; H165-L169 WeakPolarHBondContact O-CB 3.37Å; H165-L169 VanDerWaalsContact O-CG 3.26Å; H165-L169 WeakPolarHBondContact O-CG 3.25Å; H165-L169 PolarHBondContact O-N 2.9Å |
| 166 | R | 78.3 | Confident | 75.2 | Confident | 168 Ų | 168 | 68.5 Ų | 68.5 | 63% | 0.634 | 36% | 0.356 | S | S | * | . | H | α-helix | trans | -64.2 | -44.8 | 174.8 | -171.4 | 175.6 | -179.3 | 169.8 | -0.1 | 111.8 | P163 L169 Q170 | P163-R166 PolarHBondContact O-N 3.41Å; R166-L169 PolarHBondContact O-N 2.93Å; R166-Q170 WeakPolarHBondContact O-CG 3.33Å; R166-Q170 PolarHBondContact O-N 3.38Å |
| 167 | S | 83 | Confident | 76 | Confident | 39 Ų | 39 | 67.2 Ų | 67.2 | 27% | 0.273 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -63 | -41.9 | 175.4 | 161.5 | 0 | 0 | 0 | 0 | 112.1 | P163 Q170 I171 Q447 | P163-S167 PolarHBondContact O-N 3.4Å; S167-Q170 PolarHBondContact O-N 3.1Å; S167-I171 WeakPolarHBondContact O-CG1 3.32Å; S167-I171 PolarHBondContact O-N 2.85Å; S167-I171 VanDerWaalsContact O-N 3.09Å; S167-Q447 PolarHBondContact O-NE2 3.23Å; S167-Q447 VanDerWaalsContact O-NE2 3.16Å; S167-Q447 PolarHBondContact OG-OE1 2.83Å |
| 168 | L | 83.1 | Confident | 77.2 | Confident | 71 Ų | 71 | 62.9 Ų | 62.9 | 37% | 0.372 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -62.9 | -44.6 | 174.3 | 179.7 | 64.6 | 0 | 0 | 0 | 112 | R164 H165 Q170 I171 L172 | R164-L168 PolarHBondContact O-N 3.49Å; H165-L168 PolarHBondContact O-N 3.3Å; L168-Q170 VanDerWaalsContact C-N 3.3Å; L168-Q170 PolarHBondContact O-N 3.36Å; L168-I171 PolarHBondContact O-N 3.07Å; L168-I171 VanDerWaalsContact O-N 3.17Å; L168-L172 HydrophobicContact CD1-CD1 4.49Å; L168-L172 HydrophobicContact CD1-CG 4.36Å; L168-L172 HydrophobicContact CG-CD1 4.13Å; L168-L172 HydrophobicContact CG-CG 4.41Å; L168-L172 WeakPolarHBondContact O-CG 3.31Å; L168-L172 PolarHBondContact O-N 2.92Å |
| 169 | L | 81.5 | Confident | 78.4 | Confident | 30 Ų | 30 | 61.7 Ų | 61.7 | 16% | 0.157 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -60.7 | -40 | 177.5 | -76.2 | 170.8 | 0 | 0 | 0 | 111.6 | H165 R166 L172 L173 A368 V371 | H165-L169 WeakPolarHBondContact O-CB 3.37Å; H165-L169 VanDerWaalsContact O-CG 3.26Å; H165-L169 WeakPolarHBondContact O-CG 3.25Å; H165-L169 PolarHBondContact O-N 2.9Å; R166-L169 PolarHBondContact O-N 2.93Å; L169-L172 PolarHBondContact O-N 3.39Å; L169-L173 WeakPolarHBondContact O-CB 3.15Å; L169-L173 PolarHBondContact O-N 3.31Å; L169-A368 HydrophobicContact CD2-CB 4.1Å; L169-V371 HydrophobicContact CD1-CG1 4.18Å; L169-V371 HydrophobicContact CD2-CG1 4.42Å |
| 170 | Q | 86.4 | Confident | 79.9 | Confident | 22 Ų | 22 | 54.3 Ų | 54.3 | 10% | 0.103 | 28% | 0.281 | C | S | . | . | H | α-helix | trans | -65.5 | -37.8 | 175.2 | -72 | 176.6 | -54.5 | 0 | 0 | 112.5 | R166 S167 L168 L173 S174 L439 E451 | R166-Q170 WeakPolarHBondContact O-CG 3.33Å; R166-Q170 PolarHBondContact O-N 3.38Å; S167-Q170 PolarHBondContact O-N 3.1Å; L168-Q170 VanDerWaalsContact C-N 3.3Å; L168-Q170 PolarHBondContact O-N 3.36Å; Q170-L173 PolarHBondContact O-N 3.14Å; Q170-S174 WeakPolarHBondContact O-CB 3.09Å; Q170-S174 PolarHBondContact O-N 3.08Å; Q170-L439 HydrophobicContact CB-CD2 4.43Å; Q170-L439 WeakPolarHBondContact O-CD2 3.33Å; Q170-E451 HydrophobicContact CB-CG 4.32Å; Q170-E451 VanDerWaalsContact CB-OE1 3.27Å; Q170-E451 WeakPolarHBondContact CB-OE1 3.38Å |
| 171 | I | 88.8 | Confident | 81.8 | Confident | 43 Ų | 43 | 50.8 Ų | 50.8 | 22% | 0.221 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -66.6 | -45.5 | 175.4 | -65.9 | 164.3 | 0 | 0 | 0 | 110.7 | S167 L168 L173 S174 F175 L450 | S167-I171 WeakPolarHBondContact O-CG1 3.32Å; S167-I171 PolarHBondContact O-N 2.85Å; S167-I171 VanDerWaalsContact O-N 3.09Å; L168-I171 PolarHBondContact O-N 3.07Å; L168-I171 VanDerWaalsContact O-N 3.17Å; I171-L173 VanDerWaalsContact C-N 3.33Å; I171-L173 PolarHBondContact O-N 2.96Å; I171-S174 PolarHBondContact O-N 3.43Å; I171-F175 WeakPolarHBondContact O-CB 3.36Å; I171-F175 PolarHBondContact O-N 2.89Å; I171-L450 HydrophobicContact CD1-CB 4.02Å; I171-L450 HydrophobicContact CD1-CD1 4.03Å; I171-L450 HydrophobicContact CG1-CB 4.13Å |
| 172 | L | 86.3 | Confident | 83.6 | Confident | 32 Ų | 32 | 43.3 Ų | 43.3 | 17% | 0.168 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -61.7 | -42.1 | 176 | -70.6 | 174.7 | 0 | 0 | 0 | 111.5 | L168 L169 S174 F175 A176 V364 A368 | L168-L172 HydrophobicContact CD1-CD1 4.49Å; L168-L172 HydrophobicContact CD1-CG 4.36Å; L168-L172 HydrophobicContact CG-CD1 4.13Å; L168-L172 HydrophobicContact CG-CG 4.41Å; L168-L172 WeakPolarHBondContact O-CG 3.31Å; L168-L172 PolarHBondContact O-N 2.92Å; L169-L172 PolarHBondContact O-N 3.39Å; L172-S174 VanDerWaalsContact C-N 3.33Å; L172-S174 PolarHBondContact O-N 3.25Å; L172-F175 PolarHBondContact O-N 3.19Å; L172-A176 WeakPolarHBondContact O-CB 3.27Å; L172-A176 PolarHBondContact O-N 3.36Å; L172-V364 HydrophobicContact CD2-CG1 3.92Å; L172-A368 HydrophobicContact CB-CB 4.09Å |
| 173 | L | 86.4 | Confident | 84.8 | Confident | 1 Ų | 1 | 40.8 Ų | 40.8 | 1% | 0.005 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -63 | -40.1 | 175.8 | -178.9 | 69.7 | 0 | 0 | 0 | 111.8 | L169 Q170 I171 A176 S177 I369 V435 L439 | L169-L173 WeakPolarHBondContact O-CB 3.15Å; L169-L173 PolarHBondContact O-N 3.31Å; Q170-L173 PolarHBondContact O-N 3.14Å; I171-L173 VanDerWaalsContact C-N 3.33Å; I171-L173 PolarHBondContact O-N 2.96Å; L173-A176 WeakPolarHBondContact O-CB 3.49Å; L173-A176 PolarHBondContact O-N 3.48Å; L173-S177 WeakPolarHBondContact O-CB 3.48Å; L173-S177 PolarHBondContact O-N 2.88Å; L173-I369 HydrophobicContact CD1-CD1 4.1Å; L173-I369 HydrophobicContact CD1-CG1 3.31Å; L173-V435 HydrophobicContact CD1-CB 4.26Å; L173-V435 HydrophobicContact CD1-CG1 3.47Å; L173-V435 VanDerWaalsContact CD1-CG1 3.47Å; L173-V435 HydrophobicContact CD1-CG2 3.91Å; L173-V435 HydrophobicContact CD2-CG1 3.98Å; L173-V435 HydrophobicContact CG-CG1 3.41Å; L173-V435 VanDerWaalsContact CG-CG1 3.41Å; L173-L439 HydrophobicContact CB-CD2 4.36Å; L173-L439 HydrophobicContact CD2-CD2 3.89Å; L173-L439 HydrophobicContact CD2-CG 4.26Å; L173-L439 HydrophobicContact CG-CD2 4.21Å |
| 174 | S | 91.1 | Very high | 86 | Confident | 3 Ų | 3 | 35.5 Ų | 35.5 | 2% | 0.021 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -67.1 | -44.3 | 176.3 | -160.8 | 0 | 0 | 0 | 0 | 111.8 | Q170 I171 L172 A176 S177 G178 E451 L455 | Q170-S174 WeakPolarHBondContact O-CB 3.09Å; Q170-S174 PolarHBondContact O-N 3.08Å; I171-S174 PolarHBondContact O-N 3.43Å; L172-S174 VanDerWaalsContact C-N 3.33Å; L172-S174 PolarHBondContact O-N 3.25Å; S174-A176 VanDerWaalsContact C-N 3.33Å; S174-A176 PolarHBondContact O-N 2.83Å; S174-S177 WeakPolarHBondContact O-CB 3.35Å; S174-S177 PolarHBondContact O-N 3.04Å; S174-G178 PolarHBondContact O-N 2.96Å; S174-E451 VanDerWaalsContact CB-O 3.25Å; S174-E451 WeakPolarHBondContact CB-O 3.36Å; S174-E451 PolarHBondContact OG-O 2.95Å; S174-L455 VanDerWaalsContact O-CA 3.24Å; S174-L455 WeakPolarHBondContact O-CA 3.34Å; S174-L455 WeakPolarHBondContact OG-CB 3.45Å |
| 175 | F | 90.1 | Very high | 87.1 | Confident | 52 Ų | 52 | 31.9 Ų | 31.9 | 23% | 0.228 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -57.8 | -44.7 | 171.7 | 177 | -93.3 | 0 | 0 | 0 | 112.1 | I171 L172 S177 G178 G179 P361 G454 M461 | I171-F175 WeakPolarHBondContact O-CB 3.36Å; I171-F175 PolarHBondContact O-N 2.89Å; L172-F175 PolarHBondContact O-N 3.19Å; F175-S177 PolarHBondContact O-N 3.45Å; F175-G178 PolarHBondContact O-N 3.25Å; F175-G179 PolarHBondContact O-N 2.81Å; F175-P361 HydrophobicContact CE1-CB 4.03Å; F175-P361 HydrophobicContact CZ-CB 4.43Å; F175-G454 VanDerWaalsContact CA-O 3.27Å; F175-G454 WeakPolarHBondContact CA-O 2.88Å; F175-G454 WeakPolarHBondContact CD2-O 3.04Å; F175-M461 HydrophobicContact CE1-SD 4.18Å; F175-M461 HydrophobicContact CE2-SD 4.36Å; F175-M461 HydrophobicContact CZ-SD 3.5Å; F175-M461 VanDerWaalsContact CZ-SD 3.5Å |
| 176 | A | 84.8 | Confident | 87.8 | Confident | 3 Ų | 3 | 32.7 Ų | 32.7 | 3% | 0.025 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -59.9 | -45.6 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.4 | L172 L173 S174 G178 G179 L180 | L172-A176 WeakPolarHBondContact O-CB 3.27Å; L172-A176 PolarHBondContact O-N 3.36Å; L173-A176 WeakPolarHBondContact O-CB 3.49Å; L173-A176 PolarHBondContact O-N 3.48Å; S174-A176 VanDerWaalsContact C-N 3.33Å; S174-A176 PolarHBondContact O-N 2.83Å; A176-G178 VanDerWaalsContact C-N 3.28Å; A176-G178 PolarHBondContact O-N 3.37Å; A176-G179 CarbonylContact O-C 3.59Å; A176-G179 PolarHBondContact O-N 3.49Å; A176-G179 VanDerWaalsContact O-N 3.12Å; A176-L180 WeakPolarHBondContact O-CB 3.19Å; A176-L180 WeakPolarHBondContact O-CG 3.39Å; A176-L180 PolarHBondContact O-N 3.42Å |
| 177 | S | 90.4 | Very high | 88 | Confident | 0 Ų | 0 | 26 Ų | 26 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -58.9 | -42.3 | 176.6 | -166.4 | 0 | 0 | 0 | 0 | 111.5 | L173 S174 F175 L181 | L173-S177 WeakPolarHBondContact O-CB 3.48Å; L173-S177 PolarHBondContact O-N 2.88Å; S174-S177 WeakPolarHBondContact O-CB 3.35Å; S174-S177 PolarHBondContact O-N 3.04Å; F175-S177 PolarHBondContact O-N 3.45Å; S177-L181 WeakPolarHBondContact O-CB 3.47Å; S177-L181 VanDerWaalsContact O-CG 3.26Å; S177-L181 WeakPolarHBondContact O-CG 3.5Å; S177-L181 PolarHBondContact O-N 3Å |
| 178 | G | 91.9 | Very high | 88 | Confident | 0 Ų | 0 | 24.2 Ų | 24.2 | 0% | 0 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -63.7 | -41.5 | 173.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | S174 F175 A176 G182 L455 V459 | S174-G178 PolarHBondContact O-N 2.96Å; F175-G178 PolarHBondContact O-N 3.25Å; A176-G178 VanDerWaalsContact C-N 3.28Å; A176-G178 PolarHBondContact O-N 3.37Å; G178-G182 WeakPolarHBondContact O-CA 3.1Å; G178-G182 PolarHBondContact O-N 2.89Å; G178-L455 WeakPolarHBondContact CA-O 3.49Å; G178-V459 WeakPolarHBondContact O-CG2 3.43Å |
| 179 | G | 89.4 | Confident | 88.2 | Confident | 3 Ų | 3 | 22.2 Ų | 22.2 | 3% | 0.031 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -62.7 | -52.2 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.4 | F175 A176 L181 G182 D183 M462 | F175-G179 PolarHBondContact O-N 2.81Å; A176-G179 CarbonylContact O-C 3.59Å; A176-G179 PolarHBondContact O-N 3.49Å; A176-G179 VanDerWaalsContact O-N 3.12Å; G179-L181 PolarHBondContact O-N 3.27Å; G179-G182 CarbonylContact O-C 3.58Å; G179-G182 WeakPolarHBondContact O-CA 3.49Å; G179-G182 PolarHBondContact O-N 2.98Å; G179-G182 VanDerWaalsContact O-N 3.13Å; G179-D183 WeakPolarHBondContact O-CB 3.34Å; G179-D183 PolarHBondContact O-N 2.79Å; G179-M462 WeakPolarHBondContact O-CG 3.12Å |
| 180 | L | 89 | Confident | 88.3 | Confident | 3 Ų | 3 | 23.1 Ų | 23.1 | 2% | 0.016 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -59.1 | -41.9 | 177.9 | -69.2 | 171.8 | 0 | 0 | 0 | 112.8 | A176 A184 F427 V430 A431 | A176-L180 WeakPolarHBondContact O-CB 3.19Å; A176-L180 WeakPolarHBondContact O-CG 3.39Å; A176-L180 PolarHBondContact O-N 3.42Å; L180-A184 WeakPolarHBondContact O-CB 3.34Å; L180-A184 PolarHBondContact O-N 3.45Å; L180-F427 HydrophobicContact CB-CB 4.47Å; L180-F427 HydrophobicContact CD2-CD1 3.77Å; L180-F427 HydrophobicContact CD2-CD2 4.17Å; L180-F427 HydrophobicContact CD2-CE1 3.8Å; L180-F427 HydrophobicContact CD2-CE2 4.19Å; L180-F427 HydrophobicContact CD2-CG 3.94Å; L180-F427 HydrophobicContact CD2-CZ 3.98Å; L180-V430 HydrophobicContact CD1-CG1 4.15Å; L180-A431 HydrophobicContact CB-CB 4.24Å |
| 181 | L | 92.9 | Very high | 88 | Confident | 32 Ų | 32 | 25.7 Ų | 25.7 | 17% | 0.168 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -70 | -40.8 | 174.8 | -70.4 | 170.7 | 0 | 0 | 0 | 111.5 | S177 G179 F185 I428 A431 T432 | S177-L181 WeakPolarHBondContact O-CB 3.47Å; S177-L181 VanDerWaalsContact O-CG 3.26Å; S177-L181 WeakPolarHBondContact O-CG 3.5Å; S177-L181 PolarHBondContact O-N 3Å; G179-L181 PolarHBondContact O-N 3.27Å; L181-F185 HydrophobicContact CD2-CE2 4.1Å; L181-F185 WeakPolarHBondContact O-CB 3.41Å; L181-F185 VanDerWaalsContact O-CD2 3.27Å; L181-F185 WeakPolarHBondContact O-CD2 3.29Å; L181-F185 PolarHBondContact O-N 3.01Å; L181-I428 HydrophobicContact CD2-CG1 4.49Å; L181-A431 HydrophobicContact CD1-CB 4.23Å; L181-A431 HydrophobicContact CD2-CB 3.79Å; L181-A431 HydrophobicContact CG-CB 3.65Å; L181-T432 HydrophobicContact CD2-CG2 4.18Å |
| 182 | G | 91.6 | Very high | 87.5 | Confident | 2 Ų | 2 | 24.9 Ų | 24.9 | 2% | 0.021 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -58.6 | -48.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.4 | G178 G179 F185 L186 | G178-G182 WeakPolarHBondContact O-CA 3.1Å; G178-G182 PolarHBondContact O-N 2.89Å; G179-G182 CarbonylContact O-C 3.58Å; G179-G182 WeakPolarHBondContact O-CA 3.49Å; G179-G182 PolarHBondContact O-N 2.98Å; G179-G182 VanDerWaalsContact O-N 3.13Å; G182-F185 PolarHBondContact O-N 3.47Å; G182-L186 WeakPolarHBondContact O-CA 3.32Å; G182-L186 WeakPolarHBondContact O-CB 3.38Å; G182-L186 WeakPolarHBondContact O-CG 3.45Å; G182-L186 PolarHBondContact O-N 3.02Å |
| 183 | D | 87.7 | Confident | 87.1 | Confident | 0 Ų | 0 | 26.3 Ų | 26.3 | 0% | 0 | 14% | 0.136 | C | C | . | . | I | π-helix | trans | -61.8 | -50.1 | 178 | -176.9 | 57 | 0 | 0 | 0 | 111.7 | G179 F185 H187 L188 H329 F427 M462 | G179-D183 WeakPolarHBondContact O-CB 3.34Å; G179-D183 PolarHBondContact O-N 2.79Å; D183-F185 PolarHBondContact O-N 3.3Å; D183-H187 CarbonylContact O-C 3.6Å; D183-H187 WeakPolarHBondContact O-CA 3.33Å; D183-H187 WeakPolarHBondContact O-CB 3.23Å; D183-H187 PolarHBondContact O-N 2.88Å; D183-H187 WeakPolarHBondContact OD1-CB 3.43Å; D183-H187 IonicContact OD1-CD2 3.8Å; D183-H187 PolarHBondContact OD1-CD2 3.5Å; D183-H187 IonicContact OD1-CG 3.72Å; D183-L188 PolarHBondContact O-N 2.87Å; D183-L188 VanDerWaalsContact OD2-CD1 3.23Å; D183-L188 WeakPolarHBondContact OD2-CD1 3.14Å; D183-L188 WeakPolarHBondContact OD2-CG 3.46Å; D183-H329 IonicContact OD1-CE1 3.99Å; D183-H329 IonicContact OD2-CE1 3.71Å; D183-H329 PolarHBondContact OD2-CE1 2.94Å; D183-H329 VanDerWaalsContact OD2-CE1 3.25Å; D183-H329 IonicContact OD2-ND1 4Å; D183-F427 WeakPolarHBondContact OD2-CD2 3.02Å; D183-F427 WeakPolarHBondContact OD2-CE2 3.39Å; D183-M462 HydrophobicContact CB-CE 3.81Å; D183-M462 HydrophobicContact CB-SD 4.4Å |
| 184 | A | 89.8 | Confident | 86.3 | Confident | 0 Ų | 0 | 32.3 Ų | 32.3 | 0% | 0 | 16% | 0.164 | C | C | . | . | I | π-helix | trans | -56.6 | -47.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | L180 I189 A424 F427 I428 | L180-A184 WeakPolarHBondContact O-CB 3.34Å; L180-A184 PolarHBondContact O-N 3.45Å; A184-I189 WeakPolarHBondContact O-CB 3.36Å; A184-I189 WeakPolarHBondContact O-CD1 3.49Å; A184-I189 WeakPolarHBondContact O-CG1 3.35Å; A184-I189 PolarHBondContact O-N 3Å; A184-A424 HydrophobicContact CB-CB 4.03Å; A184-F427 HydrophobicContact CB-CB 4.19Å; A184-I428 HydrophobicContact CB-CD1 4.32Å; A184-I428 HydrophobicContact CB-CG1 3.89Å |
| 185 | F | 92.3 | Very high | 84.6 | Confident | 111 Ų | 111 | 35.9 Ų | 35.9 | 49% | 0.487 | 19% | 0.188 | S | C | . | . | I | π-helix | trans | -89.9 | -27.6 | -172.1 | -76.2 | -66.6 | 0 | 0 | 0 | 115.2 | L181 G182 D183 I189 P190 I428 | L181-F185 HydrophobicContact CD2-CE2 4.1Å; L181-F185 WeakPolarHBondContact O-CB 3.41Å; L181-F185 VanDerWaalsContact O-CD2 3.27Å; L181-F185 WeakPolarHBondContact O-CD2 3.29Å; L181-F185 PolarHBondContact O-N 3.01Å; G182-F185 PolarHBondContact O-N 3.47Å; D183-F185 PolarHBondContact O-N 3.3Å; F185-I189 HydrophobicContact CD1-CD1 3.92Å; F185-I189 HydrophobicContact CE1-CD1 4.13Å; F185-P190 VanDerWaalsContact O-CD 3.28Å; F185-P190 WeakPolarHBondContact O-CD 3.29Å; F185-P190 WeakPolarHBondContact O-CG 3.4Å; F185-I428 HydrophobicContact CE1-CD1 4.13Å; F185-I428 HydrophobicContact CE2-CD1 4.08Å; F185-I428 HydrophobicContact CE2-CG1 3.97Å; F185-I428 HydrophobicContact CZ-CD1 3.69Å; F185-I428 HydrophobicContact CZ-CG1 4.07Å |
| 186 | L | 88.7 | Confident | 82.7 | Confident | 71 Ų | 71 | 37.7 Ų | 37.7 | 37% | 0.372 | 20% | 0.197 | S | C | . | . | I | π-helix | trans | -108.6 | -19.5 | -172.9 | -53.2 | 177.2 | 0 | 0 | 0 | 112.8 | G182 V459 V463 | G182-L186 WeakPolarHBondContact O-CA 3.32Å; G182-L186 WeakPolarHBondContact O-CB 3.38Å; G182-L186 WeakPolarHBondContact O-CG 3.45Å; G182-L186 PolarHBondContact O-N 3.02Å; L186-V459 HydrophobicContact CD1-CG1 4.42Å; L186-V463 HydrophobicContact CD1-CG2 3.45Å; L186-V463 VanDerWaalsContact CD1-CG2 3.45Å |
| 187 | H | 82 | Confident | 80.4 | Confident | 27 Ų | 27 | 42.7 Ų | 42.7 | 13% | 0.125 | 23% | 0.231 | C | C | . | . | I | π-helix | trans | -115.1 | -69.4 | 178.9 | -172.3 | 71.1 | 0 | 0 | 0 | 110.4 | D183 I189 P190 H191 M462 E469 | D183-H187 CarbonylContact O-C 3.6Å; D183-H187 WeakPolarHBondContact O-CA 3.33Å; D183-H187 WeakPolarHBondContact O-CB 3.23Å; D183-H187 PolarHBondContact O-N 2.88Å; D183-H187 WeakPolarHBondContact OD1-CB 3.43Å; D183-H187 IonicContact OD1-CD2 3.8Å; D183-H187 PolarHBondContact OD1-CD2 3.5Å; D183-H187 IonicContact OD1-CG 3.72Å; H187-I189 PolarHBondContact O-N 3.46Å; H187-P190 WeakPolarHBondContact O-CD 3.47Å; H187-H191 VanDerWaalsContact O-CB 3.29Å; H187-H191 WeakPolarHBondContact O-CB 3.22Å; H187-H191 PolarHBondContact O-N 3.38Å; H187-M462 HydrophobicContact CB-CE 4.49Å; H187-E469 IonicContact CE1-OE1 3.25Å; H187-E469 PolarHBondContact CE1-OE1 3.46Å; H187-E469 IonicContact CE1-OE2 3.98Å; H187-E469 PolarHBondContact CE1-OE2 3.47Å; H187-E469 IonicContact CG-OE2 3.07Å; H187-E469 IonicContact ND1-OE1 3.38Å; H187-E469 PolarHBondContact ND1-OE1 3.07Å; H187-E469 IonicContact ND1-OE2 3.37Å; H187-E469 PolarHBondContact ND1-OE2 3.25Å; H187-E469 IonicContact NE2-OE1 3.69Å |
| 188 | L | 84.4 | Confident | 78.1 | Confident | 2 Ų | 2 | 49.9 Ų | 49.9 | 1% | 0.01 | 27% | 0.265 | C | S | . | . | I | π-helix | trans | -63.8 | -47.8 | -170.3 | -60.1 | -179.3 | 0 | 0 | 0 | 115 | D183 A192 L420 T423 A424 F427 | D183-L188 PolarHBondContact O-N 2.87Å; D183-L188 VanDerWaalsContact OD2-CD1 3.23Å; D183-L188 WeakPolarHBondContact OD2-CD1 3.14Å; D183-L188 WeakPolarHBondContact OD2-CG 3.46Å; L188-A192 WeakPolarHBondContact O-CB 3.48Å; L188-A192 PolarHBondContact O-N 3Å; L188-A192 VanDerWaalsContact O-N 3.12Å; L188-L420 HydrophobicContact CD2-CD2 3.79Å; L188-T423 HydrophobicContact CD1-CG2 4.09Å; L188-A424 HydrophobicContact CB-CB 3.84Å; L188-A424 HydrophobicContact CD1-CB 3.95Å; L188-F427 HydrophobicContact CD1-CD2 3.92Å; L188-F427 HydrophobicContact CD1-CE2 4.19Å |
| 189 | I | 87.7 | Confident | 75.4 | Confident | 29 Ų | 29 | 59.1 Ų | 59.1 | 15% | 0.149 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -67.5 | -50.8 | -178.9 | -71.9 | 166.7 | 0 | 0 | 0 | 111.5 | A184 F185 H187 H191 A192 L193 V219 V223 A424 I428 | A184-I189 WeakPolarHBondContact O-CB 3.36Å; A184-I189 WeakPolarHBondContact O-CD1 3.49Å; A184-I189 WeakPolarHBondContact O-CG1 3.35Å; A184-I189 PolarHBondContact O-N 3Å; F185-I189 HydrophobicContact CD1-CD1 3.92Å; F185-I189 HydrophobicContact CE1-CD1 4.13Å; H187-I189 PolarHBondContact O-N 3.46Å; I189-H191 VanDerWaalsContact C-N 3.33Å; I189-H191 PolarHBondContact O-N 2.8Å; I189-A192 PolarHBondContact O-N 3.42Å; I189-L193 HydrophobicContact CG2-CD1 3.92Å; I189-L193 HydrophobicContact CG2-CG 4.49Å; I189-L193 WeakPolarHBondContact O-CG 3.36Å; I189-L193 PolarHBondContact O-N 3.38Å; I189-V219 HydrophobicContact CG2-CG1 4.43Å; I189-V223 HydrophobicContact CD1-CG2 4.08Å; I189-V223 HydrophobicContact CG1-CG2 3.93Å; I189-A424 HydrophobicContact CD1-CB 4.27Å; I189-A424 HydrophobicContact CG1-CB 3.83Å; I189-I428 HydrophobicContact CD1-CD1 4.3Å |
| 190 | P | 83.8 | Confident | 73 | Confident | 49 Ų | 49 | 65 Ų | 65 | 32% | 0.318 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -57.5 | -43.1 | 176.4 | -27.6 | 37 | 0 | 0 | 0 | 113.1 | F185 H187 A192 L193 E194 | F185-P190 VanDerWaalsContact O-CD 3.28Å; F185-P190 WeakPolarHBondContact O-CD 3.29Å; F185-P190 WeakPolarHBondContact O-CG 3.4Å; H187-P190 WeakPolarHBondContact O-CD 3.47Å; P190-A192 VanDerWaalsContact C-N 3.26Å; P190-A192 PolarHBondContact O-N 3.07Å; P190-L193 WeakPolarHBondContact O-CA 3.27Å; P190-L193 WeakPolarHBondContact O-CB 3.33Å; P190-L193 PolarHBondContact O-N 2.91Å; P190-E194 PolarHBondContact O-N 3.38Å; P190-E194 VanDerWaalsContact O-N 3.13Å |
| 191 | H | 78.1 | Confident | 70.8 | Confident | 76 Ų | 76 | 72.7 Ų | 72.7 | 35% | 0.352 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -63.1 | -33.9 | 178.6 | -135.6 | 76.8 | 0 | 0 | 0 | 112.4 | H187 I189 L193 L420 | H187-H191 VanDerWaalsContact O-CB 3.29Å; H187-H191 WeakPolarHBondContact O-CB 3.22Å; H187-H191 PolarHBondContact O-N 3.38Å; I189-H191 VanDerWaalsContact C-N 3.33Å; I189-H191 PolarHBondContact O-N 2.8Å; H191-L193 VanDerWaalsContact C-N 3.27Å; H191-L193 PolarHBondContact O-N 2.87Å; H191-L420 HydrophobicContact CB-CD1 4.43Å |
| 192 | A | 78.4 | Confident | 68.6 | Low | 26 Ų | 26 | 78.1 Ų | 78.1 | 22% | 0.215 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -72 | -20.2 | 173.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | L188 I189 P190 V219 L420 P421 | L188-A192 WeakPolarHBondContact O-CB 3.48Å; L188-A192 PolarHBondContact O-N 3Å; L188-A192 VanDerWaalsContact O-N 3.12Å; I189-A192 PolarHBondContact O-N 3.42Å; P190-A192 VanDerWaalsContact C-N 3.26Å; P190-A192 PolarHBondContact O-N 3.07Å; A192-V219 HydrophobicContact CB-CG1 4.1Å; A192-V219 HydrophobicContact CB-CG2 3.94Å; A192-V219 WeakPolarHBondContact O-CG2 3.06Å; A192-L420 HydrophobicContact CB-CB 4.33Å; A192-P421 HydrophobicContact CB-CB 4.43Å; A192-P421 HydrophobicContact CB-CG 4.15Å |
| 193 | L | 79.8 | Confident | 66 | Low | 62 Ų | 62 | 87.3 Ų | 87.3 | 33% | 0.325 | 45% | 0.45 | S | S | . | . | H | α-helix | trans | -91.4 | -22.8 | -178.7 | -70.5 | 171.8 | 0 | 0 | 0 | 113.7 | I189 P190 H191 P195 I216 V219 | I189-L193 HydrophobicContact CG2-CD1 3.92Å; I189-L193 HydrophobicContact CG2-CG 4.49Å; I189-L193 WeakPolarHBondContact O-CG 3.36Å; I189-L193 PolarHBondContact O-N 3.38Å; P190-L193 WeakPolarHBondContact O-CA 3.27Å; P190-L193 WeakPolarHBondContact O-CB 3.33Å; P190-L193 PolarHBondContact O-N 2.91Å; H191-L193 VanDerWaalsContact C-N 3.27Å; H191-L193 PolarHBondContact O-N 2.87Å; L193-P195 WeakPolarHBondContact O-CD 3.42Å; L193-I216 HydrophobicContact CD2-CB 4.24Å; L193-I216 HydrophobicContact CD2-CG1 3.97Å; L193-I216 HydrophobicContact CD2-CG2 4.38Å; L193-V219 HydrophobicContact CD2-CB 3.82Å; L193-V219 HydrophobicContact CD2-CG1 3.88Å; L193-V219 HydrophobicContact CD2-CG2 3.86Å; L193-V219 HydrophobicContact CG-CG1 4.09Å; L193-V219 HydrophobicContact CG-CG2 4.43Å |
| 194 | E | 68.3 | Low | 64.1 | Low | 127 Ų | 127 | 95 Ų | 95 | 59% | 0.593 | 49% | 0.486 | S | S | * | . | trans | -93.1 | 100.6 | 178.4 | -77.2 | -172 | 171.5 | 0 | 0 | 111.6 | P190 H196 | P190-E194 PolarHBondContact O-N 3.38Å; P190-E194 VanDerWaalsContact O-N 3.13Å; E194-H196 PolarHBondContact O-N 3.23Å; E194-H196 VanDerWaalsContact O-N 3.12Å | ||
| 195 | P | 54.7 | Low | 61.6 | Low | 79 Ų | 79 | 98.2 Ų | 98.2 | 51% | 0.513 | 52% | 0.519 | S | S | . | . | trans | -72.4 | 105 | 167.2 | 27.4 | -31.5 | 0 | 0 | 0 | 108.7 | L193 S197 | L193-P195 WeakPolarHBondContact O-CD 3.42Å; P195-S197 PolarHBondContact O-N 3.23Å; P195-S197 PolarHBondContact O-OG 3.47Å | ||
| 196 | H | 51.9 | Low | 59.7 | Low | 90 Ų | 90 | 102.2 Ų | 102.2 | 42% | 0.417 | 54% | 0.539 | S | S | . | . | trans | -55.7 | 110.6 | 171.6 | -72.8 | -37.1 | 0 | 0 | 0 | 110.2 | E194 H198 | E194-H196 PolarHBondContact O-N 3.23Å; E194-H196 VanDerWaalsContact O-N 3.12Å; H196-H198 PolarHBondContact O-N 3.29Å | ||
| 197 | S | 36.6 | Very low | 57.2 | Low | 107 Ų | 107 | 102 Ų | 102 | 75% | 0.748 | 55% | 0.554 | S | S | * | * | trans | -79.1 | 82 | -177.5 | -50.8 | 0 | 0 | 0 | 0 | 109.2 | P195 H199 | P195-S197 PolarHBondContact O-N 3.23Å; P195-S197 PolarHBondContact O-OG 3.47Å; S197-H199 PolarHBondContact O-N 3.11Å | ||
| 198 | H | 41.3 | Very low | 55.3 | Low | 152 Ų | 152 | 109.3 Ų | 109.3 | 70% | 0.704 | 59% | 0.588 | S | S | * | * | trans | -70.4 | 115 | 167.6 | -75.7 | -76 | 0 | 0 | 0 | 109 | H196 T200 | H196-H198 PolarHBondContact O-N 3.29Å; H198-T200 VanDerWaalsContact C-N 3.29Å; H198-T200 PolarHBondContact O-N 3.49Å | ||
| 199 | H | 35.7 | Very low | 53.2 | Low | 193 Ų | 193 | 114.9 Ų | 114.9 | 89% | 0.894 | 63% | 0.626 | S | S | * | * | trans | -58.5 | 86.9 | 168.1 | -81.8 | -87.8 | 0 | 0 | 0 | 110.5 | S197 | S197-H199 PolarHBondContact O-N 3.11Š| ||
| 200 | T | 37.8 | Very low | 51.2 | Low | 127 Ų | 127 | 121.6 Ų | 121.6 | 78% | 0.779 | 66% | 0.657 | S | S | * | * | trans | -91.4 | 110.4 | 156.6 | 50 | 0 | 0 | 0 | 0 | 108.1 | H198 E202 | H198-T200 VanDerWaalsContact C-N 3.29Å; H198-T200 PolarHBondContact O-N 3.49Å; T200-E202 PolarHBondContact O-N 2.98Å | ||
| 201 | L | 44.1 | Very low | 49.2 | Very low | 164 Ų | 164 | 123.1 Ų | 123.1 | 86% | 0.859 | 67% | 0.669 | S | S | * | * | trans | -44.9 | 129.5 | 168.8 | -91.2 | 144.3 | 0 | 0 | 0 | 111.3 | ||||
| 202 | E | 46.1 | Very low | 47.9 | Very low | 146 Ų | 146 | 123.1 Ų | 123.1 | 68% | 0.682 | 69% | 0.689 | S | S | * | * | trans | 57.3 | 89.8 | 150.1 | -67.3 | -79 | 148 | 0 | 0 | 117.5 | T200 H204 | T200-E202 PolarHBondContact O-N 2.98Å; E202-H204 IonicContact OE2-ND1 3.94Å | ||
| 203 | Q | 37.2 | Very low | 46.6 | Very low | 196 Ų | 196 | 128.8 Ų | 128.8 | 92% | 0.916 | 71% | 0.711 | S | S | * | * | trans | -148.2 | 107.6 | 135.8 | -143 | 170.7 | 10.8 | 0 | 0 | 111.9 | G205 | Q203-G205 PolarHBondContact O-N 3.38Š| ||
| 204 | H | 47.3 | Very low | 45.7 | Very low | 161 Ų | 161 | 127.8 Ų | 127.8 | 75% | 0.745 | 72% | 0.716 | S | S | * | * | trans | -67.8 | 99 | 173.3 | -79 | 53.4 | 0 | 0 | 0 | 110.4 | E202 | E202-H204 IonicContact OE2-ND1 3.94Š| ||
| 205 | G | 37.4 | Very low | 45.8 | Very low | 68 Ų | 68 | 125.1 Ų | 125.1 | 70% | 0.701 | 71% | 0.71 | S | S | * | * | trans | -120.3 | 106.6 | 167.5 | 0 | 0 | 0 | 0 | 0 | 110.1 | Q203 G207 | Q203-G205 PolarHBondContact O-N 3.38Å; G205-G207 PolarHBondContact O-N 3.23Å | ||
| 206 | H | 52.9 | Low | 47.1 | Very low | 195 Ų | 195 | 126.6 Ų | 126.6 | 90% | 0.903 | 71% | 0.712 | S | S | * | * | trans | -61.5 | 104.3 | 175.8 | -70.8 | -73.1 | 0 | 0 | 0 | 111.3 | ||||
| 207 | G | 36 | Very low | 48.6 | Very low | 66 Ų | 66 | 127.7 Ų | 127.7 | 68% | 0.68 | 72% | 0.721 | S | S | * | * | trans | -124 | 124.3 | 169.4 | 0 | 0 | 0 | 0 | 0 | 110 | G205 S209 | G205-G207 PolarHBondContact O-N 3.23Å; G207-S209 PolarHBondContact O-N 2.94Å | ||
| 208 | H | 42.8 | Very low | 50.9 | Low | 181 Ų | 181 | 125 Ų | 125 | 84% | 0.838 | 70% | 0.702 | S | S | * | * | trans | -58.1 | 130.4 | -170.6 | -65.5 | -80.3 | 0 | 0 | 0 | 113.7 | H210 | H208-H210 PolarHBondContact O-N 3.26Š| ||
| 209 | S | 40.1 | Very low | 53 | Low | 118 Ų | 118 | 118.1 Ų | 118.1 | 83% | 0.825 | 67% | 0.671 | S | S | * | * | trans | -64 | 108.9 | 175.9 | 51.1 | 0 | 0 | 0 | 0 | 112.2 | G207 | G207-S209 PolarHBondContact O-N 2.94Š| ||
| 210 | H | 44.6 | Very low | 55.6 | Low | 171 Ų | 171 | 110.8 Ų | 110.8 | 79% | 0.792 | 65% | 0.647 | S | S | * | * | trans | -99.1 | 115.8 | 152.8 | -72.7 | -75.9 | 0 | 0 | 0 | 108.2 | H208 | H208-H210 PolarHBondContact O-N 3.26Š| ||
| 211 | S | 42.1 | Very low | 58.1 | Low | 81 Ų | 81 | 109.5 Ų | 109.5 | 57% | 0.566 | 64% | 0.635 | S | S | * | * | trans | 1.3 | 131.3 | 161.6 | 53.6 | 0 | 0 | 0 | 0 | 117.4 | Q213 G214 | S211-Q213 PolarHBondContact O-N 3.38Å; S211-G214 PolarHBondContact O-N 2.91Å | ||
| 212 | G | 49.9 | Very low | 60.3 | Low | 76 Ų | 76 | 106.3 Ų | 106.3 | 78% | 0.784 | 61% | 0.612 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -60.9 | 30.4 | 175.4 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||
| 213 | Q | 51.9 | Low | 62.5 | Low | 144 Ų | 144 | 100.2 Ų | 100.2 | 67% | 0.673 | 58% | 0.584 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -104.4 | -9.8 | 169 | -70 | -179.9 | -21.4 | 0 | 0 | 112.9 | S211 L217 | S211-Q213 PolarHBondContact O-N 3.38Å; Q213-L217 WeakPolarHBondContact O-CB 3.14Å; Q213-L217 PolarHBondContact O-N 2.97Å; Q213-L217 VanDerWaalsContact O-N 3.11Å |
| 214 | G | 61.4 | Low | 65.1 | Low | 42 Ų | 42 | 95.5 Ų | 95.5 | 43% | 0.433 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -58.4 | -51.6 | -178.4 | 0 | 0 | 0 | 0 | 0 | 114.4 | S211 L217 S218 | S211-G214 PolarHBondContact O-N 2.91Å; G214-L217 PolarHBondContact O-N 3.07Å; G214-S218 PolarHBondContact O-N 3.46Å; G214-S218 PolarHBondContact O-OG 3.11Å |
| 215 | P | 70.4 | Confident | 67.2 | Low | 70 Ų | 70 | 90.1 Ų | 90.1 | 46% | 0.455 | 55% | 0.545 | S | S | . | . | H | α-helix | trans | -66 | -39 | -178.4 | -23.6 | 34.6 | 0 | 0 | 0 | 113.8 | S218 V219 | P215-S218 WeakPolarHBondContact CA-OG 3.3Å; P215-S218 PolarHBondContact O-N 3.27Å; P215-S218 PolarHBondContact O-OG 2.98Å; P215-V219 WeakPolarHBondContact O-CB 3.24Å; P215-V219 VanDerWaalsContact O-CG2 3.25Å; P215-V219 WeakPolarHBondContact O-CG2 3.47Å; P215-V219 PolarHBondContact O-N 3.43Å |
| 216 | I | 81.3 | Confident | 69.6 | Low | 110 Ų | 110 | 86.9 Ų | 86.9 | 56% | 0.564 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -68.6 | -43.2 | 179.9 | -58.4 | 167.2 | 0 | 0 | 0 | 110.4 | L193 G220 | L193-I216 HydrophobicContact CD2-CB 4.24Å; L193-I216 HydrophobicContact CD2-CG1 3.97Å; L193-I216 HydrophobicContact CD2-CG2 4.38Å; I216-G220 PolarHBondContact O-N 3.02Å |
| 217 | L | 83.6 | Confident | 71.5 | Confident | 114 Ų | 114 | 79.8 Ų | 79.8 | 60% | 0.597 | 48% | 0.48 | S | S | * | . | H | α-helix | trans | -65.1 | -41.4 | 177.4 | -179.1 | 62.3 | 0 | 0 | 0 | 111.2 | Q213 G214 G220 L221 | Q213-L217 WeakPolarHBondContact O-CB 3.14Å; Q213-L217 PolarHBondContact O-N 2.97Å; Q213-L217 VanDerWaalsContact O-N 3.11Å; G214-L217 PolarHBondContact O-N 3.07Å; L217-G220 PolarHBondContact O-N 3.08Å; L217-L221 HydrophobicContact CD1-CD1 4.41Å; L217-L221 HydrophobicContact CD1-CG 4.31Å; L217-L221 HydrophobicContact CG-CD1 4.11Å; L217-L221 HydrophobicContact CG-CG 4.44Å; L217-L221 WeakPolarHBondContact O-CB 3.27Å; L217-L221 WeakPolarHBondContact O-CG 3.39Å; L217-L221 PolarHBondContact O-N 3.47Å |
| 218 | S | 84.6 | Confident | 74.2 | Confident | 49 Ų | 49 | 80.2 Ų | 80.2 | 34% | 0.343 | 47% | 0.469 | S | S | . | . | H | α-helix | trans | -64.9 | -45.1 | 178 | 61.2 | 0 | 0 | 0 | 0 | 112 | G214 P215 L221 W222 | G214-S218 PolarHBondContact O-N 3.46Å; G214-S218 PolarHBondContact O-OG 3.11Å; P215-S218 WeakPolarHBondContact CA-OG 3.3Å; P215-S218 PolarHBondContact O-N 3.27Å; P215-S218 PolarHBondContact O-OG 2.98Å; S218-L221 PolarHBondContact O-N 3.16Å; S218-W222 PolarHBondContact O-N 3.34Å |
| 219 | V | 86.6 | Confident | 76.3 | Confident | 9 Ų | 9 | 73.1 Ų | 73.1 | 6% | 0.055 | 44% | 0.442 | C | S | . | . | H | α-helix | trans | -57.8 | -50.5 | 174.5 | 169.1 | 0 | 0 | 0 | 0 | 110.3 | I189 A192 L193 P215 L221 W222 V223 P421 | I189-V219 HydrophobicContact CG2-CG1 4.43Å; A192-V219 HydrophobicContact CB-CG1 4.1Å; A192-V219 HydrophobicContact CB-CG2 3.94Å; A192-V219 WeakPolarHBondContact O-CG2 3.06Å; L193-V219 HydrophobicContact CD2-CB 3.82Å; L193-V219 HydrophobicContact CD2-CG1 3.88Å; L193-V219 HydrophobicContact CD2-CG2 3.86Å; L193-V219 HydrophobicContact CG-CG1 4.09Å; L193-V219 HydrophobicContact CG-CG2 4.43Å; P215-V219 WeakPolarHBondContact O-CB 3.24Å; P215-V219 VanDerWaalsContact O-CG2 3.25Å; P215-V219 WeakPolarHBondContact O-CG2 3.47Å; P215-V219 PolarHBondContact O-N 3.43Å; V219-L221 VanDerWaalsContact C-N 3.31Å; V219-L221 PolarHBondContact O-N 3.44Å; V219-W222 PolarHBondContact O-N 3.31Å; V219-W222 VanDerWaalsContact O-N 3.1Å; V219-V223 WeakPolarHBondContact O-CG2 3.43Å; V219-V223 PolarHBondContact O-N 2.95Å; V219-P421 HydrophobicContact CG1-CB 3.96Å; V219-P421 WeakPolarHBondContact O-CB 3.29Å |
| 220 | G | 89.8 | Confident | 78.6 | Confident | 39 Ų | 39 | 68.3 Ų | 68.3 | 40% | 0.402 | 41% | 0.406 | S | S | . | . | H | α-helix | trans | -59.2 | -38.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | I216 L217 V223 L224 | I216-G220 PolarHBondContact O-N 3.02Å; L217-G220 PolarHBondContact O-N 3.08Å; G220-V223 PolarHBondContact O-N 2.92Å; G220-L224 WeakPolarHBondContact O-CB 3.24Å; G220-L224 PolarHBondContact O-N 3.06Å |
| 221 | L | 89.9 | Confident | 80.7 | Confident | 99 Ų | 99 | 64.1 Ų | 64.1 | 52% | 0.518 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -66 | -36.9 | 175.5 | -75 | 171.7 | 0 | 0 | 0 | 112.4 | L217 S218 V219 L224 S225 | L217-L221 HydrophobicContact CD1-CD1 4.41Å; L217-L221 HydrophobicContact CD1-CG 4.31Å; L217-L221 HydrophobicContact CG-CD1 4.11Å; L217-L221 HydrophobicContact CG-CG 4.44Å; L217-L221 WeakPolarHBondContact O-CB 3.27Å; L217-L221 WeakPolarHBondContact O-CG 3.39Å; L217-L221 PolarHBondContact O-N 3.47Å; S218-L221 PolarHBondContact O-N 3.16Å; V219-L221 VanDerWaalsContact C-N 3.31Å; V219-L221 PolarHBondContact O-N 3.44Å; L221-L224 PolarHBondContact O-N 3.37Å; L221-S225 VanDerWaalsContact O-CB 3.31Å; L221-S225 WeakPolarHBondContact O-CB 3.36Å; L221-S225 PolarHBondContact O-N 3.48Å |
| 222 | W | 89.9 | Confident | 82.9 | Confident | 98 Ų | 98 | 64.2 Ų | 64.2 | 37% | 0.371 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -73.3 | -37.3 | 176.6 | -73.8 | 118.9 | 0 | 0 | 0 | 112.8 | S218 V219 L224 S225 G226 W418 P421 F422 | S218-W222 PolarHBondContact O-N 3.34Å; V219-W222 PolarHBondContact O-N 3.31Å; V219-W222 VanDerWaalsContact O-N 3.1Å; W222-L224 VanDerWaalsContact C-N 3.33Å; W222-L224 PolarHBondContact O-N 3.47Å; W222-S225 WeakPolarHBondContact O-CB 3.25Å; W222-S225 PolarHBondContact O-N 3.32Å; W222-G226 PolarHBondContact O-N 3.01Å; W222-W418 HydrophobicContact CB-CB 4.34Å; W222-W418 HydrophobicContact CD2-CB 3.23Å; W222-W418 HydrophobicContact CD2-CG 4.25Å; W222-W418 HydrophobicContact CE3-CB 3.67Å; W222-W418 HydrophobicContact CE3-CG 4.33Å; W222-W418 HydrophobicContact CG-CB 3.51Å; W222-W418 HydrophobicContact CH2-CB 4.04Å; W222-W418 HydrophobicContact CH2-CG 4.1Å; W222-W418 HydrophobicContact CZ2-CB 3.65Å; W222-W418 HydrophobicContact CZ2-CG 4.01Å; W222-W418 HydrophobicContact CZ3-CB 4.05Å; W222-W418 HydrophobicContact CZ3-CD2 4.4Å; W222-W418 HydrophobicContact CZ3-CE3 4.45Å; W222-W418 HydrophobicContact CZ3-CG 4.25Å; W222-P421 HydrophobicContact CB-CB 3.83Å; W222-P421 HydrophobicContact CB-CG 3.64Å; W222-P421 HydrophobicContact CG-CG 4.42Å; W222-F422 WeakPolarHBondContact O-CA 3.43Å |
| 223 | V | 92.3 | Very high | 84.4 | Confident | 17 Ų | 17 | 64 Ų | 64 | 10% | 0.103 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -57.1 | -48.9 | 168.3 | 177.3 | 0 | 0 | 0 | 0 | 110.4 | I189 V219 G220 S225 G226 I227 P421 G425 I428 | I189-V223 HydrophobicContact CD1-CG2 4.08Å; I189-V223 HydrophobicContact CG1-CG2 3.93Å; V219-V223 WeakPolarHBondContact O-CG2 3.43Å; V219-V223 PolarHBondContact O-N 2.95Å; G220-V223 PolarHBondContact O-N 2.92Å; V223-S225 VanDerWaalsContact C-N 3.32Å; V223-S225 PolarHBondContact O-N 3.47Å; V223-G226 PolarHBondContact O-N 2.83Å; V223-I227 HydrophobicContact CG1-CD1 4.27Å; V223-I227 WeakPolarHBondContact O-CG1 3.33Å; V223-I227 PolarHBondContact O-N 3.39Å; V223-I227 VanDerWaalsContact O-N 3.08Å; V223-P421 WeakPolarHBondContact CA-O 3.43Å; V223-P421 HydrophobicContact CG2-CB 3.66Å; V223-P421 WeakPolarHBondContact CG2-O 3.32Å; V223-G425 WeakPolarHBondContact O-CA 3.5Å; V223-I428 HydrophobicContact CG1-CD1 4Å |
| 224 | L | 93.2 | Very high | 85.9 | Confident | 98 Ų | 98 | 57.4 Ų | 57.4 | 51% | 0.513 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -63 | -39.7 | 177.9 | -173.8 | 63.7 | 0 | 0 | 0 | 111.9 | G220 L221 W222 G226 I227 V228 | G220-L224 WeakPolarHBondContact O-CB 3.24Å; G220-L224 PolarHBondContact O-N 3.06Å; L221-L224 PolarHBondContact O-N 3.37Å; W222-L224 VanDerWaalsContact C-N 3.33Å; W222-L224 PolarHBondContact O-N 3.47Å; L224-G226 VanDerWaalsContact C-N 3.33Å; L224-G226 PolarHBondContact O-N 3.36Å; L224-I227 PolarHBondContact O-N 2.93Å; L224-V228 HydrophobicContact CG-CG2 4.48Å; L224-V228 WeakPolarHBondContact O-CB 3.48Å; L224-V228 VanDerWaalsContact O-CG2 3.31Å; L224-V228 WeakPolarHBondContact O-CG2 3.1Å; L224-V228 PolarHBondContact O-N 3.41Å |
| 225 | S | 90.1 | Very high | 86.9 | Confident | 47 Ų | 47 | 62.5 Ų | 62.5 | 33% | 0.329 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -59.7 | -43 | 175.3 | -170.7 | 0 | 0 | 0 | 0 | 111.6 | L221 W222 V223 V228 A229 | L221-S225 VanDerWaalsContact O-CB 3.31Å; L221-S225 WeakPolarHBondContact O-CB 3.36Å; L221-S225 PolarHBondContact O-N 3.48Å; W222-S225 WeakPolarHBondContact O-CB 3.25Å; W222-S225 PolarHBondContact O-N 3.32Å; V223-S225 VanDerWaalsContact C-N 3.32Å; V223-S225 PolarHBondContact O-N 3.47Å; S225-V228 PolarHBondContact O-N 2.91Å; S225-A229 VanDerWaalsContact O-CB 3.28Å; S225-A229 WeakPolarHBondContact O-CB 3.22Å; S225-A229 PolarHBondContact O-N 3.07Å |
| 226 | G | 88.9 | Confident | 87.5 | Confident | 0 Ų | 0 | 65.6 Ų | 65.6 | 0% | 0 | 36% | 0.356 | C | S | . | . | H | α-helix | trans | -58 | -50.8 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | W222 V223 L224 V228 A229 F230 F422 | W222-G226 PolarHBondContact O-N 3.01Å; V223-G226 PolarHBondContact O-N 2.83Å; L224-G226 VanDerWaalsContact C-N 3.33Å; L224-G226 PolarHBondContact O-N 3.36Å; G226-V228 VanDerWaalsContact C-N 3.34Å; G226-V228 PolarHBondContact O-N 3.49Å; G226-A229 PolarHBondContact O-N 3.4Å; G226-F230 WeakPolarHBondContact O-CD2 3.35Å; G226-F230 PolarHBondContact O-N 3.36Å; G226-F422 VanDerWaalsContact CA-CD2 3.49Å; G226-F422 WeakPolarHBondContact CA-O 3.22Å |
| 227 | I | 92.6 | Very high | 87.3 | Confident | 47 Ų | 47 | 62 Ų | 62 | 24% | 0.241 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -56.9 | -47.1 | 176.6 | -66.3 | 170 | 0 | 0 | 0 | 111 | V223 L224 L231 G425 I428 Y429 | V223-I227 HydrophobicContact CG1-CD1 4.27Å; V223-I227 WeakPolarHBondContact O-CG1 3.33Å; V223-I227 PolarHBondContact O-N 3.39Å; V223-I227 VanDerWaalsContact O-N 3.08Å; L224-I227 PolarHBondContact O-N 2.93Å; I227-L231 WeakPolarHBondContact O-CB 3.49Å; I227-L231 PolarHBondContact O-N 2.87Å; I227-G425 WeakPolarHBondContact CG1-O 3.3Å; I227-I428 HydrophobicContact CD1-CG2 4.22Å; I227-Y429 HydrophobicContact CG2-CD2 4.12Å |
| 228 | V | 92.4 | Very high | 87 | Confident | 75 Ų | 75 | 61.6 Ų | 61.6 | 46% | 0.455 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -66.6 | -42 | -179.1 | 171.2 | 0 | 0 | 0 | 0 | 111.2 | L224 S225 G226 L231 V232 | L224-V228 HydrophobicContact CG-CG2 4.48Å; L224-V228 WeakPolarHBondContact O-CB 3.48Å; L224-V228 VanDerWaalsContact O-CG2 3.31Å; L224-V228 WeakPolarHBondContact O-CG2 3.1Å; L224-V228 PolarHBondContact O-N 3.41Å; S225-V228 PolarHBondContact O-N 2.91Å; G226-V228 VanDerWaalsContact C-N 3.34Å; G226-V228 PolarHBondContact O-N 3.49Å; V228-L231 WeakPolarHBondContact O-CB 3.42Å; V228-L231 PolarHBondContact O-N 3.47Å; V228-V232 HydrophobicContact CG1-CG2 4.31Å; V228-V232 VanDerWaalsContact O-CG2 3.3Å; V228-V232 WeakPolarHBondContact O-CG2 3.46Å; V228-V232 PolarHBondContact O-N 3.03Å |
| 229 | A | 87.4 | Confident | 86.8 | Confident | 32 Ų | 32 | 66.3 Ų | 66.3 | 26% | 0.264 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -60.3 | -47.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.1 | S225 G226 L231 V232 V233 F422 | S225-A229 VanDerWaalsContact O-CB 3.28Å; S225-A229 WeakPolarHBondContact O-CB 3.22Å; S225-A229 PolarHBondContact O-N 3.07Å; G226-A229 PolarHBondContact O-N 3.4Å; A229-L231 VanDerWaalsContact C-N 3.34Å; A229-L231 PolarHBondContact O-N 3.46Å; A229-V232 PolarHBondContact O-N 3.16Å; A229-V232 VanDerWaalsContact O-N 3.15Å; A229-V233 WeakPolarHBondContact O-CG2 3.27Å; A229-V233 PolarHBondContact O-N 3.07Å; A229-F422 HydrophobicContact CB-CE2 3.83Å; A229-F422 HydrophobicContact CB-CZ 3.85Å |
| 230 | F | 87.8 | Confident | 86.3 | Confident | 17 Ų | 17 | 69.7 Ų | 69.7 | 8% | 0.075 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -62.4 | -40.7 | 177.2 | -88 | -112.6 | 0 | 0 | 0 | 112.2 | G226 V232 V233 E234 L321 A325 Y429 V430 | G226-F230 WeakPolarHBondContact O-CD2 3.35Å; G226-F230 PolarHBondContact O-N 3.36Å; F230-V232 PolarHBondContact O-N 2.92Å; F230-V233 PolarHBondContact O-N 3.2Å; F230-E234 WeakPolarHBondContact O-CB 3.43Å; F230-E234 PolarHBondContact O-N 3.29Å; F230-L321 HydrophobicContact CD1-CB 4.36Å; F230-L321 HydrophobicContact CD1-CD2 4.14Å; F230-L321 WeakPolarHBondContact CE1-O 3.24Å; F230-A325 HydrophobicContact CE1-CB 3.66Å; F230-A325 HydrophobicContact CZ-CB 3.65Å; F230-Y429 HydrophobicContact CB-CD1 3.54Å; F230-Y429 HydrophobicContact CB-CD2 4.38Å; F230-Y429 HydrophobicContact CB-CE1 4.02Å; F230-Y429 HydrophobicContact CB-CG 3.72Å; F230-Y429 HydrophobicContact CD1-CD1 4.17Å; F230-Y429 HydrophobicContact CG-CD1 4.31Å; F230-V430 HydrophobicContact CD1-CG2 4.09Å; F230-V430 HydrophobicContact CE1-CG2 3.99Å |
| 231 | L | 89.1 | Confident | 85.3 | Confident | 82 Ų | 82 | 72.5 Ų | 72.5 | 43% | 0.429 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -60.7 | -42.9 | 172.5 | -177.3 | 150.1 | 0 | 0 | 0 | 112.6 | I227 V228 A229 E234 K235 Y429 | I227-L231 WeakPolarHBondContact O-CB 3.49Å; I227-L231 PolarHBondContact O-N 2.87Å; V228-L231 WeakPolarHBondContact O-CB 3.42Å; V228-L231 PolarHBondContact O-N 3.47Å; A229-L231 VanDerWaalsContact C-N 3.34Å; A229-L231 PolarHBondContact O-N 3.46Å; L231-E234 PolarHBondContact O-N 2.93Å; L231-K235 VanDerWaalsContact O-CB 3.23Å; L231-K235 WeakPolarHBondContact O-CB 3.27Å; L231-K235 PolarHBondContact O-N 3.39Å; L231-Y429 WeakPolarHBondContact CA-OH 3.28Å; L231-Y429 HydrophobicContact CB-CE2 3.71Å; L231-Y429 HydrophobicContact CD1-CE2 4.38Å; L231-Y429 HydrophobicContact CG-CE2 4.38Å |
| 232 | V | 87.4 | Confident | 83.6 | Confident | 84 Ų | 84 | 70.2 Ų | 70.2 | 51% | 0.509 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -64.2 | -44.6 | 178.4 | 168.3 | 0 | 0 | 0 | 0 | 110.5 | V228 A229 F230 K235 F236 | V228-V232 HydrophobicContact CG1-CG2 4.31Å; V228-V232 VanDerWaalsContact O-CG2 3.3Å; V228-V232 WeakPolarHBondContact O-CG2 3.46Å; V228-V232 PolarHBondContact O-N 3.03Å; A229-V232 PolarHBondContact O-N 3.16Å; A229-V232 VanDerWaalsContact O-N 3.15Å; F230-V232 PolarHBondContact O-N 2.92Å; V232-K235 PolarHBondContact O-N 3.45Å; V232-F236 VanDerWaalsContact O-CB 3.28Å; V232-F236 WeakPolarHBondContact O-CB 3.46Å; V232-F236 PolarHBondContact O-N 2.92Å |
| 233 | V | 82 | Confident | 81.5 | Confident | 71 Ų | 71 | 67.4 Ų | 67.4 | 43% | 0.43 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -62 | -48.5 | 176.3 | 175.9 | 0 | 0 | 0 | 0 | 110.3 | A229 F230 K235 F236 V237 L321 | A229-V233 WeakPolarHBondContact O-CG2 3.27Å; A229-V233 PolarHBondContact O-N 3.07Å; F230-V233 PolarHBondContact O-N 3.2Å; V233-K235 VanDerWaalsContact C-N 3.32Å; V233-K235 PolarHBondContact O-N 2.96Å; V233-F236 PolarHBondContact O-N 2.95Å; V233-V237 HydrophobicContact CG1-CG2 4.3Å; V233-V237 VanDerWaalsContact O-CG2 3.3Å; V233-V237 WeakPolarHBondContact O-CG2 3.29Å; V233-V237 PolarHBondContact O-N 2.54Å; V233-L321 HydrophobicContact CB-CD2 3.87Å; V233-L321 HydrophobicContact CG1-CD2 3.56Å |
| 234 | E | 84.3 | Confident | 79.2 | Confident | 6 Ų | 6 | 75.5 Ų | 75.5 | 3% | 0.028 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -55.2 | -48.9 | 177.1 | -170.6 | 169.6 | 119.1 | 0 | 0 | 111.4 | F230 L231 V237 R238 V317 L321 Y429 | F230-E234 WeakPolarHBondContact O-CB 3.43Å; F230-E234 PolarHBondContact O-N 3.29Å; L231-E234 PolarHBondContact O-N 2.93Å; E234-V237 PolarHBondContact O-N 3.31Å; E234-R238 WeakPolarHBondContact O-CG 3.18Å; E234-R238 PolarHBondContact O-N 2.87Å; E234-R238 IonicContact OE1-CZ 3Å; E234-R238 IonicContact OE1-NH1 3.98Å; E234-R238 PolarHBondContact OE1-NH1 3.27Å; E234-R238 IonicContact OE1-NH2 3.39Å; E234-R238 PolarHBondContact OE1-NH2 3.17Å; E234-V317 HydrophobicContact CB-CG1 4.47Å; E234-V317 HydrophobicContact CG-CG1 3.87Å; E234-L321 HydrophobicContact CB-CD1 3.58Å; E234-L321 HydrophobicContact CG-CD1 3.74Å; E234-L321 VanDerWaalsContact OE2-CD1 3.22Å; E234-L321 WeakPolarHBondContact OE2-CD1 3.31Å; E234-Y429 HydrophobicContact CB-CE1 4.47Å; E234-Y429 PolarHBondContact OE1-OH 2.97Å; E234-Y429 VanDerWaalsContact OE2-CE1 3.24Å; E234-Y429 WeakPolarHBondContact OE2-CE1 3.42Å; E234-Y429 PolarHBondContact OE2-OH 3.48Å; E234-Y429 VanDerWaalsContact OE2-OH 3.08Å |
| 235 | K | 82.1 | Confident | 77 | Confident | 149 Ų | 149 | 73.5 Ų | 73.5 | 65% | 0.648 | 41% | 0.408 | S | S | * | . | H | α-helix | trans | -64.8 | -41.2 | -179.8 | -170.3 | 174.2 | -176.7 | 177.3 | 0 | 112 | L231 V232 V233 R238 H239 | L231-K235 VanDerWaalsContact O-CB 3.23Å; L231-K235 WeakPolarHBondContact O-CB 3.27Å; L231-K235 PolarHBondContact O-N 3.39Å; V232-K235 PolarHBondContact O-N 3.45Å; V233-K235 VanDerWaalsContact C-N 3.32Å; V233-K235 PolarHBondContact O-N 2.96Å; K235-R238 PolarHBondContact O-N 2.86Å; K235-H239 WeakPolarHBondContact O-CB 3.26Å; K235-H239 PolarHBondContact O-N 2.98Å |
| 236 | F | 81.7 | Confident | 74.6 | Confident | 135 Ų | 135 | 78.3 Ų | 78.3 | 59% | 0.592 | 43% | 0.425 | S | S | * | . | H | α-helix | trans | -63 | -48.4 | 176.5 | 176.5 | -99.9 | 0 | 0 | 0 | 111.3 | V232 V233 R238 H239 V240 | V232-F236 VanDerWaalsContact O-CB 3.28Å; V232-F236 WeakPolarHBondContact O-CB 3.46Å; V232-F236 PolarHBondContact O-N 2.92Å; V233-F236 PolarHBondContact O-N 2.95Å; F236-R238 VanDerWaalsContact C-N 3.31Å; F236-R238 PolarHBondContact O-N 2.86Å; F236-H239 PolarHBondContact O-N 2.8Å; F236-H239 VanDerWaalsContact O-N 3.07Å; F236-V240 HydrophobicContact CD1-CG2 4.22Å; F236-V240 HydrophobicContact CD2-CG2 4.12Å; F236-V240 HydrophobicContact CE1-CG2 3.8Å; F236-V240 HydrophobicContact CE2-CG2 3.69Å; F236-V240 HydrophobicContact CG-CG2 4.38Å; F236-V240 HydrophobicContact CZ-CG2 3.52Å; F236-V240 WeakPolarHBondContact O-CG2 3.47Å; F236-V240 PolarHBondContact O-N 3.48Å |
| 237 | V | 76.7 | Confident | 72.1 | Confident | 34 Ų | 34 | 84.1 Ų | 84.1 | 21% | 0.206 | 47% | 0.465 | C | S | . | . | H | α-helix | trans | -61.2 | -42.2 | 179 | 177.2 | 0 | 0 | 0 | 0 | 110.7 | V233 E234 H239 K241 V317 | V233-V237 HydrophobicContact CG1-CG2 4.3Å; V233-V237 VanDerWaalsContact O-CG2 3.3Å; V233-V237 WeakPolarHBondContact O-CG2 3.29Å; V233-V237 PolarHBondContact O-N 2.54Å; E234-V237 PolarHBondContact O-N 3.31Å; V237-H239 VanDerWaalsContact C-N 3.34Å; V237-H239 PolarHBondContact O-N 3.46Å; V237-K241 HydrophobicContact CG1-CD 4.29Å; V237-K241 WeakPolarHBondContact O-CB 3.07Å; V237-K241 PolarHBondContact O-N 3.12Å; V237-V317 HydrophobicContact CB-CG1 4.07Å; V237-V317 HydrophobicContact CB-CG2 4.24Å; V237-V317 HydrophobicContact CG1-CB 4.34Å; V237-V317 HydrophobicContact CG1-CG1 4.05Å; V237-V317 HydrophobicContact CG1-CG2 3.48Å; V237-V317 VanDerWaalsContact CG1-CG2 3.48Å |
| 238 | R | 78.6 | Confident | 69.5 | Low | 106 Ų | 106 | 89.4 Ų | 89.4 | 40% | 0.4 | 49% | 0.489 | S | S | . | . | H | α-helix | trans | -62.4 | -38.8 | 173.7 | -75.9 | -172.7 | -178.7 | 128.4 | 7.4 | 112.7 | E234 K235 F236 G242 D314 | E234-R238 WeakPolarHBondContact O-CG 3.18Å; E234-R238 PolarHBondContact O-N 2.87Å; E234-R238 IonicContact OE1-CZ 3Å; E234-R238 IonicContact OE1-NH1 3.98Å; E234-R238 PolarHBondContact OE1-NH1 3.27Å; E234-R238 IonicContact OE1-NH2 3.39Å; E234-R238 PolarHBondContact OE1-NH2 3.17Å; K235-R238 PolarHBondContact O-N 2.86Å; F236-R238 VanDerWaalsContact C-N 3.31Å; F236-R238 PolarHBondContact O-N 2.86Å; R238-G242 WeakPolarHBondContact O-CA 3.37Å; R238-G242 PolarHBondContact O-N 3.39Å; R238-D314 IonicContact CZ-OD1 3.96Å; R238-D314 IonicContact NE-OD1 3.71Å; R238-D314 PolarHBondContact NE-OD1 3.22Å; R238-D314 IonicContact NH2-OD1 2.66Å; R238-D314 PolarHBondContact NH2-OD1 3.2Å |
| 239 | H | 79.2 | Confident | 67.1 | Low | 148 Ų | 148 | 89.4 Ų | 89.4 | 69% | 0.685 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -69.7 | -44.8 | 179.7 | -167.9 | 71.4 | 0 | 0 | 0 | 111.9 | K235 F236 V237 G243 | K235-H239 WeakPolarHBondContact O-CB 3.26Å; K235-H239 PolarHBondContact O-N 2.98Å; F236-H239 PolarHBondContact O-N 2.8Å; F236-H239 VanDerWaalsContact O-N 3.07Å; V237-H239 VanDerWaalsContact C-N 3.34Å; V237-H239 PolarHBondContact O-N 3.46Å; H239-G243 PolarHBondContact O-N 3.49Å |
| 240 | V | 77.8 | Confident | 64.8 | Low | 80 Ų | 80 | 94.8 Ų | 94.8 | 49% | 0.485 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -67.8 | -39.6 | 179.9 | 174.3 | 0 | 0 | 0 | 0 | 111.8 | F236 | F236-V240 HydrophobicContact CD1-CG2 4.22Å; F236-V240 HydrophobicContact CD2-CG2 4.12Å; F236-V240 HydrophobicContact CE1-CG2 3.8Å; F236-V240 HydrophobicContact CE2-CG2 3.69Å; F236-V240 HydrophobicContact CG-CG2 4.38Å; F236-V240 HydrophobicContact CZ-CG2 3.52Å; F236-V240 WeakPolarHBondContact O-CG2 3.47Å; F236-V240 PolarHBondContact O-N 3.48Å |
| 241 | K | 67.1 | Low | 62.2 | Low | 98 Ų | 98 | 97.8 Ų | 97.8 | 43% | 0.426 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -83.4 | -25 | 177.5 | -82 | 176.2 | 169.3 | 168.3 | 0 | 113.9 | V237 L313 | V237-K241 HydrophobicContact CG1-CD 4.29Å; V237-K241 WeakPolarHBondContact O-CB 3.07Å; V237-K241 PolarHBondContact O-N 3.12Å; K241-L313 HydrophobicContact CD-CD2 4.41Å |
| 242 | G | 55.8 | Low | 59.9 | Low | 50 Ų | 50 | 100.9 Ų | 100.9 | 52% | 0.515 | 57% | 0.57 | S | S | . | * | H | α-helix | trans | -85 | -4.4 | 177.4 | 0 | 0 | 0 | 0 | 0 | 115.1 | R238 H244 | R238-G242 WeakPolarHBondContact O-CA 3.37Å; R238-G242 PolarHBondContact O-N 3.39Å; G242-H244 PolarHBondContact O-N 3.26Å |
| 243 | G | 44.8 | Very low | 57.4 | Low | 39 Ų | 39 | 101.5 Ų | 101.5 | 40% | 0.402 | 58% | 0.584 | S | S | . | * | trans | -82.8 | 1.8 | -172.6 | 0 | 0 | 0 | 0 | 0 | 117.3 | H239 | H239-G243 PolarHBondContact O-N 3.49Š| ||
| 244 | H | 44.2 | Very low | 55.4 | Low | 188 Ų | 188 | 104.9 Ų | 104.9 | 87% | 0.87 | 60% | 0.595 | S | S | * | * | S | Bend | trans | -111.3 | 48.6 | -179.2 | -71.1 | 100.1 | 0 | 0 | 0 | 113.3 | G242 | G242-H244 PolarHBondContact O-N 3.26Š|
| 245 | G | 46.5 | Very low | 53 | Low | 56 Ų | 56 | 109.7 Ų | 109.7 | 58% | 0.577 | 63% | 0.629 | S | S | * | * | trans | -140.2 | 46.2 | 179.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 246 | H | 40.9 | Very low | 50.9 | Low | 147 Ų | 147 | 110 Ų | 110 | 68% | 0.681 | 63% | 0.633 | S | S | * | * | trans | -125.9 | 84.5 | 172.2 | -53.4 | -39.9 | 0 | 0 | 0 | 110.4 | H248 | H246-H248 PolarHBondContact O-N 2.89Å; H246-H248 VanDerWaalsContact O-N 3.11Å | ||
| 247 | S | 35.3 | Very low | 48.6 | Very low | 122 Ų | 122 | 109.7 Ų | 109.7 | 85% | 0.853 | 64% | 0.642 | S | S | * | * | trans | -68.3 | 98.6 | 158.4 | 54.6 | 0 | 0 | 0 | 0 | 108.4 | G249 | S247-G249 PolarHBondContact O-N 3.4Š| ||
| 248 | H | 39.2 | Very low | 46.8 | Very low | 159 Ų | 159 | 117.2 Ų | 117.2 | 74% | 0.736 | 68% | 0.675 | S | S | * | * | trans | -69.5 | 94 | 165.6 | -78.1 | -82.7 | 0 | 0 | 0 | 109.3 | H246 H250 | H246-H248 PolarHBondContact O-N 2.89Å; H246-H248 VanDerWaalsContact O-N 3.11Å; H248-H250 PolarHBondContact O-N 3.46Å; H248-H250 VanDerWaalsContact O-N 3.08Å | ||
| 249 | G | 41 | Very low | 44.6 | Very low | 74 Ų | 74 | 116 Ų | 116 | 76% | 0.763 | 70% | 0.695 | S | S | * | * | trans | -76.3 | 74 | 161.9 | 0 | 0 | 0 | 0 | 0 | 110.7 | S247 | S247-G249 PolarHBondContact O-N 3.4Š| ||
| 250 | H | 39.2 | Very low | 42.3 | Very low | 146 Ų | 146 | 113.7 Ų | 113.7 | 68% | 0.676 | 70% | 0.696 | S | S | * | * | trans | -107.4 | 74.6 | 162.9 | -86.8 | -76.4 | 0 | 0 | 0 | 109.5 | H248 H252 | H248-H250 PolarHBondContact O-N 3.46Å; H248-H250 VanDerWaalsContact O-N 3.08Å; H250-H252 PolarHBondContact O-N 3.23Å | ||
| 251 | G | 32.7 | Very low | 40.2 | Very low | 79 Ų | 79 | 119 Ų | 119 | 81% | 0.814 | 72% | 0.715 | S | S | * | * | trans | -87.8 | 90.5 | 161.8 | 0 | 0 | 0 | 0 | 0 | 109.4 | A253 | G251-A253 PolarHBondContact O-N 2.86Å; G251-A253 VanDerWaalsContact O-N 3.16Å | ||
| 252 | H | 41.1 | Very low | 38.5 | Very low | 147 Ų | 147 | 118 Ų | 118 | 68% | 0.681 | 73% | 0.732 | S | S | * | * | trans | -70.9 | 100.3 | 163.5 | -82.2 | -83.2 | 0 | 0 | 0 | 108.8 | H250 | H250-H252 PolarHBondContact O-N 3.23Š| ||
| 253 | A | 35.8 | Very low | 37.3 | Very low | 97 Ų | 97 | 125.5 Ų | 125.5 | 80% | 0.802 | 75% | 0.754 | S | S | * | * | trans | -105.1 | 104.9 | 161.6 | 0 | 0 | 0 | 0 | 0 | 108.2 | G251 S255 | G251-A253 PolarHBondContact O-N 2.86Å; G251-A253 VanDerWaalsContact O-N 3.16Å; A253-S255 PolarHBondContact O-N 3Å | ||
| 254 | H | 38.8 | Very low | 36.5 | Very low | 143 Ų | 143 | 127.1 Ų | 127.1 | 66% | 0.662 | 77% | 0.77 | S | S | * | * | trans | -78.9 | 110.7 | 168 | -68.2 | -79.9 | 0 | 0 | 0 | 108.6 | ||||
| 255 | S | 34.7 | Very low | 35.8 | Very low | 106 Ų | 106 | 128.6 Ų | 128.6 | 74% | 0.741 | 77% | 0.768 | S | S | * | * | trans | -105.1 | 109.5 | 159.6 | 71.8 | 0 | 0 | 0 | 0 | 108.7 | A253 | A253-S255 PolarHBondContact O-N 3Š| ||
| 256 | H | 37.3 | Very low | 34.8 | Very low | 156 Ų | 156 | 132 Ų | 132 | 72% | 0.722 | 77% | 0.769 | S | S | * | * | trans | -85.1 | 114.2 | 172.4 | -26.2 | -81.3 | 0 | 0 | 0 | 108 | ||||
| 257 | T | 34.6 | Very low | 34.3 | Very low | 129 Ų | 129 | 132 Ų | 132 | 79% | 0.791 | 77% | 0.769 | S | S | * | * | trans | -129.6 | 106.4 | 161.1 | 47.7 | 0 | 0 | 0 | 0 | 107.9 | G259 | T257-G259 PolarHBondContact O-N 3.34Š| ||
| 258 | H | 38.1 | Very low | 33.8 | Very low | 191 Ų | 191 | 137 Ų | 137 | 88% | 0.884 | 77% | 0.77 | S | S | * | * | trans | -63 | 118.2 | 172.4 | -85.6 | -91.9 | 0 | 0 | 0 | 110.1 | ||||
| 259 | G | 32 | Very low | 33.2 | Very low | 80 Ų | 80 | 133.6 Ų | 133.6 | 83% | 0.825 | 76% | 0.763 | S | S | * | * | trans | -97.3 | 124.1 | 160.4 | 0 | 0 | 0 | 0 | 0 | 109.6 | T257 | T257-G259 PolarHBondContact O-N 3.34Š| ||
| 260 | S | 31.7 | Very low | 32.5 | Very low | 101 Ų | 101 | 136.2 Ų | 136.2 | 71% | 0.706 | 77% | 0.765 | S | S | * | * | trans | -128.7 | 114.3 | 163.9 | 169.6 | 0 | 0 | 0 | 0 | 108.7 | ||||
| 261 | H | 33.5 | Very low | 32 | Very low | 191 Ų | 191 | 137.5 Ų | 137.5 | 88% | 0.884 | 77% | 0.768 | S | S | * | * | trans | 45 | 131.5 | 148.7 | -65.2 | -77 | 0 | 0 | 0 | 121.6 | ||||
| 262 | G | 30.8 | Very low | 31.6 | Very low | 77 Ų | 77 | 140.7 Ų | 140.7 | 79% | 0.794 | 76% | 0.762 | S | S | * | * | trans | 159.7 | 109.7 | 148.3 | 0 | 0 | 0 | 0 | 0 | 115.8 | ||||
| 263 | H | 30.7 | Very low | 30.9 | Very low | 208 Ų | 208 | 141.6 Ų | 141.6 | 96% | 0.963 | 76% | 0.764 | S | S | * | * | trans | -50.7 | 146.6 | 168.5 | -102.4 | -97.6 | 0 | 0 | 0 | 114.6 | ||||
| 264 | G | 29.6 | Very low | 30.4 | Very low | 72 Ų | 72 | 144.4 Ų | 144.4 | 74% | 0.742 | 76% | 0.761 | S | S | * | * | trans | 169.1 | 82.4 | 162.2 | 0 | 0 | 0 | 0 | 0 | 118.2 | ||||
| 265 | R | 27.7 | Very low | 29.7 | Very low | 219 Ų | 219 | 143 Ų | 143 | 83% | 0.826 | 77% | 0.767 | S | S | * | * | trans | 35.6 | 134.5 | 131.4 | -165 | 170.5 | 179.2 | -166.5 | -6.4 | 123.2 | ||||
| 266 | Q | 27.2 | Very low | 29.3 | Very low | 129 Ų | 129 | 142 Ų | 142 | 60% | 0.603 | 76% | 0.759 | S | S | * | * | trans | 67.2 | 145.6 | 155.8 | -84.8 | 174 | -84.7 | 0 | 0 | 117.4 | ||||
| 267 | E | 28.7 | Very low | 28.8 | Very low | 147 Ų | 147 | 142.3 Ų | 142.3 | 69% | 0.687 | 76% | 0.761 | S | S | * | * | cis | -163 | 134.9 | 18.8 | -121.6 | 168.1 | -168.3 | 0 | 0 | 107.2 | ||||
| 268 | R | 26.1 | Very low | 28.5 | Very low | 227 Ų | 227 | 143.4 Ų | 143.4 | 86% | 0.857 | 76% | 0.757 | S | S | * | * | 84.9 | 131.8 | 96.6 | -161.7 | 175.5 | -157.6 | -163 | 5.3 | 117.1 | |||||
| 269 | S | 26.8 | Very low | 28 | Very low | 87 Ų | 87 | 142 Ų | 142 | 61% | 0.608 | 75% | 0.752 | S | S | * | * | trans | -51.9 | 159.6 | 176.5 | 59 | 0 | 0 | 0 | 0 | 118.8 | ||||
| 270 | T | 26.4 | Very low | 27.7 | Very low | 128 Ų | 128 | 144.8 Ų | 144.8 | 79% | 0.785 | 74% | 0.743 | S | S | * | * | 162.9 | 119.6 | 116.4 | 41.1 | 0 | 0 | 0 | 0 | 108.2 | |||||
| 271 | K | 27.6 | Very low | 27.4 | Very low | 174 Ų | 174 | 147.4 Ų | 147.4 | 76% | 0.757 | 74% | 0.741 | S | S | * | * | 63.1 | 132.6 | 76.2 | -140.8 | -157.7 | 173.3 | -157.4 | 0 | 115.1 | |||||
| 272 | E | 25.3 | Very low | 27.1 | Very low | 146 Ų | 146 | 145.7 Ų | 145.7 | 68% | 0.682 | 73% | 0.734 | S | S | * | * | trans | 83.2 | 146.9 | 159.1 | -62.8 | -170.8 | 176.7 | 0 | 0 | 117.1 | ||||
| 273 | K | 25.8 | Very low | 26.8 | Very low | 165 Ų | 165 | 148.3 Ų | 148.3 | 72% | 0.717 | 73% | 0.734 | S | S | * | * | cis | -177 | 149.3 | -21.6 | -140 | 178.5 | 177.1 | -164.9 | 0 | 105.6 | ||||
| 274 | Q | 24.3 | Very low | 26.5 | Very low | 157 Ų | 157 | 142.3 Ų | 142.3 | 73% | 0.734 | 73% | 0.729 | S | S | * | * | trans | 69.3 | 143.4 | 142.5 | -91.5 | 174.7 | -52 | 0 | 0 | 125.4 | ||||
| 275 | S | 25.3 | Very low | 26.4 | Very low | 114 Ų | 114 | 142.8 Ų | 142.8 | 80% | 0.797 | 73% | 0.734 | S | S | * | * | trans | 86.1 | 146.1 | 149.3 | 95.1 | 0 | 0 | 0 | 0 | 116.3 | ||||
| 276 | S | 25.8 | Very low | 26.5 | Very low | 83 Ų | 83 | 138.5 Ų | 138.5 | 58% | 0.58 | 73% | 0.732 | S | S | * | * | cis | -167.6 | 162.1 | 10.6 | 40.6 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 277 | E | 27.2 | Very low | 26.7 | Very low | 163 Ų | 163 | 141 Ų | 141 | 76% | 0.762 | 74% | 0.744 | S | S | * | * | trans | 54.4 | 144 | 137.7 | -69.7 | 155 | -175.8 | 0 | 0 | 119.4 | ||||
| 278 | E | 27.6 | Very low | 26.7 | Very low | 152 Ų | 152 | 144 Ų | 144 | 71% | 0.71 | 76% | 0.755 | S | S | * | * | cis | -172.2 | 159.6 | 21.5 | -118.1 | 163 | -156 | 0 | 0 | 108.7 | ||||
| 279 | E | 27.2 | Very low | 27 | Very low | 163 Ų | 163 | 144.5 Ų | 144.5 | 76% | 0.762 | 76% | 0.756 | S | S | * | * | trans | 28.2 | 154.7 | 143.8 | -69.6 | -173.8 | 160.9 | 0 | 0 | 122.5 | ||||
| 280 | E | 26.8 | Very low | 27.1 | Very low | 138 Ų | 138 | 152.2 Ų | 152.2 | 65% | 0.645 | 77% | 0.772 | S | S | * | * | cis | -169.7 | 165.1 | 6.8 | -124.7 | -165.1 | 169.6 | 0 | 0 | 108.1 | ||||
| 281 | K | 25.9 | Very low | 27.1 | Very low | 155 Ų | 155 | 149.9 Ų | 149.9 | 67% | 0.674 | 77% | 0.774 | S | S | * | * | trans | 72.1 | 114 | 146.3 | -91.5 | 178.8 | 176.3 | 155.6 | 0 | 125.3 | ||||
| 282 | E | 25.9 | Very low | 27.1 | Very low | 156 Ų | 156 | 145.3 Ų | 145.3 | 73% | 0.729 | 78% | 0.776 | S | S | * | * | 70.3 | 136.7 | 115.4 | -87.6 | -167.7 | 155.7 | 0 | 0 | 124.3 | |||||
| 283 | T | 24.5 | Very low | 27.6 | Very low | 131 Ų | 131 | 143.8 Ų | 143.8 | 80% | 0.804 | 78% | 0.781 | S | S | * | * | trans | 94.7 | 112 | 150.5 | 69.6 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 284 | G | 25 | Very low | 27.8 | Very low | 82 Ų | 82 | 142.1 Ų | 142.1 | 85% | 0.845 | 79% | 0.785 | S | S | * | * | 85.7 | 135 | 117.9 | 0 | 0 | 0 | 0 | 0 | 118.7 | |||||
| 285 | G | 27.7 | Very low | 28.2 | Very low | 83 Ų | 83 | 140.5 Ų | 140.5 | 86% | 0.856 | 79% | 0.785 | S | S | * | * | trans | 119.5 | 104.4 | 146.4 | 0 | 0 | 0 | 0 | 0 | 116.2 | ||||
| 286 | V | 28.7 | Very low | 28.7 | Very low | 128 Ų | 128 | 140.3 Ų | 140.3 | 78% | 0.776 | 78% | 0.782 | S | S | * | * | trans | -75.3 | 148.2 | 176.9 | 168.3 | 0 | 0 | 0 | 0 | 112.1 | ||||
| 287 | Q | 31.4 | Very low | 29.2 | Very low | 182 Ų | 182 | 146.4 Ų | 146.4 | 85% | 0.85 | 80% | 0.798 | S | S | * | * | trans | 80.5 | 87.4 | 153.5 | -83.5 | 162.9 | -11.6 | 0 | 0 | 122.3 | ||||
| 288 | K | 30.2 | Very low | 29.8 | Very low | 211 Ų | 211 | 146.4 Ų | 146.4 | 92% | 0.917 | 80% | 0.803 | S | S | * | * | trans | -28.6 | 125.6 | 144.9 | -157.9 | 173.2 | -171.8 | 176.2 | 0 | 116.8 | ||||
| 289 | R | 31 | Very low | 30.5 | Very low | 236 Ų | 236 | 141.5 Ų | 141.5 | 89% | 0.891 | 79% | 0.793 | S | S | * | * | trans | -123.9 | 132.8 | 152.2 | -99.5 | -172.9 | 174.2 | -171.1 | 0.3 | 110.4 | ||||
| 290 | R | 30.3 | Very low | 31.2 | Very low | 250 Ų | 250 | 140.2 Ų | 140.2 | 94% | 0.943 | 80% | 0.799 | S | S | * | * | trans | 62.4 | 143 | 156 | -78.9 | -175.1 | 168.9 | -168.6 | -3.2 | 120.2 | ||||
| 291 | G | 25.9 | Very low | 31.9 | Very low | 79 Ų | 79 | 139.7 Ų | 139.7 | 81% | 0.814 | 81% | 0.805 | S | S | * | * | trans | 126 | 113.5 | 156.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | ||||
| 292 | G | 28.3 | Very low | 32.9 | Very low | 78 Ų | 78 | 140.8 Ų | 140.8 | 80% | 0.804 | 81% | 0.805 | S | S | * | * | trans | -85.7 | -166.7 | -173.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | ||||
| 293 | S | 34.3 | Very low | 34 | Very low | 114 Ų | 114 | 138.4 Ų | 138.4 | 80% | 0.797 | 80% | 0.803 | S | S | * | * | trans | 77.4 | 109.7 | 177.4 | -162 | 0 | 0 | 0 | 0 | 115.6 | ||||
| 294 | T | 29.9 | Very low | 35.2 | Very low | 130 Ų | 130 | 137 Ų | 137 | 80% | 0.798 | 79% | 0.787 | S | S | * | * | -173.9 | 117.1 | 129.1 | 27.4 | 0 | 0 | 0 | 0 | 110.2 | |||||
| 295 | V | 32.6 | Very low | 36.9 | Very low | 122 Ų | 122 | 138.5 Ų | 138.5 | 74% | 0.739 | 78% | 0.776 | S | S | * | * | trans | 44.9 | 111 | 137 | -168.8 | 0 | 0 | 0 | 0 | 117.7 | ||||
| 296 | P | 36.8 | Very low | 38.4 | Very low | 111 Ų | 111 | 137.9 Ų | 137.9 | 72% | 0.721 | 76% | 0.762 | S | S | * | * | trans | -74.4 | 130.1 | 164.8 | 22.9 | -13.8 | 0 | 0 | 0 | 109.7 | D298 | P296-D298 PolarHBondContact O-N 3.4Š| ||
| 297 | K | 35.8 | Very low | 39.9 | Very low | 211 Ų | 211 | 139 Ų | 139 | 92% | 0.917 | 76% | 0.759 | S | S | * | * | trans | -67.4 | 110.7 | 165.4 | -83.3 | -178.8 | 170.9 | 178 | 0 | 108.4 | G299 | K297-G299 PolarHBondContact O-N 2.89Å; K297-G299 VanDerWaalsContact O-N 3.09Å | ||
| 298 | D | 39.2 | Very low | 41.5 | Very low | 163 Ų | 163 | 135.5 Ų | 135.5 | 87% | 0.872 | 74% | 0.743 | S | S | * | * | trans | -65.6 | 101.1 | 163.9 | -75.8 | -38.5 | 0 | 0 | 0 | 109.4 | P296 | P296-D298 PolarHBondContact O-N 3.4Š| ||
| 299 | G | 42.5 | Very low | 43.2 | Very low | 49 Ų | 49 | 132 Ų | 132 | 51% | 0.505 | 73% | 0.73 | S | S | . | * | trans | -86.4 | 150 | 153.5 | 0 | 0 | 0 | 0 | 0 | 109 | K297 V301 | K297-G299 PolarHBondContact O-N 2.89Å; K297-G299 VanDerWaalsContact O-N 3.09Å; G299-V301 PolarHBondContact O-N 2.89Å | ||
| 300 | P | 42.4 | Very low | 45 | Very low | 135 Ų | 135 | 127.3 Ų | 127.3 | 88% | 0.877 | 72% | 0.716 | S | S | * | * | trans | -63.4 | 111.7 | 179 | 25.4 | -31.1 | 0 | 0 | 0 | 109.7 | R302 | P300-R302 PolarHBondContact O-N 3.36Š| ||
| 301 | V | 42.1 | Very low | 46.7 | Very low | 127 Ų | 127 | 121.6 Ų | 121.6 | 77% | 0.77 | 69% | 0.694 | S | S | * | * | trans | -65.6 | 114.5 | 171.8 | 177.8 | 0 | 0 | 0 | 0 | 107.8 | G299 | G299-V301 PolarHBondContact O-N 2.89Š| ||
| 302 | R | 46.6 | Very low | 48.8 | Very low | 178 Ų | 178 | 119.3 Ų | 119.3 | 67% | 0.672 | 67% | 0.671 | S | S | * | * | trans | -61.2 | 144.6 | 174.4 | -161.6 | 173.9 | -169.8 | -161.2 | 6.8 | 109.5 | P300 Q304 | P300-R302 PolarHBondContact O-N 3.36Å; R302-Q304 HydrophobicContact CB-CG 4.36Å; R302-Q304 HydrophobicContact CG-CG 4.08Å; R302-Q304 PolarHBondContact O-N 3.17Å | ||
| 303 | P | 49.1 | Very low | 51.1 | Low | 106 Ų | 106 | 118 Ų | 118 | 69% | 0.688 | 65% | 0.645 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -75.1 | 39.7 | -176.2 | 32.3 | -37.3 | 0 | 0 | 0 | 113.9 | ||
| 304 | Q | 50.4 | Low | 53 | Low | 102 Ų | 102 | 114.9 Ų | 114.9 | 48% | 0.477 | 62% | 0.619 | S | S | . | * | H | α-helix | trans | -75.2 | -28.3 | -178.2 | -71.2 | -179 | -29.5 | 0 | 0 | 112.8 | R302 E308 | R302-Q304 HydrophobicContact CB-CG 4.36Å; R302-Q304 HydrophobicContact CG-CG 4.08Å; R302-Q304 PolarHBondContact O-N 3.17Å; Q304-E308 WeakPolarHBondContact O-CG 3.37Å; Q304-E308 PolarHBondContact O-N 3.14Å |
| 305 | N | 59.8 | Low | 55.1 | Low | 114 Ų | 114 | 110.7 Ų | 110.7 | 61% | 0.61 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -71.7 | -34 | -175.2 | -70.5 | -13.8 | 0 | 0 | 0 | 113.6 | E309 | N305-E309 WeakPolarHBondContact O-CB 3.12Å; N305-E309 PolarHBondContact O-N 3Å |
| 306 | A | 59.6 | Low | 57.4 | Low | 69 Ų | 69 | 111.6 Ų | 111.6 | 57% | 0.57 | 58% | 0.582 | S | S | * | * | H | α-helix | trans | -72.7 | -36.2 | -176.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | K310 | A306-K310 VanDerWaalsContact O-CB 3.23Å; A306-K310 WeakPolarHBondContact O-CB 3.37Å; A306-K310 PolarHBondContact O-N 3.12Å; A306-K310 VanDerWaalsContact O-N 3.07Å |
| 307 | E | 60.8 | Low | 59.6 | Low | 153 Ų | 153 | 106.5 Ų | 106.5 | 72% | 0.715 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -75.1 | -37.8 | 177.8 | -67.4 | -172.3 | 165.8 | 0 | 0 | 112 | R311 | E307-R311 WeakPolarHBondContact O-CB 3.24Å; E307-R311 PolarHBondContact O-N 2.87Å |
| 308 | E | 63.2 | Low | 61.7 | Low | 108 Ų | 108 | 97 Ų | 97 | 51% | 0.505 | 51% | 0.509 | S | S | . | . | H | α-helix | trans | -70.4 | -38.1 | 175.8 | -69.4 | -164.1 | 141.8 | 0 | 0 | 112.8 | Q304 R311 G312 | Q304-E308 WeakPolarHBondContact O-CG 3.37Å; Q304-E308 PolarHBondContact O-N 3.14Å; E308-R311 PolarHBondContact O-N 2.93Å; E308-R311 IonicContact OE1-NH2 3.71Å; E308-R311 PolarHBondContact OE1-NH2 3.1Å; E308-G312 PolarHBondContact O-N 2.89Å |
| 309 | E | 66.9 | Low | 63.9 | Low | 137 Ų | 137 | 89.4 Ų | 89.4 | 64% | 0.64 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -65.8 | -44.9 | 174.6 | -173.4 | 177.1 | -178.2 | 0 | 0 | 111.2 | N305 R311 G312 L313 | N305-E309 WeakPolarHBondContact O-CB 3.12Å; N305-E309 PolarHBondContact O-N 3Å; E309-R311 VanDerWaalsContact C-N 3.33Å; E309-R311 PolarHBondContact O-N 3.34Å; E309-G312 PolarHBondContact O-N 3.38Å; E309-L313 WeakPolarHBondContact O-CG 3.49Å; E309-L313 PolarHBondContact O-N 3Å |
| 310 | K | 68.7 | Low | 65.9 | Low | 138 Ų | 138 | 93.2 Ų | 93.2 | 60% | 0.6 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -60 | -41.6 | 174.5 | -172 | -179.6 | 177.2 | -170.1 | 0 | 111.9 | A306 L313 D314 | A306-K310 VanDerWaalsContact O-CB 3.23Å; A306-K310 WeakPolarHBondContact O-CB 3.37Å; A306-K310 PolarHBondContact O-N 3.12Å; A306-K310 VanDerWaalsContact O-N 3.07Å; K310-L313 WeakPolarHBondContact O-CB 3.39Å; K310-L313 PolarHBondContact O-N 3.14Å; K310-D314 PolarHBondContact O-N 3.17Å |
| 311 | R | 66.7 | Low | 67.9 | Low | 130 Ų | 130 | 87 Ų | 87 | 49% | 0.491 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -63.4 | -43.7 | 175 | -177.3 | -178.9 | 65.7 | -165.8 | -6.3 | 112.2 | E307 E308 E309 L313 D314 L315 | E307-R311 WeakPolarHBondContact O-CB 3.24Å; E307-R311 PolarHBondContact O-N 2.87Å; E308-R311 PolarHBondContact O-N 2.93Å; E308-R311 IonicContact OE1-NH2 3.71Å; E308-R311 PolarHBondContact OE1-NH2 3.1Å; E309-R311 VanDerWaalsContact C-N 3.33Å; E309-R311 PolarHBondContact O-N 3.34Å; R311-L313 PolarHBondContact O-N 3.49Å; R311-D314 PolarHBondContact O-N 2.89Å; R311-L315 HydrophobicContact CG-CD1 4.25Å; R311-L315 WeakPolarHBondContact O-CG 3.28Å; R311-L315 PolarHBondContact O-N 3.44Å |
| 312 | G | 70.3 | Confident | 70 | Confident | 31 Ų | 31 | 81.1 Ų | 81.1 | 32% | 0.32 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -62.6 | -33 | 176.2 | 0 | 0 | 0 | 0 | 0 | 112.6 | E308 E309 R316 | E308-G312 PolarHBondContact O-N 2.89Å; E309-G312 PolarHBondContact O-N 3.38Å; G312-R316 VanDerWaalsContact O-CG 3.32Å; G312-R316 WeakPolarHBondContact O-CG 3.2Å; G312-R316 PolarHBondContact O-N 2.83Å |
| 313 | L | 74.7 | Confident | 71.9 | Confident | 49 Ų | 49 | 73.8 Ų | 73.8 | 26% | 0.257 | 37% | 0.367 | S | S | . | . | H | α-helix | trans | -69.2 | -49.2 | 171.6 | -69.4 | 167.5 | 0 | 0 | 0 | 111.4 | K241 E309 K310 R311 L315 R316 V317 | K241-L313 HydrophobicContact CD-CD2 4.41Å; E309-L313 WeakPolarHBondContact O-CG 3.49Å; E309-L313 PolarHBondContact O-N 3Å; K310-L313 WeakPolarHBondContact O-CB 3.39Å; K310-L313 PolarHBondContact O-N 3.14Å; R311-L313 PolarHBondContact O-N 3.49Å; L313-L315 VanDerWaalsContact C-N 3.33Å; L313-L315 PolarHBondContact O-N 2.98Å; L313-R316 WeakPolarHBondContact O-CB 3.42Å; L313-R316 PolarHBondContact O-N 3.19Å; L313-R316 VanDerWaalsContact O-N 3.11Å; L313-V317 WeakPolarHBondContact O-CG2 3.3Å; L313-V317 PolarHBondContact O-N 3.45Å |
| 314 | D | 74.9 | Confident | 73.6 | Confident | 49 Ų | 49 | 71 Ų | 71 | 26% | 0.262 | 35% | 0.352 | S | S | . | . | H | α-helix | trans | -57.8 | -43.5 | 180 | -74.5 | -28.4 | 0 | 0 | 0 | 112.2 | R238 K310 R311 R316 V317 S318 | R238-D314 IonicContact CZ-OD1 3.96Å; R238-D314 IonicContact NE-OD1 3.71Å; R238-D314 PolarHBondContact NE-OD1 3.22Å; R238-D314 IonicContact NH2-OD1 2.66Å; R238-D314 PolarHBondContact NH2-OD1 3.2Å; K310-D314 PolarHBondContact O-N 3.17Å; R311-D314 PolarHBondContact O-N 2.89Å; D314-R316 PolarHBondContact O-N 3.09Å; D314-V317 PolarHBondContact O-N 2.81Å; D314-S318 WeakPolarHBondContact O-CB 3.38Å; D314-S318 PolarHBondContact O-N 3.47Å |
| 315 | L | 75.1 | Confident | 75.2 | Confident | 43 Ų | 43 | 66.2 Ų | 66.2 | 23% | 0.225 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -62.9 | -40.3 | 175.8 | -71.7 | 173.8 | 0 | 0 | 0 | 112.3 | R311 L313 S318 G319 S373 | R311-L315 HydrophobicContact CG-CD1 4.25Å; R311-L315 WeakPolarHBondContact O-CG 3.28Å; R311-L315 PolarHBondContact O-N 3.44Å; L313-L315 VanDerWaalsContact C-N 3.33Å; L313-L315 PolarHBondContact O-N 2.98Å; L315-S318 PolarHBondContact O-N 3.46Å; L315-G319 PolarHBondContact O-N 2.98Å; L315-G319 VanDerWaalsContact O-N 3.07Å; L315-S373 WeakPolarHBondContact O-CB 3.42Å |
| 316 | R | 80.6 | Confident | 76.5 | Confident | 141 Ų | 141 | 60.9 Ų | 60.9 | 53% | 0.532 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -66 | -38.7 | 174.4 | -75.3 | 176.1 | -173.9 | 179.1 | 4.2 | 112.3 | G312 L313 D314 G319 Y320 S373 | G312-R316 VanDerWaalsContact O-CG 3.32Å; G312-R316 WeakPolarHBondContact O-CG 3.2Å; G312-R316 PolarHBondContact O-N 2.83Å; L313-R316 WeakPolarHBondContact O-CB 3.42Å; L313-R316 PolarHBondContact O-N 3.19Å; L313-R316 VanDerWaalsContact O-N 3.11Å; D314-R316 PolarHBondContact O-N 3.09Å; R316-G319 PolarHBondContact O-N 2.89Å; R316-Y320 WeakPolarHBondContact O-CD2 3.34Å; R316-Y320 PolarHBondContact O-N 3.34Å; R316-S373 WeakPolarHBondContact CG-O 3.27Å |
| 317 | V | 82.8 | Confident | 77.9 | Confident | 4 Ų | 4 | 61.1 Ų | 61.1 | 2% | 0.024 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -64.7 | -45.9 | 177.3 | -179.6 | 0 | 0 | 0 | 0 | 110.4 | E234 V237 L313 D314 G319 Y320 L321 | E234-V317 HydrophobicContact CB-CG1 4.47Å; E234-V317 HydrophobicContact CG-CG1 3.87Å; V237-V317 HydrophobicContact CB-CG1 4.07Å; V237-V317 HydrophobicContact CB-CG2 4.24Å; V237-V317 HydrophobicContact CG1-CB 4.34Å; V237-V317 HydrophobicContact CG1-CG1 4.05Å; V237-V317 HydrophobicContact CG1-CG2 3.48Å; V237-V317 VanDerWaalsContact CG1-CG2 3.48Å; L313-V317 WeakPolarHBondContact O-CG2 3.3Å; L313-V317 PolarHBondContact O-N 3.45Å; D314-V317 PolarHBondContact O-N 2.81Å; V317-G319 VanDerWaalsContact C-N 3.32Å; V317-G319 PolarHBondContact O-N 3.08Å; V317-Y320 PolarHBondContact O-N 3.23Å; V317-Y320 VanDerWaalsContact O-N 3.12Å; V317-L321 HydrophobicContact CG1-CD1 3.88Å; V317-L321 HydrophobicContact CG1-CG 4.34Å; V317-L321 WeakPolarHBondContact O-CG 3.42Å; V317-L321 PolarHBondContact O-N 3.43Å |
| 318 | S | 79.7 | Confident | 78.9 | Confident | 12 Ų | 12 | 55.1 Ų | 55.1 | 8% | 0.084 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -53.1 | -47 | 173.5 | 160.8 | 0 | 0 | 0 | 0 | 111.9 | D314 L315 Y320 L321 N322 S434 | D314-S318 WeakPolarHBondContact O-CB 3.38Å; D314-S318 PolarHBondContact O-N 3.47Å; L315-S318 PolarHBondContact O-N 3.46Å; S318-Y320 VanDerWaalsContact C-N 3.34Å; S318-Y320 PolarHBondContact O-N 3.45Å; S318-L321 PolarHBondContact O-N 3.21Å; S318-N322 WeakPolarHBondContact O-CB 3.5Å; S318-N322 PolarHBondContact O-N 2.88Å; S318-S434 WeakPolarHBondContact OG-CB 3.08Å |
| 319 | G | 84.8 | Confident | 80 | Confident | 2 Ų | 2 | 50 Ų | 50 | 2% | 0.021 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -60 | -37.2 | 176.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | L315 R316 V317 L323 | L315-G319 PolarHBondContact O-N 2.98Å; L315-G319 VanDerWaalsContact O-N 3.07Å; R316-G319 PolarHBondContact O-N 2.89Å; V317-G319 VanDerWaalsContact C-N 3.32Å; V317-G319 PolarHBondContact O-N 3.08Å; G319-L323 PolarHBondContact O-N 3.21Å |
| 320 | Y | 85.1 | Confident | 81.1 | Confident | 130 Ų | 130 | 43.5 Ų | 43.5 | 51% | 0.51 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -74 | -35.8 | 175.7 | -70.2 | -60.6 | 0 | 0 | 0 | 113.2 | R316 V317 S318 N322 L323 A324 | R316-Y320 WeakPolarHBondContact O-CD2 3.34Å; R316-Y320 PolarHBondContact O-N 3.34Å; V317-Y320 PolarHBondContact O-N 3.23Å; V317-Y320 VanDerWaalsContact O-N 3.12Å; S318-Y320 VanDerWaalsContact C-N 3.34Å; S318-Y320 PolarHBondContact O-N 3.45Å; Y320-N322 VanDerWaalsContact C-N 3.35Å; Y320-L323 PolarHBondContact O-N 2.97Å; Y320-A324 PolarHBondContact O-N 2.95Å; Y320-A324 VanDerWaalsContact O-N 3.09Å |
| 321 | L | 84.4 | Confident | 82 | Confident | 5 Ų | 5 | 39.7 Ų | 39.7 | 3% | 0.026 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -66.7 | -41.3 | 175.5 | -71.8 | 167.1 | 0 | 0 | 0 | 110.7 | F230 V233 E234 V317 S318 L323 A324 A325 Y429 | F230-L321 HydrophobicContact CD1-CB 4.36Å; F230-L321 HydrophobicContact CD1-CD2 4.14Å; F230-L321 WeakPolarHBondContact CE1-O 3.24Å; V233-L321 HydrophobicContact CB-CD2 3.87Å; V233-L321 HydrophobicContact CG1-CD2 3.56Å; E234-L321 HydrophobicContact CB-CD1 3.58Å; E234-L321 HydrophobicContact CG-CD1 3.74Å; E234-L321 VanDerWaalsContact OE2-CD1 3.22Å; E234-L321 WeakPolarHBondContact OE2-CD1 3.31Å; V317-L321 HydrophobicContact CG1-CD1 3.88Å; V317-L321 HydrophobicContact CG1-CG 4.34Å; V317-L321 WeakPolarHBondContact O-CG 3.42Å; V317-L321 PolarHBondContact O-N 3.43Å; S318-L321 PolarHBondContact O-N 3.21Å; L321-L323 VanDerWaalsContact C-N 3.33Å; L321-L323 PolarHBondContact O-N 3.33Å; L321-A324 WeakPolarHBondContact O-CB 3.32Å; L321-A324 PolarHBondContact O-N 2.66Å; L321-A324 VanDerWaalsContact O-N 3.12Å; L321-A325 PolarHBondContact O-N 3.42Å; L321-Y429 HydrophobicContact CD1-CE1 4.3Å |
| 322 | N | 85.1 | Confident | 82.9 | Confident | 3 Ų | 3 | 33.7 Ų | 33.7 | 2% | 0.016 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -55 | -50.9 | 173.1 | -164.7 | 84 | 0 | 0 | 0 | 111.1 | S318 Y320 A324 A325 D326 D366 I369 V430 | S318-N322 WeakPolarHBondContact O-CB 3.5Å; S318-N322 PolarHBondContact O-N 2.88Å; Y320-N322 VanDerWaalsContact C-N 3.35Å; N322-A324 PolarHBondContact O-N 3.04Å; N322-A325 WeakPolarHBondContact O-CB 3.45Å; N322-A325 PolarHBondContact O-N 3.12Å; N322-A325 VanDerWaalsContact O-N 3.08Å; N322-D326 WeakPolarHBondContact O-CB 3.37Å; N322-D326 PolarHBondContact O-N 3.09Å; N322-D366 WeakPolarHBondContact ND2-CB 3.34Å; N322-D366 PolarHBondContact ND2-OD1 2.96Å; N322-D366 PolarHBondContact ND2-OD2 3.07Å; N322-D366 PolarHBondContact OD1-OD1 3.18Å; N322-I369 HydrophobicContact CB-CG2 3.9Å; N322-I369 WeakPolarHBondContact OD1-CD1 3.49Å; N322-V430 HydrophobicContact CB-CG1 4.43Å; N322-V430 VanDerWaalsContact OD1-CG1 3.28Å; N322-V430 WeakPolarHBondContact OD1-CG1 3.3Å |
| 323 | L | 87.3 | Confident | 83.7 | Confident | 24 Ų | 24 | 32.6 Ų | 32.6 | 13% | 0.126 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -58.6 | -34.7 | 177.5 | -169.6 | 71.5 | 0 | 0 | 0 | 113.3 | G319 Y320 L321 L327 L383 T387 | G319-L323 PolarHBondContact O-N 3.21Å; Y320-L323 PolarHBondContact O-N 2.97Å; L321-L323 VanDerWaalsContact C-N 3.33Å; L321-L323 PolarHBondContact O-N 3.33Å; L323-L327 VanDerWaalsContact O-CB 3.3Å; L323-L327 WeakPolarHBondContact O-CB 3.4Å; L323-L327 PolarHBondContact O-N 3.12Å; L323-L383 HydrophobicContact CD1-CB 4.13Å; L323-L383 WeakPolarHBondContact CD1-O 3.38Å; L323-L383 HydrophobicContact CD2-CB 4.41Å; L323-L383 HydrophobicContact CD2-CD2 4.11Å; L323-T387 HydrophobicContact CD1-CG2 3.31Å; L323-T387 HydrophobicContact CG-CG2 4.04Å |
| 324 | A | 85.1 | Confident | 84.4 | Confident | 46 Ų | 46 | 30.2 Ų | 30.2 | 38% | 0.38 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -72.7 | -36.8 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | Y320 L321 N322 A328 | Y320-A324 PolarHBondContact O-N 2.95Å; Y320-A324 VanDerWaalsContact O-N 3.09Å; L321-A324 WeakPolarHBondContact O-CB 3.32Å; L321-A324 PolarHBondContact O-N 2.66Å; L321-A324 VanDerWaalsContact O-N 3.12Å; N322-A324 PolarHBondContact O-N 3.04Å; A324-A328 PolarHBondContact O-N 3.01Å |
| 325 | A | 84.3 | Confident | 84.9 | Confident | 2 Ų | 2 | 28 Ų | 28 | 2% | 0.017 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -65.9 | -47.6 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.1 | F230 L321 N322 L327 A328 H329 F427 V430 | F230-A325 HydrophobicContact CE1-CB 3.66Å; F230-A325 HydrophobicContact CZ-CB 3.65Å; L321-A325 PolarHBondContact O-N 3.42Å; N322-A325 WeakPolarHBondContact O-CB 3.45Å; N322-A325 PolarHBondContact O-N 3.12Å; N322-A325 VanDerWaalsContact O-N 3.08Å; A325-L327 PolarHBondContact O-N 2.78Å; A325-A328 WeakPolarHBondContact O-CB 3.32Å; A325-A328 PolarHBondContact O-N 3.39Å; A325-H329 PolarHBondContact O-N 3.48Å; A325-F427 HydrophobicContact CB-CD1 3.76Å; A325-F427 HydrophobicContact CB-CE1 3.73Å; A325-V430 HydrophobicContact CB-CG2 4.19Å |
| 326 | D | 86.9 | Confident | 85.3 | Confident | 3 Ų | 3 | 27.3 Ų | 27.3 | 2% | 0.016 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -59.3 | -46.2 | 178.4 | -171.8 | 43.9 | 0 | 0 | 0 | 111.8 | N322 A328 H329 N330 D366 T387 | N322-D326 WeakPolarHBondContact O-CB 3.37Å; N322-D326 PolarHBondContact O-N 3.09Å; D326-A328 VanDerWaalsContact C-N 3.27Å; D326-A328 PolarHBondContact O-N 3.47Å; D326-H329 PolarHBondContact O-N 2.82Å; D326-N330 VanDerWaalsContact O-CB 3.29Å; D326-N330 WeakPolarHBondContact O-CB 3.47Å; D326-N330 VanDerWaalsContact O-CG 3.26Å; D326-N330 PolarHBondContact O-N 3.33Å; D326-N330 PolarHBondContact O-OD1 3.39Å; D326-D366 WeakPolarHBondContact CB-OD2 3.31Å; D326-T387 HydrophobicContact CB-CG2 4.15Å; D326-T387 VanDerWaalsContact OD2-CB 3.24Å; D326-T387 WeakPolarHBondContact OD2-CB 3.41Å; D326-T387 WeakPolarHBondContact OD2-CG2 3.49Å; D326-T387 PolarHBondContact OD2-OG1 3.04Å |
| 327 | L | 88.6 | Confident | 85.7 | Confident | 73 Ų | 73 | 20.6 Ų | 20.6 | 38% | 0.382 | 11% | 0.114 | S | C | . | . | H | α-helix | trans | -55 | -41.8 | 172.5 | -177.3 | 81.8 | 0 | 0 | 0 | 112.9 | L323 A325 F331 T387 | L323-L327 VanDerWaalsContact O-CB 3.3Å; L323-L327 WeakPolarHBondContact O-CB 3.4Å; L323-L327 PolarHBondContact O-N 3.12Å; A325-L327 PolarHBondContact O-N 2.78Å; L327-F331 WeakPolarHBondContact O-CB 3.45Å; L327-F331 PolarHBondContact O-N 3.25Å; L327-T387 HydrophobicContact CB-CG2 4.27Å |
| 328 | A | 82.6 | Confident | 85.9 | Confident | 27 Ų | 27 | 20.4 Ų | 20.4 | 22% | 0.223 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -73.8 | -34.5 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | A324 A325 D326 F331 T332 | A324-A328 PolarHBondContact O-N 3.01Å; A325-A328 WeakPolarHBondContact O-CB 3.32Å; A325-A328 PolarHBondContact O-N 3.39Å; D326-A328 VanDerWaalsContact C-N 3.27Å; D326-A328 PolarHBondContact O-N 3.47Å; A328-F331 WeakPolarHBondContact O-CB 3.42Å; A328-T332 PolarHBondContact O-N 2.91Å |
| 329 | H | 86.3 | Confident | 86 | Confident | 0 Ų | 0 | 20.6 Ų | 20.6 | 0% | 0 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -69.7 | -47 | 173.4 | -177 | 73.7 | 0 | 0 | 0 | 111.5 | D183 A325 D326 F331 T332 D333 T423 F427 | D183-H329 IonicContact OD1-CE1 3.99Å; D183-H329 IonicContact OD2-CE1 3.71Å; D183-H329 PolarHBondContact OD2-CE1 2.94Å; D183-H329 VanDerWaalsContact OD2-CE1 3.25Å; D183-H329 IonicContact OD2-ND1 4Å; A325-H329 PolarHBondContact O-N 3.48Å; D326-H329 PolarHBondContact O-N 2.82Å; H329-F331 PolarHBondContact O-N 3.07Å; H329-F331 VanDerWaalsContact O-N 3.16Å; H329-T332 WeakPolarHBondContact CA-OG1 3.36Å; H329-T332 WeakPolarHBondContact O-CA 3.37Å; H329-T332 PolarHBondContact O-N 2.92Å; H329-T332 PolarHBondContact O-OG1 3.21Å; H329-D333 IonicContact CD2-OD2 2.96Å; H329-D333 IonicContact CE1-OD1 2.7Å; H329-D333 IonicContact NE2-OD2 2.66Å; H329-D333 PolarHBondContact O-N 2.95Å; H329-T423 HydrophobicContact CB-CG2 3.88Å; H329-F427 HydrophobicContact CB-CE1 4.07Å; H329-F427 HydrophobicContact CB-CE2 4.01Å; H329-F427 HydrophobicContact CB-CZ 3.33Å; H329-F427 AromaticContact CD2-CZ 3.85Å; H329-F427 AromaticContact CE1-CE2 3.73Å; H329-F427 AromaticContact CG-CE2 3.61Å; H329-F427 AromaticContact CG-CZ 3.33Å; H329-F427 AromaticContact ND1-CE2 3.34Å; H329-F427 VanDerWaalsContact ND1-CE2 3.34Å; H329-F427 WeakPolarHBondContact ND1-CE2 3.4Å; H329-F427 AromaticContact ND1-CZ 3.6Å |
| 330 | N | 89.9 | Confident | 85.9 | Confident | 1 Ų | 1 | 21.1 Ų | 21.1 | 1% | 0.005 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -60.2 | -35.4 | 177 | -72.1 | 11.6 | 0 | 0 | 0 | 110.4 | D326 D333 G334 E359 T387 A391 | D326-N330 VanDerWaalsContact O-CB 3.29Å; D326-N330 WeakPolarHBondContact O-CB 3.47Å; D326-N330 VanDerWaalsContact O-CG 3.26Å; D326-N330 PolarHBondContact O-N 3.33Å; D326-N330 PolarHBondContact O-OD1 3.39Å; N330-D333 PolarHBondContact O-N 3.12Å; N330-G334 PolarHBondContact O-N 3.13Å; N330-E359 PolarHBondContact ND2-OE1 2.94Å; N330-E359 PolarHBondContact OD1-OE1 3.44Å; N330-E359 VanDerWaalsContact OD1-OE1 3.1Å; N330-T387 PolarHBondContact ND2-OG1 3.39Å; N330-T387 VanDerWaalsContact ND2-OG1 3.12Å; N330-A391 HydrophobicContact CB-CB 4.12Å; N330-A391 WeakPolarHBondContact O-CA 3.48Å; N330-A391 VanDerWaalsContact O-CB 3.29Å; N330-A391 WeakPolarHBondContact O-CB 3.5Å; N330-A391 PolarHBondContact O-N 3.43Å |
| 331 | F | 88 | Confident | 85.9 | Confident | 58 Ų | 58 | 15.7 Ų | 15.7 | 25% | 0.254 | 10% | 0.098 | S | C | . | . | H | α-helix | trans | -60.5 | -43 | 170.1 | 175.2 | -94.6 | 0 | 0 | 0 | 113.7 | L327 A328 H329 G334 L335 G390 A393 G394 V419 | L327-F331 WeakPolarHBondContact O-CB 3.45Å; L327-F331 PolarHBondContact O-N 3.25Å; A328-F331 WeakPolarHBondContact O-CB 3.42Å; H329-F331 PolarHBondContact O-N 3.07Å; H329-F331 VanDerWaalsContact O-N 3.16Å; F331-G334 PolarHBondContact O-N 3.3Å; F331-L335 HydrophobicContact CD1-CD1 3.9Å; F331-L335 HydrophobicContact CE1-CD1 3.32Å; F331-L335 HydrophobicContact CE1-CG 4.08Å; F331-L335 HydrophobicContact CZ-CD1 3.77Å; F331-L335 HydrophobicContact CZ-CD2 4.46Å; F331-L335 HydrophobicContact CZ-CG 4.14Å; F331-L335 WeakPolarHBondContact O-CG 3.48Å; F331-L335 PolarHBondContact O-N 3.06Å; F331-G390 WeakPolarHBondContact CA-O 3.39Å; F331-G390 WeakPolarHBondContact CD2-O 3.5Å; F331-A393 HydrophobicContact CD2-CB 4.23Å; F331-A393 HydrophobicContact CE2-CB 4.43Å; F331-G394 VanDerWaalsContact CD2-CA 3.46Å; F331-G394 VanDerWaalsContact CE2-CA 3.48Å; F331-G394 WeakPolarHBondContact O-CA 3.33Å; F331-V419 HydrophobicContact CD1-CG1 4.4Å |
| 332 | T | 84.1 | Confident | 85.9 | Confident | 5 Ų | 5 | 19.7 Ų | 19.7 | 3% | 0.031 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -67.4 | -37.2 | 176.1 | 46.8 | 0 | 0 | 0 | 0 | 112.6 | A328 H329 G334 L335 A336 V419 L420 | A328-T332 PolarHBondContact O-N 2.91Å; H329-T332 WeakPolarHBondContact CA-OG1 3.36Å; H329-T332 WeakPolarHBondContact O-CA 3.37Å; H329-T332 PolarHBondContact O-N 2.92Å; H329-T332 PolarHBondContact O-OG1 3.21Å; T332-G334 VanDerWaalsContact C-N 3.34Å; T332-L335 WeakPolarHBondContact O-CB 3.37Å; T332-L335 PolarHBondContact O-N 3.31Å; T332-A336 PolarHBondContact O-N 2.95Å; T332-V419 HydrophobicContact CG2-CB 4.13Å; T332-V419 HydrophobicContact CG2-CG1 3.31Å; T332-L420 HydrophobicContact CG2-CD2 4Å |
| 333 | D | 88.1 | Confident | 85.3 | Confident | 7 Ų | 7 | 22.5 Ų | 22.5 | 4% | 0.037 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -64.9 | -42.7 | 175 | -68.8 | -0.2 | 0 | 0 | 0 | 111.5 | I145 H329 N330 L335 A336 I337 V355 H358 | I145-D333 HydrophobicContact CD1-CB 4.37Å; H329-D333 IonicContact CD2-OD2 2.96Å; H329-D333 IonicContact CE1-OD1 2.7Å; H329-D333 IonicContact NE2-OD2 2.66Å; H329-D333 PolarHBondContact O-N 2.95Å; N330-D333 PolarHBondContact O-N 3.12Å; D333-L335 VanDerWaalsContact C-N 3.31Å; D333-L335 PolarHBondContact O-N 2.84Å; D333-A336 PolarHBondContact O-N 2.91Å; D333-I337 WeakPolarHBondContact O-CG1 3.37Å; D333-I337 PolarHBondContact O-N 3.02Å; D333-V355 HydrophobicContact CB-CG1 3.83Å; D333-V355 HydrophobicContact CB-CG2 4.44Å; D333-H358 IonicContact OD1-NE2 3.48Å; D333-H358 IonicContact OD2-NE2 2.78Å |
| 334 | G | 89.4 | Confident | 84.9 | Confident | 0 Ų | 0 | 22.7 Ų | 22.7 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -57.8 | -44 | 172.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | N330 F331 T332 G338 A391 G394 T395 | N330-G334 PolarHBondContact O-N 3.13Å; F331-G334 PolarHBondContact O-N 3.3Å; T332-G334 VanDerWaalsContact C-N 3.34Å; G334-G338 PolarHBondContact O-N 2.67Å; G334-A391 WeakPolarHBondContact CA-O 3.39Å; G334-G394 VanDerWaalsContact C-C 3.5Å; G334-T395 VanDerWaalsContact C-N 3.27Å; G334-T395 WeakPolarHBondContact CA-OG1 3.35Å; G334-T395 WeakPolarHBondContact O-CA 3.28Å; G334-T395 WeakPolarHBondContact O-CB 3.36Å; G334-T395 PolarHBondContact O-N 3.49Å; G334-T395 PolarHBondContact O-OG1 3.01Å |
| 335 | L | 85.3 | Confident | 85 | Confident | 2 Ų | 2 | 27.8 Ų | 27.8 | 1% | 0.01 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -60.4 | -47.6 | 174.4 | -79.7 | 170.7 | 0 | 0 | 0 | 111.3 | F331 T332 D333 G338 A339 G394 C397 A398 V406 V410 | F331-L335 HydrophobicContact CD1-CD1 3.9Å; F331-L335 HydrophobicContact CE1-CD1 3.32Å; F331-L335 HydrophobicContact CE1-CG 4.08Å; F331-L335 HydrophobicContact CZ-CD1 3.77Å; F331-L335 HydrophobicContact CZ-CD2 4.46Å; F331-L335 HydrophobicContact CZ-CG 4.14Å; F331-L335 WeakPolarHBondContact O-CG 3.48Å; F331-L335 PolarHBondContact O-N 3.06Å; T332-L335 WeakPolarHBondContact O-CB 3.37Å; T332-L335 PolarHBondContact O-N 3.31Å; D333-L335 VanDerWaalsContact C-N 3.31Å; D333-L335 PolarHBondContact O-N 2.84Å; L335-G338 PolarHBondContact O-N 2.9Å; L335-A339 VanDerWaalsContact O-CB 3.31Å; L335-A339 WeakPolarHBondContact O-CB 3.27Å; L335-A339 PolarHBondContact O-N 3.43Å; L335-G394 VanDerWaalsContact CD2-O 3.29Å; L335-G394 WeakPolarHBondContact CD2-O 3.43Å; L335-C397 HydrophobicContact CD2-CB 3.92Å; L335-A398 HydrophobicContact CD2-CB 4.04Å; L335-A398 WeakPolarHBondContact O-CB 3.27Å; L335-V406 HydrophobicContact CD2-CG1 4.28Å; L335-V410 HydrophobicContact CD1-CG1 4.09Å; L335-V410 HydrophobicContact CD1-CG2 4.41Å |
| 336 | A | 82.9 | Confident | 85 | Confident | 29 Ų | 29 | 30.4 Ų | 30.4 | 24% | 0.24 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -60.7 | -48.5 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.5 | T332 D333 G338 A339 S340 T351 | T332-A336 PolarHBondContact O-N 2.95Å; D333-A336 PolarHBondContact O-N 2.91Å; A336-G338 PolarHBondContact O-N 3.31Å; A336-A339 PolarHBondContact O-N 3.22Å; A336-S340 WeakPolarHBondContact O-CB 3.39Å; A336-S340 PolarHBondContact O-N 2.94Å; A336-S340 PolarHBondContact O-OG 3.27Å; A336-S340 VanDerWaalsContact O-OG 3.09Å; A336-T351 HydrophobicContact CB-CG2 4.18Å |
| 337 | I | 89.2 | Confident | 84.5 | Confident | 0 Ų | 0 | 34.5 Ų | 34.5 | 0% | 0 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -58.9 | -48.2 | 176.7 | -71.2 | 173.6 | 0 | 0 | 0 | 111 | A141 I145 D333 A339 S340 F341 T351 V355 | A141-I337 HydrophobicContact CB-CG2 3.99Å; I145-I337 HydrophobicContact CD1-CD1 3.5Å; I145-I337 HydrophobicContact CG1-CD1 4.09Å; I145-I337 HydrophobicContact CG2-CD1 4.1Å; D333-I337 WeakPolarHBondContact O-CG1 3.37Å; D333-I337 PolarHBondContact O-N 3.02Å; I337-A339 VanDerWaalsContact C-N 3.33Å; I337-A339 PolarHBondContact O-N 3.4Å; I337-S340 PolarHBondContact O-N 3.43Å; I337-F341 HydrophobicContact CG2-CD2 3.78Å; I337-F341 HydrophobicContact CG2-CE2 3.88Å; I337-F341 WeakPolarHBondContact O-CD2 3.49Å; I337-F341 PolarHBondContact O-N 3.29Å; I337-T351 HydrophobicContact CG1-CG2 4.2Å; I337-V355 HydrophobicContact CD1-CB 4.41Å; I337-V355 HydrophobicContact CD1-CG1 4.28Å; I337-V355 HydrophobicContact CG1-CG2 4.44Å |
| 338 | G | 86.8 | Confident | 84.3 | Confident | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -62.9 | -38.8 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113 | G334 L335 A336 R342 | G334-G338 PolarHBondContact O-N 2.67Å; L335-G338 PolarHBondContact O-N 2.9Å; A336-G338 PolarHBondContact O-N 3.31Å; G338-R342 PolarHBondContact O-N 3.07Å |
| 339 | A | 82 | Confident | 84.7 | Confident | 15 Ų | 15 | 33.5 Ų | 33.5 | 12% | 0.124 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -67 | -45.8 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.7 | L335 A336 I337 F341 R342 G343 G407 | L335-A339 VanDerWaalsContact O-CB 3.31Å; L335-A339 WeakPolarHBondContact O-CB 3.27Å; L335-A339 PolarHBondContact O-N 3.43Å; A336-A339 PolarHBondContact O-N 3.22Å; I337-A339 VanDerWaalsContact C-N 3.33Å; I337-A339 PolarHBondContact O-N 3.4Å; A339-F341 PolarHBondContact O-N 3.18Å; A339-R342 WeakPolarHBondContact O-CB 3.25Å; A339-R342 PolarHBondContact O-N 3.06Å; A339-R342 VanDerWaalsContact O-N 3.14Å; A339-G343 PolarHBondContact O-N 3.34Å; A339-G407 VanDerWaalsContact CB-C 3.48Å; A339-G407 WeakPolarHBondContact CB-O 3.4Å |
| 340 | S | 82.2 | Confident | 84.7 | Confident | 14 Ų | 14 | 38.3 Ų | 38.3 | 10% | 0.098 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -63.7 | -42.1 | -179.4 | -70.9 | 0 | 0 | 0 | 0 | 112.9 | A336 I337 R342 G343 G344 T351 | A336-S340 WeakPolarHBondContact O-CB 3.39Å; A336-S340 PolarHBondContact O-N 2.94Å; A336-S340 PolarHBondContact O-OG 3.27Å; A336-S340 VanDerWaalsContact O-OG 3.09Å; I337-S340 PolarHBondContact O-N 3.43Å; S340-R342 PolarHBondContact O-N 2.66Å; S340-G343 CarbonylContact O-C 3.53Å; S340-G343 WeakPolarHBondContact O-CA 3.43Å; S340-G343 PolarHBondContact O-N 3.06Å; S340-G343 VanDerWaalsContact O-N 3.08Å; S340-G344 PolarHBondContact O-N 2.86Å; S340-T351 VanDerWaalsContact CB-OG1 3.29Å; S340-T351 WeakPolarHBondContact CB-OG1 3.49Å; S340-T351 WeakPolarHBondContact OG-CB 3.47Å; S340-T351 PolarHBondContact OG-OG1 3.34Å |
| 341 | F | 86.6 | Confident | 84.5 | Confident | 15 Ų | 15 | 39.4 Ų | 39.4 | 7% | 0.066 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -64.6 | -29.6 | 175.3 | -89 | -71.9 | 0 | 0 | 0 | 112.9 | L134 A138 A141 I337 A339 G344 I349 T352 | L134-F341 VanDerWaalsContact CD1-C 3.45Å; L134-F341 HydrophobicContact CD1-CB 3.78Å; L134-F341 WeakPolarHBondContact CD1-O 3.43Å; A138-F341 HydrophobicContact CB-CB 4.09Å; A138-F341 HydrophobicContact CB-CD2 3.97Å; A138-F341 HydrophobicContact CB-CG 4.17Å; A141-F341 HydrophobicContact CB-CE2 3.55Å; A141-F341 HydrophobicContact CB-CZ 4.04Å; I337-F341 HydrophobicContact CG2-CD2 3.78Å; I337-F341 HydrophobicContact CG2-CE2 3.88Å; I337-F341 WeakPolarHBondContact O-CD2 3.49Å; I337-F341 PolarHBondContact O-N 3.29Å; A339-F341 PolarHBondContact O-N 3.18Å; F341-G344 PolarHBondContact O-N 3.34Å; F341-I349 HydrophobicContact CE1-CG1 4.36Å; F341-I349 HydrophobicContact CZ-CG1 4.34Å; F341-T352 WeakPolarHBondContact CE2-OG1 3.4Å |
| 342 | R | 82.6 | Confident | 84.6 | Confident | 89 Ų | 89 | 36.9 Ų | 36.9 | 34% | 0.336 | 22% | 0.22 | S | C | . | . | H | α-helix | trans | -71 | -36.5 | 170 | -80.4 | -174.8 | 130.7 | 175 | -5 | 113 | L134 G338 A339 S340 G344 A398 L399 T401 | L134-R342 HydrophobicContact CD1-CG 4.35Å; L134-R342 HydrophobicContact CD2-CG 3.83Å; G338-R342 PolarHBondContact O-N 3.07Å; A339-R342 WeakPolarHBondContact O-CB 3.25Å; A339-R342 PolarHBondContact O-N 3.06Å; A339-R342 VanDerWaalsContact O-N 3.14Å; S340-R342 PolarHBondContact O-N 2.66Å; R342-G344 PolarHBondContact O-N 2.93Å; R342-A398 PolarHBondContact NH1-O 2.9Å; R342-L399 HydrophobicContact CG-CD2 4.04Å; R342-L399 PolarHBondContact NH1-O 3Å; R342-L399 VanDerWaalsContact NH1-O 3.1Å; R342-L399 PolarHBondContact NH2-O 3.21Å; R342-T401 PolarHBondContact NH1-O 2.99Å |
| 343 | G | 72.9 | Confident | 84.8 | Confident | 63 Ų | 63 | 41 Ų | 41 | 65% | 0.649 | 24% | 0.24 | S | C | * | . | H | α-helix | trans | -67.5 | -25.8 | 172.1 | 0 | 0 | 0 | 0 | 0 | 113 | A339 S340 | A339-G343 PolarHBondContact O-N 3.34Å; S340-G343 CarbonylContact O-C 3.53Å; S340-G343 WeakPolarHBondContact O-CA 3.43Å; S340-G343 PolarHBondContact O-N 3.06Å; S340-G343 VanDerWaalsContact O-N 3.08Å |
| 344 | G | 79.5 | Confident | 84.7 | Confident | 27 Ų | 27 | 41.5 Ų | 41.5 | 28% | 0.278 | 24% | 0.243 | S | C | . | . | trans | 154.2 | 156 | 169.4 | 0 | 0 | 0 | 0 | 0 | 112.4 | S340 F341 R342 G346 L347 G348 | S340-G344 PolarHBondContact O-N 2.86Å; F341-G344 PolarHBondContact O-N 3.34Å; R342-G344 PolarHBondContact O-N 2.93Å; G344-G346 VanDerWaalsContact C-N 3.3Å; G344-G346 PolarHBondContact O-N 3.39Å; G344-L347 PolarHBondContact O-N 3.13Å; G344-G348 PolarHBondContact O-N 2.83Å | ||
| 345 | R | 87.7 | Confident | 84.7 | Confident | 154 Ų | 154 | 41.8 Ų | 41.8 | 58% | 0.581 | 25% | 0.245 | S | C | * | . | H | α-helix | trans | -58.4 | -39.2 | -178.1 | 179.5 | 174.4 | 139.2 | -177.9 | -7.1 | 113.3 | I349 | R345-I349 HydrophobicContact CG-CD1 3.95Å; R345-I349 VanDerWaalsContact O-CG1 3.27Å; R345-I349 WeakPolarHBondContact O-CG1 3.38Å; R345-I349 PolarHBondContact O-N 3.15Å |
| 346 | G | 82.6 | Confident | 84.8 | Confident | 57 Ų | 57 | 43.3 Ų | 43.3 | 59% | 0.588 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -63.6 | -46.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.3 | G344 I349 L350 | G344-G346 VanDerWaalsContact C-N 3.3Å; G344-G346 PolarHBondContact O-N 3.39Å; G346-I349 PolarHBondContact O-N 3.04Å; G346-L350 PolarHBondContact O-N 2.77Å |
| 347 | L | 78.3 | Confident | 85 | Confident | 89 Ų | 89 | 46.5 Ų | 46.5 | 47% | 0.466 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -62.7 | -45.1 | 176.9 | -175.6 | 62.5 | 0 | 0 | 0 | 111.3 | G344 I349 L350 T351 | G344-L347 PolarHBondContact O-N 3.13Å; L347-I349 PolarHBondContact O-N 2.96Å; L347-L350 PolarHBondContact O-N 3.41Å; L347-T351 PolarHBondContact O-N 3.48Å; L347-T351 PolarHBondContact O-OG1 3.4Å; L347-T351 VanDerWaalsContact O-OG1 3.11Å |
| 348 | G | 84.5 | Confident | 84.8 | Confident | 0 Ų | 0 | 46.6 Ų | 46.6 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -56.9 | -43.4 | 175.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | G344 T352 | G344-G348 PolarHBondContact O-N 2.83Å; G348-T352 WeakPolarHBondContact O-CB 3.34Å; G348-T352 PolarHBondContact O-N 3.44Å; G348-T352 PolarHBondContact O-OG1 2.96Å |
| 349 | I | 90.8 | Very high | 84.8 | Confident | 79 Ų | 79 | 46.6 Ų | 46.6 | 41% | 0.405 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -64.8 | -44.6 | 176.6 | -68.3 | 165 | 0 | 0 | 0 | 110.9 | F341 R345 G346 L347 T352 M353 | F341-I349 HydrophobicContact CE1-CG1 4.36Å; F341-I349 HydrophobicContact CZ-CG1 4.34Å; R345-I349 HydrophobicContact CG-CD1 3.95Å; R345-I349 VanDerWaalsContact O-CG1 3.27Å; R345-I349 WeakPolarHBondContact O-CG1 3.38Å; R345-I349 PolarHBondContact O-N 3.15Å; G346-I349 PolarHBondContact O-N 3.04Å; L347-I349 PolarHBondContact O-N 2.96Å; I349-T352 WeakPolarHBondContact O-CB 3.38Å; I349-T352 PolarHBondContact O-N 2.87Å; I349-M353 WeakPolarHBondContact O-CG 3.43Å; I349-M353 PolarHBondContact O-N 3.37Å |
| 350 | L | 85.6 | Confident | 84.9 | Confident | 101 Ų | 101 | 47.7 Ų | 47.7 | 53% | 0.529 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -61.5 | -50.9 | 178.8 | -177.2 | 61.5 | 0 | 0 | 0 | 111.2 | G346 L347 T352 M353 T354 | G346-L350 PolarHBondContact O-N 2.77Å; L347-L350 PolarHBondContact O-N 3.41Å; L350-T352 VanDerWaalsContact C-N 3.28Å; L350-T352 PolarHBondContact O-N 3.44Å; L350-M353 PolarHBondContact O-N 2.96Å; L350-T354 PolarHBondContact O-N 2.88Å; L350-T354 PolarHBondContact O-OG1 2.88Å |
| 351 | T | 85.2 | Confident | 84.7 | Confident | 24 Ų | 24 | 48 Ų | 48 | 15% | 0.147 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -57.6 | -40.9 | 176 | -57.2 | 0 | 0 | 0 | 0 | 111.7 | A336 I337 S340 L347 M353 T354 V355 | A336-T351 HydrophobicContact CB-CG2 4.18Å; I337-T351 HydrophobicContact CG1-CG2 4.2Å; S340-T351 VanDerWaalsContact CB-OG1 3.29Å; S340-T351 WeakPolarHBondContact CB-OG1 3.49Å; S340-T351 WeakPolarHBondContact OG-CB 3.47Å; S340-T351 PolarHBondContact OG-OG1 3.34Å; L347-T351 PolarHBondContact O-N 3.48Å; L347-T351 PolarHBondContact O-OG1 3.4Å; L347-T351 VanDerWaalsContact O-OG1 3.11Å; T351-M353 VanDerWaalsContact C-N 3.33Å; T351-M353 PolarHBondContact O-N 2.92Å; T351-T354 PolarHBondContact O-N 2.71Å; T351-V355 HydrophobicContact CG2-CG2 4.25Å; T351-V355 WeakPolarHBondContact O-CB 3.2Å; T351-V355 VanDerWaalsContact O-CG2 3.25Å; T351-V355 WeakPolarHBondContact O-CG2 3.22Å; T351-V355 PolarHBondContact O-N 2.81Å |
| 352 | T | 90.8 | Very high | 84.6 | Confident | 5 Ų | 5 | 47.6 Ų | 47.6 | 3% | 0.031 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -61.1 | -42 | 176.4 | -56.7 | 0 | 0 | 0 | 0 | 111.8 | A141 I145 F341 G348 I349 L350 L356 | A141-T352 HydrophobicContact CB-CG2 3.68Å; A141-T352 WeakPolarHBondContact CB-OG1 3.44Å; I145-T352 HydrophobicContact CG2-CG2 3.89Å; F341-T352 WeakPolarHBondContact CE2-OG1 3.4Å; G348-T352 WeakPolarHBondContact O-CB 3.34Å; G348-T352 PolarHBondContact O-N 3.44Å; G348-T352 PolarHBondContact O-OG1 2.96Å; I349-T352 WeakPolarHBondContact O-CB 3.38Å; I349-T352 PolarHBondContact O-N 2.87Å; L350-T352 VanDerWaalsContact C-N 3.28Å; L350-T352 PolarHBondContact O-N 3.44Å; T352-L356 VanDerWaalsContact O-CB 3.22Å; T352-L356 WeakPolarHBondContact O-CB 3.26Å; T352-L356 PolarHBondContact O-N 3.14Å |
| 353 | M | 88.8 | Confident | 84.8 | Confident | 91 Ų | 91 | 43.5 Ų | 43.5 | 45% | 0.448 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -69.2 | -43.5 | 179.8 | -69.7 | -62.9 | 152.3 | 0 | 0 | 111.6 | I349 L350 T351 L356 L357 | I349-M353 WeakPolarHBondContact O-CG 3.43Å; I349-M353 PolarHBondContact O-N 3.37Å; L350-M353 PolarHBondContact O-N 2.96Å; T351-M353 VanDerWaalsContact C-N 3.33Å; T351-M353 PolarHBondContact O-N 2.92Å; M353-L356 PolarHBondContact O-N 2.9Å; M353-L357 VanDerWaalsContact O-CG 3.27Å; M353-L357 WeakPolarHBondContact O-CG 3.37Å; M353-L357 PolarHBondContact O-N 3.43Å |
| 354 | T | 85.2 | Confident | 85.3 | Confident | 18 Ų | 18 | 41.3 Ų | 41.3 | 11% | 0.11 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -55.3 | -53.2 | 172.6 | -68.2 | 0 | 0 | 0 | 0 | 111.5 | L350 T351 L356 L357 H358 E469 | L350-T354 PolarHBondContact O-N 2.88Å; L350-T354 PolarHBondContact O-OG1 2.88Å; T351-T354 PolarHBondContact O-N 2.71Å; T354-L356 VanDerWaalsContact C-N 3.33Å; T354-L356 PolarHBondContact O-N 3.44Å; T354-L357 WeakPolarHBondContact O-CB 3.39Å; T354-L357 PolarHBondContact O-N 3.41Å; T354-H358 PolarHBondContact O-N 2.81Å; T354-E469 VanDerWaalsContact CG2-CD 3.49Å; T354-E469 HydrophobicContact CG2-CG 3.21Å; T354-E469 WeakPolarHBondContact CG2-OE1 3.35Å |
| 355 | V | 88.5 | Confident | 85.4 | Confident | 5 Ų | 5 | 40 Ų | 40 | 3% | 0.03 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -60.5 | -45.5 | -179.3 | 169.3 | 0 | 0 | 0 | 0 | 110.8 | I145 D333 I337 T351 L357 H358 E359 | I145-V355 HydrophobicContact CB-CG1 4.4Å; I145-V355 HydrophobicContact CD1-CG1 3.59Å; I145-V355 HydrophobicContact CG2-CG1 4.19Å; D333-V355 HydrophobicContact CB-CG1 3.83Å; D333-V355 HydrophobicContact CB-CG2 4.44Å; I337-V355 HydrophobicContact CD1-CB 4.41Å; I337-V355 HydrophobicContact CD1-CG1 4.28Å; I337-V355 HydrophobicContact CG1-CG2 4.44Å; T351-V355 HydrophobicContact CG2-CG2 4.25Å; T351-V355 WeakPolarHBondContact O-CB 3.2Å; T351-V355 VanDerWaalsContact O-CG2 3.25Å; T351-V355 WeakPolarHBondContact O-CG2 3.22Å; T351-V355 PolarHBondContact O-N 2.81Å; V355-L357 PolarHBondContact O-N 3.49Å; V355-L357 VanDerWaalsContact O-N 3.16Å; V355-H358 WeakPolarHBondContact CA-NE2 3.41Å; V355-H358 PolarHBondContact O-CD2 3.16Å; V355-H358 PolarHBondContact O-N 2.69Å; V355-E359 VanDerWaalsContact O-CB 3.22Å; V355-E359 WeakPolarHBondContact O-CB 3.21Å; V355-E359 PolarHBondContact O-N 2.92Å |
| 356 | L | 89.2 | Confident | 85.3 | Confident | 35 Ų | 35 | 32.9 Ų | 32.9 | 18% | 0.183 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -56.1 | -36.2 | 176.8 | -178.2 | 63.6 | 0 | 0 | 0 | 112.8 | I145 A148 T352 M353 T354 V360 | I145-L356 HydrophobicContact CG2-CB 4.12Å; A148-L356 HydrophobicContact CB-CD1 3.45Å; A148-L356 VanDerWaalsContact CB-CD1 3.45Å; T352-L356 VanDerWaalsContact O-CB 3.22Å; T352-L356 WeakPolarHBondContact O-CB 3.26Å; T352-L356 PolarHBondContact O-N 3.14Å; M353-L356 PolarHBondContact O-N 2.9Å; T354-L356 VanDerWaalsContact C-N 3.33Å; T354-L356 PolarHBondContact O-N 3.44Å; L356-V360 HydrophobicContact CD1-CG2 4.31Å; L356-V360 WeakPolarHBondContact O-CG2 3.39Å; L356-V360 PolarHBondContact O-N 3.21Å |
| 357 | L | 85.4 | Confident | 85.6 | Confident | 96 Ų | 96 | 30.2 Ų | 30.2 | 50% | 0.503 | 16% | 0.162 | S | C | . | . | H | α-helix | trans | -71 | -36 | -178.7 | -73.7 | 170.4 | 0 | 0 | 0 | 112.7 | M353 T354 V355 P361 I465 L468 | M353-L357 VanDerWaalsContact O-CG 3.27Å; M353-L357 WeakPolarHBondContact O-CG 3.37Å; M353-L357 PolarHBondContact O-N 3.43Å; T354-L357 WeakPolarHBondContact O-CB 3.39Å; T354-L357 PolarHBondContact O-N 3.41Å; V355-L357 PolarHBondContact O-N 3.49Å; V355-L357 VanDerWaalsContact O-N 3.16Å; L357-P361 WeakPolarHBondContact O-CD 3.46Å; L357-P361 WeakPolarHBondContact O-CG 2.97Å; L357-I465 HydrophobicContact CB-CD1 4.5Å; L357-L468 HydrophobicContact CD1-CD1 4.48Å |
| 358 | H | 85.8 | Confident | 85.9 | Confident | 2 Ų | 2 | 26 Ų | 26 | 1% | 0.009 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -84.2 | -28.5 | 174.1 | 55.6 | -130.9 | 0 | 0 | 0 | 113.1 | D333 T354 V355 P361 H362 M462 I465 E469 | D333-H358 IonicContact OD1-NE2 3.48Å; D333-H358 IonicContact OD2-NE2 2.78Å; T354-H358 PolarHBondContact O-N 2.81Å; V355-H358 WeakPolarHBondContact CA-NE2 3.41Å; V355-H358 PolarHBondContact O-CD2 3.16Å; V355-H358 PolarHBondContact O-N 2.69Å; H358-P361 VanDerWaalsContact O-CD 3.24Å; H358-P361 WeakPolarHBondContact O-CD 3.49Å; H358-H362 PolarHBondContact O-CD2 2.83Å; H358-H362 PolarHBondContact O-N 3.42Å; H358-M462 HydrophobicContact CB-CE 4.15Å; H358-M462 HydrophobicContact CB-SD 4.23Å; H358-I465 HydrophobicContact CB-CD1 3.67Å; H358-I465 HydrophobicContact CB-CG2 4.3Å; H358-E469 IonicContact ND1-OE1 3.42Å |
| 359 | E | 86.4 | Confident | 85.8 | Confident | 0 Ų | 0 | 26.2 Ų | 26.2 | 0% | 0 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -68.6 | -40.6 | -176.9 | -173 | 66 | 176.8 | 0 | 0 | 112.8 | P149 N330 V355 H362 E363 | P149-E359 HydrophobicContact CG-CG 3.97Å; N330-E359 PolarHBondContact ND2-OE1 2.94Å; N330-E359 PolarHBondContact OD1-OE1 3.44Å; N330-E359 VanDerWaalsContact OD1-OE1 3.1Å; V355-E359 VanDerWaalsContact O-CB 3.22Å; V355-E359 WeakPolarHBondContact O-CB 3.21Å; V355-E359 PolarHBondContact O-N 2.92Å; E359-H362 PolarHBondContact O-N 2.87Å; E359-H362 VanDerWaalsContact O-N 3.17Å; E359-E363 HydrophobicContact CG-CG 4.14Å; E359-E363 WeakPolarHBondContact O-CB 3.2Å; E359-E363 WeakPolarHBondContact O-CG 3.48Å; E359-E363 PolarHBondContact O-N 3.48Å |
| 360 | V | 83.7 | Confident | 85.6 | Confident | 37 Ų | 37 | 22.7 Ų | 22.7 | 22% | 0.224 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -57.1 | -49.6 | 178.5 | 166.5 | 0 | 0 | 0 | 0 | 111.9 | P149 V152 L356 V364 | P149-V360 HydrophobicContact CG-CG2 4.16Å; V152-V360 HydrophobicContact CB-CG1 4.36Å; V152-V360 HydrophobicContact CG1-CG1 4.22Å; V152-V360 HydrophobicContact CG2-CG1 3.91Å; L356-V360 HydrophobicContact CD1-CG2 4.31Å; L356-V360 WeakPolarHBondContact O-CG2 3.39Å; L356-V360 PolarHBondContact O-N 3.21Å; V360-V364 VanDerWaalsContact O-CG2 3.25Å; V360-V364 WeakPolarHBondContact O-CG2 3.03Å; V360-V364 PolarHBondContact O-N 3.4Å |
| 361 | P | 79.1 | Confident | 85.6 | Confident | 22 Ų | 22 | 19 Ų | 19 | 14% | 0.143 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -56.6 | -46.5 | 170.2 | -27.7 | 32.4 | 0 | 0 | 0 | 115.1 | F175 L357 H358 V364 G365 M461 | F175-P361 HydrophobicContact CE1-CB 4.03Å; F175-P361 HydrophobicContact CZ-CB 4.43Å; L357-P361 WeakPolarHBondContact O-CD 3.46Å; L357-P361 WeakPolarHBondContact O-CG 2.97Å; H358-P361 VanDerWaalsContact O-CD 3.24Å; H358-P361 WeakPolarHBondContact O-CD 3.49Å; P361-V364 PolarHBondContact O-N 2.95Å; P361-G365 PolarHBondContact O-N 3.18Å; P361-G365 VanDerWaalsContact O-N 3.14Å; P361-M461 HydrophobicContact CB-CE 3.45Å; P361-M461 VanDerWaalsContact CB-CE 3.45Å; P361-M461 HydrophobicContact CB-SD 3.3Å; P361-M461 WeakPolarHBondContact CB-SD 3.49Å; P361-M461 HydrophobicContact CG-CE 3.67Å; P361-M461 HydrophobicContact CG-SD 3.14Å; P361-M461 WeakPolarHBondContact CG-SD 3.27Å |
| 362 | H | 83.7 | Confident | 85.4 | Confident | 6 Ų | 6 | 20.1 Ų | 20.1 | 3% | 0.028 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -60.8 | -48.4 | -179.2 | -79.3 | -64.7 | 0 | 0 | 0 | 110.9 | H358 E359 V364 G365 D366 | H358-H362 PolarHBondContact O-CD2 2.83Å; H358-H362 PolarHBondContact O-N 3.42Å; E359-H362 PolarHBondContact O-N 2.87Å; E359-H362 VanDerWaalsContact O-N 3.17Å; H362-V364 VanDerWaalsContact C-N 3.32Å; H362-V364 PolarHBondContact O-N 3.42Å; H362-G365 WeakPolarHBondContact O-CA 3.29Å; H362-G365 PolarHBondContact O-N 2.88Å; H362-D366 PolarHBondContact O-N 2.92Å |
| 363 | E | 86.8 | Confident | 84.9 | Confident | 2 Ų | 2 | 20.4 Ų | 20.4 | 1% | 0.009 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -63.5 | -33.4 | 179.2 | -79.3 | -82.9 | -145.8 | 0 | 0 | 113.6 | P149 E359 G365 F367 Q384 | P149-E363 HydrophobicContact CB-CB 3.53Å; P149-E363 HydrophobicContact CB-CG 3.67Å; P149-E363 HydrophobicContact CG-CB 4.17Å; P149-E363 HydrophobicContact CG-CG 3.85Å; E359-E363 HydrophobicContact CG-CG 4.14Å; E359-E363 WeakPolarHBondContact O-CB 3.2Å; E359-E363 WeakPolarHBondContact O-CG 3.48Å; E359-E363 PolarHBondContact O-N 3.48Å; E363-G365 VanDerWaalsContact C-N 3.32Å; E363-F367 WeakPolarHBondContact O-CB 3.32Å; E363-F367 PolarHBondContact O-N 3.39Å; E363-Q384 PolarHBondContact O-NE2 2.75Å; E363-Q384 WeakPolarHBondContact OE2-CB 3.45Å; E363-Q384 WeakPolarHBondContact OE2-CG 3.33Å; E363-Q384 PolarHBondContact OE2-NE2 2.91Å |
| 364 | V | 83.6 | Confident | 84.6 | Confident | 17 Ų | 17 | 19.1 Ų | 19.1 | 10% | 0.103 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -66.1 | -37.7 | 171.9 | 170.4 | 0 | 0 | 0 | 0 | 111.4 | V152 L153 I156 L172 V360 P361 H362 A368 | V152-V364 HydrophobicContact CG1-CG2 4.11Å; L153-V364 HydrophobicContact CD2-CG2 4.01Å; I156-V364 HydrophobicContact CD1-CG1 3.94Å; I156-V364 HydrophobicContact CD1-CG2 4.05Å; L172-V364 HydrophobicContact CD2-CG1 3.92Å; V360-V364 VanDerWaalsContact O-CG2 3.25Å; V360-V364 WeakPolarHBondContact O-CG2 3.03Å; V360-V364 PolarHBondContact O-N 3.4Å; P361-V364 PolarHBondContact O-N 2.95Å; H362-V364 VanDerWaalsContact C-N 3.32Å; H362-V364 PolarHBondContact O-N 3.42Å; V364-A368 PolarHBondContact O-N 2.91Å |
| 365 | G | 81.9 | Confident | 84.6 | Confident | 1 Ų | 1 | 19.5 Ų | 19.5 | 1% | 0.01 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -68.6 | -49.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | P361 H362 E363 F367 A368 I369 | P361-G365 PolarHBondContact O-N 3.18Å; P361-G365 VanDerWaalsContact O-N 3.14Å; H362-G365 WeakPolarHBondContact O-CA 3.29Å; H362-G365 PolarHBondContact O-N 2.88Å; E363-G365 VanDerWaalsContact C-N 3.32Å; G365-F367 PolarHBondContact O-N 3.22Å; G365-A368 WeakPolarHBondContact O-CA 3.3Å; G365-A368 WeakPolarHBondContact O-CB 3.41Å; G365-A368 PolarHBondContact O-N 3.27Å; G365-I369 WeakPolarHBondContact O-CG1 3.44Å; G365-I369 PolarHBondContact O-N 3.06Å |
| 366 | D | 86.3 | Confident | 84.5 | Confident | 4 Ų | 4 | 22 Ų | 22 | 2% | 0.021 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -58.2 | -37.6 | 175.8 | -82.4 | 16 | 0 | 0 | 0 | 112.1 | N322 D326 H362 A368 I369 L370 | N322-D366 WeakPolarHBondContact ND2-CB 3.34Å; N322-D366 PolarHBondContact ND2-OD1 2.96Å; N322-D366 PolarHBondContact ND2-OD2 3.07Å; N322-D366 PolarHBondContact OD1-OD1 3.18Å; D326-D366 WeakPolarHBondContact CB-OD2 3.31Å; H362-D366 PolarHBondContact O-N 2.92Å; D366-A368 VanDerWaalsContact C-N 3.33Å; D366-A368 PolarHBondContact O-N 3.07Å; D366-I369 PolarHBondContact O-N 2.88Å; D366-L370 WeakPolarHBondContact O-CB 3.24Å; D366-L370 WeakPolarHBondContact O-CG 3.29Å; D366-L370 PolarHBondContact O-N 3.37Å |
| 367 | F | 87.9 | Confident | 84.3 | Confident | 0 Ų | 0 | 22.8 Ų | 22.8 | 0% | 0 | 14% | 0.143 | C | C | . | . | H | α-helix | trans | -63.4 | -43.6 | 176.1 | 172.8 | -102 | 0 | 0 | 0 | 110.5 | L153 V158 E363 G365 L370 V371 K377 A380 M381 Q384 | L153-F367 HydrophobicContact CD1-CB 4.46Å; L153-F367 HydrophobicContact CD2-CB 3.6Å; L153-F367 HydrophobicContact CD2-CD1 4.06Å; L153-F367 HydrophobicContact CD2-CD2 4.29Å; L153-F367 HydrophobicContact CD2-CG 3.73Å; V158-F367 HydrophobicContact CB-CE1 4.28Å; V158-F367 HydrophobicContact CB-CZ 4.27Å; V158-F367 HydrophobicContact CG2-CE1 3.64Å; V158-F367 HydrophobicContact CG2-CZ 4.11Å; E363-F367 WeakPolarHBondContact O-CB 3.32Å; E363-F367 PolarHBondContact O-N 3.39Å; G365-F367 PolarHBondContact O-N 3.22Å; F367-L370 PolarHBondContact O-N 2.91Å; F367-V371 HydrophobicContact CD1-CG2 4.43Å; F367-V371 HydrophobicContact CD2-CG2 4.25Å; F367-V371 HydrophobicContact CE1-CG2 4.01Å; F367-V371 HydrophobicContact CE2-CG2 3.79Å; F367-V371 HydrophobicContact CZ-CG2 3.66Å; F367-V371 WeakPolarHBondContact O-CB 3.39Å; F367-V371 VanDerWaalsContact O-CG2 3.28Å; F367-V371 WeakPolarHBondContact O-CG2 3.48Å; F367-V371 PolarHBondContact O-N 3.24Å; F367-K377 HydrophobicContact CE2-CB 4.38Å; F367-K377 HydrophobicContact CE2-CG 3.94Å; F367-K377 HydrophobicContact CZ-CB 4.25Å; F367-K377 HydrophobicContact CZ-CD 4.31Å; F367-K377 HydrophobicContact CZ-CG 3.83Å; F367-A380 HydrophobicContact CD2-CB 3.71Å; F367-A380 HydrophobicContact CE2-CB 3.83Å; F367-M381 HydrophobicContact CD2-CG 4.48Å; F367-M381 HydrophobicContact CE2-CG 4.24Å; F367-Q384 VanDerWaalsContact CB-NE2 3.35Å |
| 368 | A | 83.9 | Confident | 84.4 | Confident | 1 Ų | 1 | 26.4 Ų | 26.4 | 1% | 0.008 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -62.4 | -42.7 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.5 | L169 L172 V364 G365 D366 V371 Q372 | L169-A368 HydrophobicContact CD2-CB 4.1Å; L172-A368 HydrophobicContact CB-CB 4.09Å; V364-A368 PolarHBondContact O-N 2.91Å; G365-A368 WeakPolarHBondContact O-CA 3.3Å; G365-A368 WeakPolarHBondContact O-CB 3.41Å; G365-A368 PolarHBondContact O-N 3.27Å; D366-A368 VanDerWaalsContact C-N 3.33Å; D366-A368 PolarHBondContact O-N 3.07Å; A368-V371 PolarHBondContact O-N 3.48Å; A368-Q372 WeakPolarHBondContact O-CB 3.32Å; A368-Q372 PolarHBondContact O-N 2.96Å |
| 369 | I | 84.1 | Confident | 84.5 | Confident | 5 Ų | 5 | 31.2 Ų | 31.2 | 3% | 0.026 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -61.9 | -47.7 | 177 | -66.6 | 168 | 0 | 0 | 0 | 110.7 | L173 N322 G365 D366 V371 Q372 S373 V435 | L173-I369 HydrophobicContact CD1-CD1 4.1Å; L173-I369 HydrophobicContact CD1-CG1 3.31Å; N322-I369 HydrophobicContact CB-CG2 3.9Å; N322-I369 WeakPolarHBondContact OD1-CD1 3.49Å; G365-I369 WeakPolarHBondContact O-CG1 3.44Å; G365-I369 PolarHBondContact O-N 3.06Å; D366-I369 PolarHBondContact O-N 2.88Å; I369-V371 PolarHBondContact O-N 2.86Å; I369-Q372 PolarHBondContact O-N 3.36Å; I369-S373 WeakPolarHBondContact O-CB 3.48Å; I369-S373 PolarHBondContact O-N 2.91Å; I369-V435 HydrophobicContact CD1-CG2 3.7Å; I369-V435 HydrophobicContact CG1-CG2 4.15Å |
| 370 | L | 86.4 | Confident | 84.6 | Confident | 4 Ų | 4 | 31.2 Ų | 31.2 | 2% | 0.021 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -63.7 | -43.3 | 178.9 | -73.1 | 172.3 | 0 | 0 | 0 | 111.9 | D366 F367 Q372 S373 G374 C375 A380 L383 Q384 | D366-L370 WeakPolarHBondContact O-CB 3.24Å; D366-L370 WeakPolarHBondContact O-CG 3.29Å; D366-L370 PolarHBondContact O-N 3.37Å; F367-L370 PolarHBondContact O-N 2.91Å; L370-Q372 VanDerWaalsContact C-N 3.32Å; L370-Q372 PolarHBondContact O-N 2.84Å; L370-S373 WeakPolarHBondContact O-CB 3.47Å; L370-S373 PolarHBondContact O-N 3.08Å; L370-S373 PolarHBondContact O-OG 3.23Å; L370-G374 PolarHBondContact O-N 3.36Å; L370-C375 HydrophobicContact CB-CB 4.46Å; L370-C375 VanDerWaalsContact O-CB 3.23Å; L370-C375 WeakPolarHBondContact O-CB 3.5Å; L370-C375 PolarHBondContact O-N 3.47Å; L370-C375 VanDerWaalsContact O-N 3.09Å; L370-A380 HydrophobicContact CB-CB 3.72Å; L370-A380 HydrophobicContact CD1-CB 4.22Å; L370-L383 HydrophobicContact CD1-CB 4.1Å; L370-L383 HydrophobicContact CD2-CD1 4.08Å; L370-Q384 HydrophobicContact CD1-CG 3.88Å |
| 371 | V | 85.7 | Confident | 84.7 | Confident | 25 Ų | 25 | 31.1 Ų | 31.1 | 15% | 0.152 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -62.4 | -42 | 176.1 | 170.8 | 0 | 0 | 0 | 0 | 110.9 | V158 L169 F367 A368 I369 S373 G374 A380 | V158-V371 HydrophobicContact CG1-CG1 4.16Å; L169-V371 HydrophobicContact CD1-CG1 4.18Å; L169-V371 HydrophobicContact CD2-CG1 4.42Å; F367-V371 HydrophobicContact CD1-CG2 4.43Å; F367-V371 HydrophobicContact CD2-CG2 4.25Å; F367-V371 HydrophobicContact CE1-CG2 4.01Å; F367-V371 HydrophobicContact CE2-CG2 3.79Å; F367-V371 HydrophobicContact CZ-CG2 3.66Å; F367-V371 WeakPolarHBondContact O-CB 3.39Å; F367-V371 VanDerWaalsContact O-CG2 3.28Å; F367-V371 WeakPolarHBondContact O-CG2 3.48Å; F367-V371 PolarHBondContact O-N 3.24Å; A368-V371 PolarHBondContact O-N 3.48Å; I369-V371 PolarHBondContact O-N 2.86Å; V371-S373 VanDerWaalsContact C-N 3.29Å; V371-S373 PolarHBondContact O-N 3.41Å; V371-G374 PolarHBondContact O-N 2.66Å; V371-G374 VanDerWaalsContact O-N 3.08Å; V371-A380 HydrophobicContact CG2-CB 4.07Å |
| 372 | Q | 80.1 | Confident | 85.2 | Confident | 47 Ų | 47 | 39.5 Ų | 39.5 | 22% | 0.22 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -68.1 | -28.7 | 176.7 | -166.7 | 173.8 | 23 | 0 | 0 | 112.9 | A368 I369 L370 G374 E438 | A368-Q372 WeakPolarHBondContact O-CB 3.32Å; A368-Q372 PolarHBondContact O-N 2.96Å; I369-Q372 PolarHBondContact O-N 3.36Å; L370-Q372 VanDerWaalsContact C-N 3.32Å; L370-Q372 PolarHBondContact O-N 2.84Å; Q372-G374 PolarHBondContact O-N 3.39Å; Q372-G374 VanDerWaalsContact O-N 3.17Å; Q372-E438 VanDerWaalsContact NE2-CG 3.29Å |
| 373 | S | 81.4 | Confident | 85.5 | Confident | 11 Ų | 11 | 41.4 Ų | 41.4 | 8% | 0.077 | 21% | 0.214 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -67.9 | -7.3 | 171.9 | 85 | 0 | 0 | 0 | 0 | 113.7 | L315 R316 I369 L370 V371 | L315-S373 WeakPolarHBondContact O-CB 3.42Å; R316-S373 WeakPolarHBondContact CG-O 3.27Å; I369-S373 WeakPolarHBondContact O-CB 3.48Å; I369-S373 PolarHBondContact O-N 2.91Å; L370-S373 WeakPolarHBondContact O-CB 3.47Å; L370-S373 PolarHBondContact O-N 3.08Å; L370-S373 PolarHBondContact O-OG 3.23Å; V371-S373 VanDerWaalsContact C-N 3.29Å; V371-S373 PolarHBondContact O-N 3.41Å |
| 374 | G | 82.1 | Confident | 85.5 | Confident | 63 Ų | 63 | 41.3 Ų | 41.3 | 65% | 0.649 | 21% | 0.213 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 99.8 | 10.3 | 178.6 | 0 | 0 | 0 | 0 | 0 | 114.2 | L370 V371 Q372 | L370-G374 PolarHBondContact O-N 3.36Å; V371-G374 PolarHBondContact O-N 2.66Å; V371-G374 VanDerWaalsContact O-N 3.08Å; Q372-G374 PolarHBondContact O-N 3.39Å; Q372-G374 VanDerWaalsContact O-N 3.17Å |
| 375 | C | 84.7 | Confident | 85.6 | Confident | 26 Ų | 26 | 45.1 Ų | 45.1 | 18% | 0.176 | 23% | 0.233 | C | C | . | . | trans | -72.9 | 140.8 | 170.8 | -63.6 | 0 | 0 | 0 | 0 | 110.8 | L370 Q379 A380 | L370-C375 HydrophobicContact CB-CB 4.46Å; L370-C375 VanDerWaalsContact O-CB 3.23Å; L370-C375 WeakPolarHBondContact O-CB 3.5Å; L370-C375 PolarHBondContact O-N 3.47Å; L370-C375 VanDerWaalsContact O-N 3.09Å; C375-Q379 HydrophobicContact CB-CB 4.08Å; C375-A380 HydrophobicContact CB-CB 4.26Å | ||
| 376 | S | 87.4 | Confident | 86 | Confident | 58 Ų | 58 | 49.8 Ų | 49.8 | 41% | 0.406 | 26% | 0.257 | S | S | . | . | trans | -67.7 | 157.2 | 164.9 | 62.7 | 0 | 0 | 0 | 0 | 110.8 | K378 Q379 A380 | S376-K378 PolarHBondContact O-N 3.06Å; S376-K378 VanDerWaalsContact O-N 3.16Å; S376-Q379 WeakPolarHBondContact O-CA 3.46Å; S376-Q379 WeakPolarHBondContact O-CB 3.47Å; S376-Q379 PolarHBondContact O-N 3.11Å; S376-Q379 WeakPolarHBondContact OG-CB 3.49Å; S376-Q379 VanDerWaalsContact OG-CD 3.23Å; S376-Q379 VanDerWaalsContact OG-CG 3.23Å; S376-Q379 WeakPolarHBondContact OG-CG 3.49Å; S376-Q379 PolarHBondContact OG-N 2.89Å; S376-Q379 PolarHBondContact OG-OE1 3.46Å; S376-A380 PolarHBondContact O-N 2.98Å | ||
| 377 | K | 84.6 | Confident | 86.2 | Confident | 52 Ų | 52 | 49.6 Ų | 49.6 | 23% | 0.226 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -47.4 | -46.9 | 176.4 | 175.3 | 168.8 | -177.5 | 176.6 | 0 | 112.5 | L153 F154 I156 F367 Q379 A380 M381 | L153-K377 WeakPolarHBondContact O-CE 3.33Å; L153-K377 PolarHBondContact O-NZ 2.88Å; F154-K377 PolarHBondContact O-NZ 3.08Å; I156-K377 PolarHBondContact O-NZ 3.44Å; F367-K377 HydrophobicContact CE2-CB 4.38Å; F367-K377 HydrophobicContact CE2-CG 3.94Å; F367-K377 HydrophobicContact CZ-CB 4.25Å; F367-K377 HydrophobicContact CZ-CD 4.31Å; F367-K377 HydrophobicContact CZ-CG 3.83Å; K377-Q379 PolarHBondContact O-N 3.29Å; K377-A380 PolarHBondContact O-N 2.9Å; K377-M381 HydrophobicContact CG-SD 4.05Å; K377-M381 VanDerWaalsContact O-CG 3.26Å; K377-M381 WeakPolarHBondContact O-CG 3.22Å; K377-M381 PolarHBondContact O-N 3.23Å |
| 378 | K | 87.1 | Confident | 86.4 | Confident | 171 Ų | 171 | 50.1 Ų | 50.1 | 74% | 0.743 | 26% | 0.26 | S | S | * | . | H | α-helix | trans | -66.5 | -34.2 | 178.7 | -66.4 | -174.4 | -179.9 | -177.8 | 0 | 113.1 | S376 R382 | S376-K378 PolarHBondContact O-N 3.06Å; S376-K378 VanDerWaalsContact O-N 3.16Å; K378-R382 VanDerWaalsContact O-CG 3.3Å; K378-R382 WeakPolarHBondContact O-CG 3.38Å; K378-R382 PolarHBondContact O-N 3.34Å |
| 379 | Q | 88.1 | Confident | 86.8 | Confident | 104 Ų | 104 | 54.3 Ų | 54.3 | 49% | 0.486 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -71.5 | -45.1 | 176.1 | -76 | 166.3 | -35.3 | 0 | 0 | 111.2 | C375 S376 K377 M381 R382 L383 | C375-Q379 HydrophobicContact CB-CB 4.08Å; S376-Q379 WeakPolarHBondContact O-CA 3.46Å; S376-Q379 WeakPolarHBondContact O-CB 3.47Å; S376-Q379 PolarHBondContact O-N 3.11Å; S376-Q379 WeakPolarHBondContact OG-CB 3.49Å; S376-Q379 VanDerWaalsContact OG-CD 3.23Å; S376-Q379 VanDerWaalsContact OG-CG 3.23Å; S376-Q379 WeakPolarHBondContact OG-CG 3.49Å; S376-Q379 PolarHBondContact OG-N 2.89Å; S376-Q379 PolarHBondContact OG-OE1 3.46Å; K377-Q379 PolarHBondContact O-N 3.29Å; Q379-M381 PolarHBondContact O-N 3.24Å; Q379-R382 PolarHBondContact O-N 2.9Å; Q379-L383 WeakPolarHBondContact O-CG 3.24Å; Q379-L383 PolarHBondContact O-N 3.36Å |
| 380 | A | 87.4 | Confident | 87.1 | Confident | 0 Ų | 0 | 54.3 Ų | 54.3 | 0% | 0 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -57.1 | -50 | 177.4 | 0 | 0 | 0 | 0 | 0 | 110.8 | F367 L370 V371 C375 S376 K377 R382 L383 Q384 | F367-A380 HydrophobicContact CD2-CB 3.71Å; F367-A380 HydrophobicContact CE2-CB 3.83Å; L370-A380 HydrophobicContact CB-CB 3.72Å; L370-A380 HydrophobicContact CD1-CB 4.22Å; V371-A380 HydrophobicContact CG2-CB 4.07Å; C375-A380 HydrophobicContact CB-CB 4.26Å; S376-A380 PolarHBondContact O-N 2.98Å; K377-A380 PolarHBondContact O-N 2.9Å; A380-R382 VanDerWaalsContact C-N 3.34Å; A380-R382 PolarHBondContact O-N 3.47Å; A380-L383 PolarHBondContact O-N 2.93Å; A380-L383 VanDerWaalsContact O-N 3.1Å; A380-Q384 PolarHBondContact O-N 3.11Å |
| 381 | M | 87 | Confident | 87.4 | Confident | 34 Ų | 34 | 54.1 Ų | 54.1 | 17% | 0.167 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -57.9 | -43.5 | 175.5 | -66.9 | 175.1 | 76.4 | 0 | 0 | 112.3 | F150 F367 K377 Q379 L383 Q384 L385 | F150-M381 HydrophobicContact CD1-CB 4.49Å; F150-M381 HydrophobicContact CD1-CE 4.01Å; F150-M381 HydrophobicContact CE1-CB 4.13Å; F150-M381 WeakPolarHBondContact CE1-O 3.35Å; F367-M381 HydrophobicContact CD2-CG 4.48Å; F367-M381 HydrophobicContact CE2-CG 4.24Å; K377-M381 HydrophobicContact CG-SD 4.05Å; K377-M381 VanDerWaalsContact O-CG 3.26Å; K377-M381 WeakPolarHBondContact O-CG 3.22Å; K377-M381 PolarHBondContact O-N 3.23Å; Q379-M381 PolarHBondContact O-N 3.24Å; M381-L383 VanDerWaalsContact C-N 3.3Å; M381-L383 PolarHBondContact O-N 3.22Å; M381-Q384 PolarHBondContact O-N 3.16Å; M381-L385 PolarHBondContact O-N 3.46Å |
| 382 | R | 89.1 | Confident | 87.8 | Confident | 198 Ų | 198 | 56 Ų | 56 | 75% | 0.747 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -65.8 | -32.3 | 178.3 | -78.1 | -177.5 | 65.4 | -168 | -1.4 | 113.5 | K378 Q379 A380 L386 | K378-R382 VanDerWaalsContact O-CG 3.3Å; K378-R382 WeakPolarHBondContact O-CG 3.38Å; K378-R382 PolarHBondContact O-N 3.34Å; Q379-R382 PolarHBondContact O-N 2.9Å; A380-R382 VanDerWaalsContact C-N 3.34Å; A380-R382 PolarHBondContact O-N 3.47Å; R382-L386 PolarHBondContact O-N 3Å |
| 383 | L | 89.1 | Confident | 88.4 | Confident | 46 Ų | 46 | 56 Ų | 56 | 24% | 0.241 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -72.2 | -42.5 | 177.4 | -72.2 | 170.3 | 0 | 0 | 0 | 110.3 | L323 L370 Q379 A380 M381 L385 L386 | L323-L383 HydrophobicContact CD1-CB 4.13Å; L323-L383 WeakPolarHBondContact CD1-O 3.38Å; L323-L383 HydrophobicContact CD2-CB 4.41Å; L323-L383 HydrophobicContact CD2-CD2 4.11Å; L370-L383 HydrophobicContact CD1-CB 4.1Å; L370-L383 HydrophobicContact CD2-CD1 4.08Å; Q379-L383 WeakPolarHBondContact O-CG 3.24Å; Q379-L383 PolarHBondContact O-N 3.36Å; A380-L383 PolarHBondContact O-N 2.93Å; A380-L383 VanDerWaalsContact O-N 3.1Å; M381-L383 VanDerWaalsContact C-N 3.3Å; M381-L383 PolarHBondContact O-N 3.22Å; L383-L385 VanDerWaalsContact C-N 3.29Å; L383-L385 PolarHBondContact O-N 2.7Å; L383-L386 WeakPolarHBondContact O-CA 3.37Å; L383-L386 WeakPolarHBondContact O-CB 3.23Å; L383-L386 PolarHBondContact O-N 3.37Å |
| 384 | Q | 87.9 | Confident | 88.7 | Confident | 0 Ų | 0 | 55.5 Ų | 55.5 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -59.2 | -40 | 172 | -73.2 | 172.8 | -43.9 | 0 | 0 | 112 | F150 E363 F367 L370 A380 M381 L386 T387 | F150-Q384 HydrophobicContact CZ-CB 4.06Å; E363-Q384 PolarHBondContact O-NE2 2.75Å; E363-Q384 WeakPolarHBondContact OE2-CB 3.45Å; E363-Q384 WeakPolarHBondContact OE2-CG 3.33Å; E363-Q384 PolarHBondContact OE2-NE2 2.91Å; F367-Q384 VanDerWaalsContact CB-NE2 3.35Å; L370-Q384 HydrophobicContact CD1-CG 3.88Å; A380-Q384 PolarHBondContact O-N 3.11Å; M381-Q384 PolarHBondContact O-N 3.16Å; Q384-L386 PolarHBondContact O-N 3.07Å; Q384-T387 PolarHBondContact O-N 3.27Å; Q384-T387 PolarHBondContact O-OG1 3.11Å |
| 385 | L | 86.3 | Confident | 89.2 | Confident | 97 Ų | 97 | 52.5 Ų | 52.5 | 51% | 0.508 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -64.6 | -20.8 | 178.5 | -169.2 | 61.4 | 0 | 0 | 0 | 112 | F150 M381 L383 T387 A388 | F150-L385 HydrophobicContact CE1-CB 3.94Å; F150-L385 HydrophobicContact CE1-CD1 4.43Å; F150-L385 HydrophobicContact CE2-CB 4.37Å; F150-L385 HydrophobicContact CE2-CD1 3.85Å; F150-L385 HydrophobicContact CZ-CB 3.51Å; F150-L385 HydrophobicContact CZ-CD1 3.81Å; F150-L385 HydrophobicContact CZ-CG 4.22Å; M381-L385 PolarHBondContact O-N 3.46Å; L383-L385 VanDerWaalsContact C-N 3.29Å; L383-L385 PolarHBondContact O-N 2.7Å; L385-T387 VanDerWaalsContact C-N 3.32Å; L385-A388 VanDerWaalsContact O-CB 3.29Å; L385-A388 WeakPolarHBondContact O-CB 3.34Å |
| 386 | L | 89.8 | Confident | 89.4 | Confident | 99 Ų | 99 | 52.6 Ų | 52.6 | 52% | 0.518 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -71 | -28.1 | 174.4 | -168.4 | 62.8 | 0 | 0 | 0 | 111.8 | R382 L383 Q384 A388 V389 | R382-L386 PolarHBondContact O-N 3Å; L383-L386 WeakPolarHBondContact O-CA 3.37Å; L383-L386 WeakPolarHBondContact O-CB 3.23Å; L383-L386 PolarHBondContact O-N 3.37Å; Q384-L386 PolarHBondContact O-N 3.07Å; L386-A388 VanDerWaalsContact C-N 3.26Å; L386-A388 PolarHBondContact O-N 3.34Å; L386-V389 HydrophobicContact CD1-CG2 4.4Å; L386-V389 VanDerWaalsContact O-CB 3.31Å; L386-V389 WeakPolarHBondContact O-CB 3.29Å; L386-V389 WeakPolarHBondContact O-CG2 2.9Å; L386-V389 PolarHBondContact O-N 3.4Å |
| 387 | T | 90 | Very high | 89.4 | Confident | 1 Ų | 1 | 51.8 Ų | 51.8 | 1% | 0.006 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -73.7 | -20.5 | 179.5 | 67.6 | 0 | 0 | 0 | 0 | 112.4 | L323 D326 L327 N330 Q384 L385 V389 G390 A391 | L323-T387 HydrophobicContact CD1-CG2 3.31Å; L323-T387 HydrophobicContact CG-CG2 4.04Å; D326-T387 HydrophobicContact CB-CG2 4.15Å; D326-T387 VanDerWaalsContact OD2-CB 3.24Å; D326-T387 WeakPolarHBondContact OD2-CB 3.41Å; D326-T387 WeakPolarHBondContact OD2-CG2 3.49Å; D326-T387 PolarHBondContact OD2-OG1 3.04Å; L327-T387 HydrophobicContact CB-CG2 4.27Å; N330-T387 PolarHBondContact ND2-OG1 3.39Å; N330-T387 VanDerWaalsContact ND2-OG1 3.12Å; Q384-T387 PolarHBondContact O-N 3.27Å; Q384-T387 PolarHBondContact O-OG1 3.11Å; L385-T387 VanDerWaalsContact C-N 3.32Å; T387-V389 PolarHBondContact O-N 3.49Å; T387-V389 VanDerWaalsContact O-N 3.09Å; T387-G390 WeakPolarHBondContact O-CA 3.36Å; T387-G390 PolarHBondContact O-N 3.01Å; T387-A391 PolarHBondContact O-N 2.85Å |
| 388 | A | 91.1 | Very high | 89.3 | Confident | 11 Ų | 11 | 49.3 Ų | 49.3 | 9% | 0.091 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -54.4 | -26.8 | 166.8 | 0 | 0 | 0 | 0 | 0 | 113.5 | L385 L386 G390 A391 L392 | L385-A388 VanDerWaalsContact O-CB 3.29Å; L385-A388 WeakPolarHBondContact O-CB 3.34Å; L386-A388 VanDerWaalsContact C-N 3.26Å; L386-A388 PolarHBondContact O-N 3.34Å; A388-G390 VanDerWaalsContact C-N 3.27Å; A388-G390 PolarHBondContact O-N 3.08Å; A388-A391 PolarHBondContact O-N 3.14Å; A388-L392 WeakPolarHBondContact O-CG 3.17Å; A388-L392 PolarHBondContact O-N 3.09Å |
| 389 | V | 92.8 | Very high | 89.3 | Confident | 88 Ų | 88 | 41.3 Ų | 41.3 | 53% | 0.533 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -63.9 | -36.1 | 173.5 | 178.8 | 0 | 0 | 0 | 0 | 110.9 | L386 T387 A393 | L386-V389 HydrophobicContact CD1-CG2 4.4Å; L386-V389 VanDerWaalsContact O-CB 3.31Å; L386-V389 WeakPolarHBondContact O-CB 3.29Å; L386-V389 WeakPolarHBondContact O-CG2 2.9Å; L386-V389 PolarHBondContact O-N 3.4Å; T387-V389 PolarHBondContact O-N 3.49Å; T387-V389 VanDerWaalsContact O-N 3.09Å; V389-A393 VanDerWaalsContact O-CB 3.24Å; V389-A393 WeakPolarHBondContact O-CB 3.5Å; V389-A393 PolarHBondContact O-N 2.85Å |
| 390 | G | 91.1 | Very high | 89.1 | Confident | 6 Ų | 6 | 42 Ų | 42 | 6% | 0.062 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -58.7 | -53.3 | 172.8 | 0 | 0 | 0 | 0 | 0 | 110.8 | F331 T387 A388 L392 A393 G394 | F331-G390 WeakPolarHBondContact CA-O 3.39Å; F331-G390 WeakPolarHBondContact CD2-O 3.5Å; T387-G390 WeakPolarHBondContact O-CA 3.36Å; T387-G390 PolarHBondContact O-N 3.01Å; A388-G390 VanDerWaalsContact C-N 3.27Å; A388-G390 PolarHBondContact O-N 3.08Å; G390-L392 PolarHBondContact O-N 3.34Å; G390-A393 WeakPolarHBondContact O-CB 3.49Å; G390-A393 PolarHBondContact O-N 3.43Å; G390-G394 PolarHBondContact O-N 3.43Å |
| 391 | A | 92.8 | Very high | 88.6 | Confident | 0 Ų | 0 | 43.8 Ų | 43.8 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -58.8 | -47.7 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | T142 N330 G334 T387 A388 A393 G394 T395 | T142-A391 VanDerWaalsContact CG2-C 3.48Å; T142-A391 HydrophobicContact CG2-CB 3.53Å; N330-A391 HydrophobicContact CB-CB 4.12Å; N330-A391 WeakPolarHBondContact O-CA 3.48Å; N330-A391 VanDerWaalsContact O-CB 3.29Å; N330-A391 WeakPolarHBondContact O-CB 3.5Å; N330-A391 PolarHBondContact O-N 3.43Å; G334-A391 WeakPolarHBondContact CA-O 3.39Å; T387-A391 PolarHBondContact O-N 2.85Å; A388-A391 PolarHBondContact O-N 3.14Å; A391-A393 VanDerWaalsContact C-N 3.3Å; A391-A393 PolarHBondContact O-N 2.87Å; A391-G394 PolarHBondContact O-N 3.38Å; A391-T395 PolarHBondContact O-N 3.25Å; A391-T395 PolarHBondContact O-OG1 3.33Å; A391-T395 VanDerWaalsContact O-OG1 3.14Å |
| 392 | L | 94.7 | Very high | 87 | Confident | 64 Ų | 64 | 51 Ų | 51 | 34% | 0.335 | 27% | 0.27 | S | S | . | . | H | α-helix | trans | -61.8 | -39.2 | 177.1 | -69.3 | 171.2 | 0 | 0 | 0 | 112.3 | L139 T142 V143 A388 G390 A396 | L139-L392 HydrophobicContact CD2-CD2 4.09Å; T142-L392 HydrophobicContact CG2-CD2 3.88Å; T142-L392 HydrophobicContact CG2-CG 4.26Å; V143-L392 HydrophobicContact CG2-CD2 4.03Å; A388-L392 WeakPolarHBondContact O-CG 3.17Å; A388-L392 PolarHBondContact O-N 3.09Å; G390-L392 PolarHBondContact O-N 3.34Å; L392-A396 VanDerWaalsContact O-CB 3.32Å; L392-A396 WeakPolarHBondContact O-CB 3.23Å; L392-A396 PolarHBondContact O-N 3.06Å |
| 393 | A | 91.3 | Very high | 85.3 | Confident | 48 Ų | 48 | 45.3 Ų | 45.3 | 40% | 0.397 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -65.6 | -40.2 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.9 | F331 V389 G390 A391 C397 | F331-A393 HydrophobicContact CD2-CB 4.23Å; F331-A393 HydrophobicContact CE2-CB 4.43Å; V389-A393 VanDerWaalsContact O-CB 3.24Å; V389-A393 WeakPolarHBondContact O-CB 3.5Å; V389-A393 PolarHBondContact O-N 2.85Å; G390-A393 WeakPolarHBondContact O-CB 3.49Å; G390-A393 PolarHBondContact O-N 3.43Å; A391-A393 VanDerWaalsContact C-N 3.3Å; A391-A393 PolarHBondContact O-N 2.87Å; A393-C397 VanDerWaalsContact O-CB 3.3Å; A393-C397 WeakPolarHBondContact O-CB 3.47Å; A393-C397 PolarHBondContact O-N 3.28Å |
| 394 | G | 88.5 | Confident | 83.5 | Confident | 0 Ų | 0 | 43.5 Ų | 43.5 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -61.1 | -50.7 | 174.7 | 0 | 0 | 0 | 0 | 0 | 111.8 | F331 G334 L335 G390 A391 A396 C397 A398 | F331-G394 VanDerWaalsContact CD2-CA 3.46Å; F331-G394 VanDerWaalsContact CE2-CA 3.48Å; F331-G394 WeakPolarHBondContact O-CA 3.33Å; G334-G394 VanDerWaalsContact C-C 3.5Å; L335-G394 VanDerWaalsContact CD2-O 3.29Å; L335-G394 WeakPolarHBondContact CD2-O 3.43Å; G390-G394 PolarHBondContact O-N 3.43Å; A391-G394 PolarHBondContact O-N 3.38Å; G394-A396 PolarHBondContact O-N 2.79Å; G394-C397 WeakPolarHBondContact O-CB 3.42Å; G394-C397 PolarHBondContact O-N 3.44Å; G394-C397 VanDerWaalsContact O-N 3.11Å; G394-A398 PolarHBondContact O-N 3.1Å |
| 395 | T | 91.5 | Very high | 81.5 | Confident | 0 Ų | 0 | 45.2 Ų | 45.2 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -60.5 | -45.4 | 177.8 | -55.9 | 0 | 0 | 0 | 0 | 111.9 | A138 L139 T142 G334 A391 C397 A398 L399 | A138-T395 HydrophobicContact CB-CG2 3.84Å; L139-T395 HydrophobicContact CD2-CG2 4.1Å; T142-T395 WeakPolarHBondContact CG2-OG1 3.35Å; T142-T395 PolarHBondContact OG1-OG1 2.86Å; G334-T395 VanDerWaalsContact C-N 3.27Å; G334-T395 WeakPolarHBondContact CA-OG1 3.35Å; G334-T395 WeakPolarHBondContact O-CA 3.28Å; G334-T395 WeakPolarHBondContact O-CB 3.36Å; G334-T395 PolarHBondContact O-N 3.49Å; G334-T395 PolarHBondContact O-OG1 3.01Å; A391-T395 PolarHBondContact O-N 3.25Å; A391-T395 PolarHBondContact O-OG1 3.33Å; A391-T395 VanDerWaalsContact O-OG1 3.14Å; T395-C397 VanDerWaalsContact C-N 3.3Å; T395-C397 PolarHBondContact O-N 3.01Å; T395-A398 PolarHBondContact O-N 3.28Å; T395-L399 HydrophobicContact CG2-CD1 3.98Å; T395-L399 HydrophobicContact CG2-CG 4.46Å; T395-L399 VanDerWaalsContact O-CG 3.27Å; T395-L399 WeakPolarHBondContact O-CG 3.37Å; T395-L399 PolarHBondContact O-N 2.9Å |
| 396 | A | 90.8 | Very high | 79.7 | Confident | 27 Ų | 27 | 42.8 Ų | 42.8 | 22% | 0.223 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -60.2 | -41.2 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | L392 G394 L399 L400 | L392-A396 VanDerWaalsContact O-CB 3.32Å; L392-A396 WeakPolarHBondContact O-CB 3.23Å; L392-A396 PolarHBondContact O-N 3.06Å; G394-A396 PolarHBondContact O-N 2.79Å; A396-L399 PolarHBondContact O-N 2.89Å; A396-L400 WeakPolarHBondContact O-CB 3.35Å; A396-L400 WeakPolarHBondContact O-CG 3.14Å; A396-L400 PolarHBondContact O-N 2.91Å |
| 397 | C | 86.8 | Confident | 77.7 | Confident | 41 Ų | 41 | 38 Ų | 38 | 28% | 0.277 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -62 | -44.5 | 177.2 | -172.3 | 0 | 0 | 0 | 0 | 112.3 | L335 A393 G394 T395 L399 L400 T401 | L335-C397 HydrophobicContact CD2-CB 3.92Å; A393-C397 VanDerWaalsContact O-CB 3.3Å; A393-C397 WeakPolarHBondContact O-CB 3.47Å; A393-C397 PolarHBondContact O-N 3.28Å; G394-C397 WeakPolarHBondContact O-CB 3.42Å; G394-C397 PolarHBondContact O-N 3.44Å; G394-C397 VanDerWaalsContact O-N 3.11Å; T395-C397 VanDerWaalsContact C-N 3.3Å; T395-C397 PolarHBondContact O-N 3.01Å; C397-L399 VanDerWaalsContact C-N 3.31Å; C397-L399 PolarHBondContact O-N 3.36Å; C397-L400 PolarHBondContact O-N 3.2Å; C397-T401 WeakPolarHBondContact O-CG2 3.45Å; C397-T401 PolarHBondContact O-N 3.36Å; C397-T401 PolarHBondContact O-OG1 2.99Å |
| 398 | A | 82.9 | Confident | 75.7 | Confident | 0 Ų | 0 | 41 Ų | 41 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -64.6 | -33.4 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113 | L335 R342 G394 T395 T401 | L335-A398 HydrophobicContact CD2-CB 4.04Å; L335-A398 WeakPolarHBondContact O-CB 3.27Å; R342-A398 PolarHBondContact NH1-O 2.9Å; G394-A398 PolarHBondContact O-N 3.1Å; T395-A398 PolarHBondContact O-N 3.28Å; A398-T401 PolarHBondContact O-OG1 3.39Å |
| 399 | L | 85.5 | Confident | 73.6 | Confident | 3 Ų | 3 | 43.4 Ų | 43.4 | 2% | 0.016 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -81.4 | -32.6 | 179.2 | -66.2 | 173.4 | 0 | 0 | 0 | 113.7 | L134 W135 A138 R342 T395 A396 C397 | L134-L399 HydrophobicContact CD1-CD2 4.49Å; L134-L399 HydrophobicContact CD2-CD2 4.06Å; L134-L399 HydrophobicContact CG-CD2 4.04Å; W135-L399 HydrophobicContact CB-CD1 4.47Å; W135-L399 HydrophobicContact CD2-CB 4.23Å; W135-L399 HydrophobicContact CD2-CD1 3.7Å; W135-L399 HydrophobicContact CE3-CD1 3.96Å; W135-L399 HydrophobicContact CG-CD1 3.93Å; W135-L399 HydrophobicContact CH2-CB 4.17Å; W135-L399 HydrophobicContact CZ2-CB 3.61Å; W135-L399 HydrophobicContact CZ3-CD1 4.46Å; A138-L399 HydrophobicContact CB-CD1 3.9Å; A138-L399 HydrophobicContact CB-CD2 4.27Å; R342-L399 HydrophobicContact CG-CD2 4.04Å; R342-L399 PolarHBondContact NH1-O 3Å; R342-L399 VanDerWaalsContact NH1-O 3.1Å; R342-L399 PolarHBondContact NH2-O 3.21Å; T395-L399 HydrophobicContact CG2-CD1 3.98Å; T395-L399 HydrophobicContact CG2-CG 4.46Å; T395-L399 VanDerWaalsContact O-CG 3.27Å; T395-L399 WeakPolarHBondContact O-CG 3.37Å; T395-L399 PolarHBondContact O-N 2.9Å; A396-L399 PolarHBondContact O-N 2.89Å; C397-L399 VanDerWaalsContact C-N 3.31Å; C397-L399 PolarHBondContact O-N 3.36Å |
| 400 | L | 85.3 | Confident | 71.5 | Confident | 120 Ų | 120 | 40 Ų | 40 | 63% | 0.628 | 25% | 0.253 | S | S | * | . | H | α-helix | trans | -76.4 | -23.6 | -178.2 | -75.2 | 170.5 | 0 | 0 | 0 | 113.9 | W135 A396 C397 E402 | W135-L400 HydrophobicContact CH2-CD2 3.62Å; W135-L400 HydrophobicContact CH2-CG 3.72Å; W135-L400 HydrophobicContact CZ2-CD2 3.77Å; W135-L400 HydrophobicContact CZ2-CG 4.02Å; A396-L400 WeakPolarHBondContact O-CB 3.35Å; A396-L400 WeakPolarHBondContact O-CG 3.14Å; A396-L400 PolarHBondContact O-N 2.91Å; C397-L400 PolarHBondContact O-N 3.2Å; L400-E402 PolarHBondContact O-N 2.92Å |
| 401 | T | 75.7 | Confident | 69.4 | Low | 36 Ų | 36 | 41.4 Ų | 41.4 | 22% | 0.221 | 27% | 0.265 | C | S | . | . | S | Bend | trans | -82 | 100.2 | -175.6 | 43.6 | 0 | 0 | 0 | 0 | 110 | R342 C397 A398 G403 G404 V406 | R342-T401 PolarHBondContact NH1-O 2.99Å; C397-T401 WeakPolarHBondContact O-CG2 3.45Å; C397-T401 PolarHBondContact O-N 3.36Å; C397-T401 PolarHBondContact O-OG1 2.99Å; A398-T401 PolarHBondContact O-OG1 3.39Å; T401-G403 PolarHBondContact O-N 2.91Å; T401-G404 PolarHBondContact O-N 3.49Å; T401-V406 HydrophobicContact CG2-CB 3.94Å; T401-V406 HydrophobicContact CG2-CG2 3.65Å |
| 402 | E | 53.3 | Low | 67.1 | Low | 186 Ų | 186 | 42.1 Ų | 42.1 | 87% | 0.869 | 27% | 0.272 | S | S | * | . | G | 310 helix | trans | -50.5 | 129.7 | 176.4 | -74.7 | -175.2 | 171 | 0 | 0 | 110.8 | L400 | L400-E402 PolarHBondContact O-N 2.92Š|
| 403 | G | 54.7 | Low | 64.7 | Low | 78 Ų | 78 | 41.5 Ų | 41.5 | 80% | 0.804 | 28% | 0.281 | S | S | * | . | G | 310 helix | trans | 84.7 | 1.6 | -174.4 | 0 | 0 | 0 | 0 | 0 | 115.3 | T401 A405 | T401-G403 PolarHBondContact O-N 2.91Å; G403-A405 PolarHBondContact O-N 3.36Å |
| 404 | G | 50.1 | Low | 62.3 | Low | 9 Ų | 9 | 43 Ų | 43 | 9% | 0.093 | 29% | 0.293 | C | S | . | . | G | 310 helix | trans | 64.5 | 9.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | T401 V406 G407 S408 | T401-G404 PolarHBondContact O-N 3.49Å; G404-V406 VanDerWaalsContact C-N 3.29Å; G404-V406 PolarHBondContact O-N 2.64Å; G404-V406 VanDerWaalsContact O-N 3.13Å; G404-G407 CarbonylContact O-C 3.22Å; G404-G407 PolarHBondContact O-N 2.91Å; G404-S408 WeakPolarHBondContact O-CA 3.3Å; G404-S408 WeakPolarHBondContact O-CB 3.27Å; G404-S408 PolarHBondContact O-N 3.03Å |
| 405 | A | 46.6 | Very low | 60.3 | Low | 36 Ų | 36 | 43.9 Ų | 43.9 | 30% | 0.298 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -51.2 | -44.1 | -172.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | G403 G407 E409 | G403-A405 PolarHBondContact O-N 3.36Å; A405-G407 PolarHBondContact O-N 3.5Å; A405-E409 HydrophobicContact CB-CG 4.36Å; A405-E409 WeakPolarHBondContact CB-OE1 3.35Å; A405-E409 VanDerWaalsContact O-CA 3.3Å; A405-E409 WeakPolarHBondContact O-CA 3.41Å; A405-E409 WeakPolarHBondContact O-CB 3.31Å; A405-E409 WeakPolarHBondContact O-CG 3.36Å; A405-E409 PolarHBondContact O-N 3.29Å |
| 406 | V | 49 | Very low | 58.2 | Low | 45 Ų | 45 | 46.5 Ų | 46.5 | 27% | 0.273 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -72.6 | -34.2 | 177.9 | -178.6 | 0 | 0 | 0 | 0 | 112.8 | L335 T401 G404 V410 | L335-V406 HydrophobicContact CD2-CG1 4.28Å; T401-V406 HydrophobicContact CG2-CB 3.94Å; T401-V406 HydrophobicContact CG2-CG2 3.65Å; G404-V406 VanDerWaalsContact C-N 3.29Å; G404-V406 PolarHBondContact O-N 2.64Å; G404-V406 VanDerWaalsContact O-N 3.13Å; V406-V410 HydrophobicContact CG1-CG2 4.35Å; V406-V410 WeakPolarHBondContact O-CB 3.49Å; V406-V410 WeakPolarHBondContact O-CG2 3.26Å; V406-V410 PolarHBondContact O-N 3.03Å; V406-V410 VanDerWaalsContact O-N 3.13Å |
| 407 | G | 47.8 | Very low | 56.8 | Low | 0 Ų | 0 | 47.2 Ų | 47.2 | 0% | 0 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -81.1 | -45.2 | -179.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | A339 G404 A405 A411 | A339-G407 VanDerWaalsContact CB-C 3.48Å; A339-G407 WeakPolarHBondContact CB-O 3.4Å; G404-G407 CarbonylContact O-C 3.22Å; G404-G407 PolarHBondContact O-N 2.91Å; A405-G407 PolarHBondContact O-N 3.5Å; G407-A411 WeakPolarHBondContact O-CA 3.24Å; G407-A411 WeakPolarHBondContact O-CB 3.3Å; G407-A411 PolarHBondContact O-N 3.1Å |
| 408 | S | 46.8 | Very low | 56.1 | Low | 62 Ų | 62 | 50.2 Ų | 50.2 | 43% | 0.434 | 34% | 0.335 | S | S | . | . | H | α-helix | trans | -77.7 | -17.6 | 175.4 | -172.1 | 0 | 0 | 0 | 0 | 113.2 | G404 G412 | G404-S408 WeakPolarHBondContact O-CA 3.3Å; G404-S408 WeakPolarHBondContact O-CB 3.27Å; G404-S408 PolarHBondContact O-N 3.03Å; S408-G412 CarbonylContact O-C 3.57Å; S408-G412 WeakPolarHBondContact O-CA 3.31Å; S408-G412 PolarHBondContact O-N 2.96Å; S408-G412 VanDerWaalsContact O-O 3.12Å |
| 409 | E | 48.3 | Very low | 55.7 | Low | 63 Ų | 63 | 50.8 Ų | 50.8 | 29% | 0.294 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -94.8 | -25.4 | 170.5 | -56.4 | 179 | -174.7 | 0 | 0 | 112.3 | A405 G412 G413 A414 G415 | A405-E409 HydrophobicContact CB-CG 4.36Å; A405-E409 WeakPolarHBondContact CB-OE1 3.35Å; A405-E409 VanDerWaalsContact O-CA 3.3Å; A405-E409 WeakPolarHBondContact O-CA 3.41Å; A405-E409 WeakPolarHBondContact O-CB 3.31Å; A405-E409 WeakPolarHBondContact O-CG 3.36Å; A405-E409 PolarHBondContact O-N 3.29Å; E409-G412 CarbonylContact O-C 3.42Å; E409-G413 PolarHBondContact O-N 3.4Å; E409-A414 HydrophobicContact CB-CB 4.38Å; E409-A414 HydrophobicContact CG-CB 3.9Å; E409-A414 VanDerWaalsContact OE2-C 3.29Å; E409-G415 CarbonylContact C-O 3Å; E409-G415 VanDerWaalsContact CB-O 3.24Å; E409-G415 WeakPolarHBondContact CB-O 3.08Å; E409-G415 VanDerWaalsContact OE2-CA 3.27Å; E409-G415 WeakPolarHBondContact OE2-CA 3.2Å; E409-G415 PolarHBondContact OE2-N 3.42Å |
| 410 | V | 48.1 | Very low | 55.4 | Low | 15 Ų | 15 | 51.7 Ų | 51.7 | 9% | 0.091 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -75.1 | -35.2 | 165.8 | 173 | 0 | 0 | 0 | 0 | 111.4 | L335 V406 G415 | L335-V410 HydrophobicContact CD1-CG1 4.09Å; L335-V410 HydrophobicContact CD1-CG2 4.41Å; V406-V410 HydrophobicContact CG1-CG2 4.35Å; V406-V410 WeakPolarHBondContact O-CB 3.49Å; V406-V410 WeakPolarHBondContact O-CG2 3.26Å; V406-V410 PolarHBondContact O-N 3.03Å; V406-V410 VanDerWaalsContact O-N 3.13Å; V410-G415 PolarHBondContact N-O 3.3Å |
| 411 | A | 46.5 | Very low | 55.4 | Low | 37 Ų | 37 | 46 Ų | 46 | 31% | 0.306 | 31% | 0.314 | S | S | . | . | S | Bend | trans | -90.4 | -3.1 | 170.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | G407 | G407-A411 WeakPolarHBondContact O-CA 3.24Å; G407-A411 WeakPolarHBondContact O-CB 3.3Å; G407-A411 PolarHBondContact O-N 3.1Å |
| 412 | G | 44 | Very low | 55.9 | Low | 14 Ų | 14 | 46.4 Ų | 46.4 | 14% | 0.144 | 31% | 0.313 | C | S | . | . | S | Bend | trans | -159.4 | 60.1 | -172.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | S408 E409 A414 | S408-G412 CarbonylContact O-C 3.57Å; S408-G412 WeakPolarHBondContact O-CA 3.31Å; S408-G412 PolarHBondContact O-N 2.96Å; S408-G412 VanDerWaalsContact O-O 3.12Å; E409-G412 CarbonylContact O-C 3.42Å; G412-A414 VanDerWaalsContact C-N 3.34Å; G412-A414 PolarHBondContact O-N 2.96Å |
| 413 | G | 44.5 | Very low | 57.3 | Low | 52 Ų | 52 | 37.8 Ų | 37.8 | 54% | 0.536 | 27% | 0.272 | S | S | . | . | S | Bend | trans | 65.7 | -14.6 | 147.9 | 0 | 0 | 0 | 0 | 0 | 122 | E409 | E409-G413 PolarHBondContact O-N 3.4Š|
| 414 | A | 42.4 | Very low | 59 | Low | 78 Ų | 78 | 34 Ų | 34 | 65% | 0.645 | 23% | 0.234 | S | C | * | . | S | Bend | trans | -102.4 | 4 | -170.5 | 0 | 0 | 0 | 0 | 0 | 117.4 | E409 G412 | E409-A414 HydrophobicContact CB-CB 4.38Å; E409-A414 HydrophobicContact CG-CB 3.9Å; E409-A414 VanDerWaalsContact OE2-C 3.29Å; G412-A414 VanDerWaalsContact C-N 3.34Å; G412-A414 PolarHBondContact O-N 2.96Å |
| 415 | G | 44.8 | Very low | 60.9 | Low | 20 Ų | 20 | 33.6 Ų | 33.6 | 21% | 0.206 | 23% | 0.23 | C | C | . | . | S | Bend | trans | 161.8 | 167.9 | -177.3 | 0 | 0 | 0 | 0 | 0 | 113.4 | E409 V410 G417 | E409-G415 CarbonylContact C-O 3Å; E409-G415 VanDerWaalsContact CB-O 3.24Å; E409-G415 WeakPolarHBondContact CB-O 3.08Å; E409-G415 VanDerWaalsContact OE2-CA 3.27Å; E409-G415 WeakPolarHBondContact OE2-CA 3.2Å; E409-G415 PolarHBondContact OE2-N 3.42Å; V410-G415 PolarHBondContact N-O 3.3Å; G415-G417 VanDerWaalsContact C-N 3.3Å; G415-G417 PolarHBondContact O-N 3.4Å |
| 416 | P | 48.5 | Very low | 62.8 | Low | 54 Ų | 54 | 31.9 Ų | 31.9 | 35% | 0.351 | 22% | 0.216 | S | C | . | . | -53.4 | 90 | -87.4 | 14.8 | 8.3 | 0 | 0 | 0 | 112.2 | W418 | P416-W418 HydrophobicContact CB-CG 4.24Å; P416-W418 PolarHBondContact O-N 3.11Å | |||
| 417 | G | 62.2 | Low | 64.8 | Low | 43 Ų | 43 | 30 Ų | 30 | 44% | 0.443 | 20% | 0.204 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -66.6 | 24.7 | 175 | 0 | 0 | 0 | 0 | 0 | 115.1 | G415 P421 | G415-G417 VanDerWaalsContact C-N 3.3Å; G415-G417 PolarHBondContact O-N 3.4Å; G417-P421 WeakPolarHBondContact O-CD 3.49Å; G417-P421 WeakPolarHBondContact O-CG 3.33Å |
| 418 | W | 72.1 | Confident | 67 | Low | 103 Ų | 103 | 31 Ų | 31 | 39% | 0.39 | 21% | 0.209 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -91.6 | -25.5 | 177.9 | 64.5 | -104.8 | 0 | 0 | 0 | 113.3 | W222 P416 P421 F422 | W222-W418 HydrophobicContact CB-CB 4.34Å; W222-W418 HydrophobicContact CD2-CB 3.23Å; W222-W418 HydrophobicContact CD2-CG 4.25Å; W222-W418 HydrophobicContact CE3-CB 3.67Å; W222-W418 HydrophobicContact CE3-CG 4.33Å; W222-W418 HydrophobicContact CG-CB 3.51Å; W222-W418 HydrophobicContact CH2-CB 4.04Å; W222-W418 HydrophobicContact CH2-CG 4.1Å; W222-W418 HydrophobicContact CZ2-CB 3.65Å; W222-W418 HydrophobicContact CZ2-CG 4.01Å; W222-W418 HydrophobicContact CZ3-CB 4.05Å; W222-W418 HydrophobicContact CZ3-CD2 4.4Å; W222-W418 HydrophobicContact CZ3-CE3 4.45Å; W222-W418 HydrophobicContact CZ3-CG 4.25Å; P416-W418 HydrophobicContact CB-CG 4.24Å; P416-W418 PolarHBondContact O-N 3.11Å; W418-P421 WeakPolarHBondContact O-CD 3.45Å; W418-P421 WeakPolarHBondContact O-CG 3.42Å; W418-F422 HydrophobicContact CE3-CB 4.06Å; W418-F422 HydrophobicContact CE3-CG 4.34Å; W418-F422 HydrophobicContact CZ3-CD1 4.5Å; W418-F422 HydrophobicContact CZ3-CG 4.44Å; W418-F422 WeakPolarHBondContact O-CB 3.37Å; W418-F422 PolarHBondContact O-N 2.91Å |
| 419 | V | 72.9 | Confident | 69.1 | Low | 13 Ų | 13 | 28.5 Ų | 28.5 | 8% | 0.079 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -65.8 | -51.7 | -171.5 | -169.9 | 0 | 0 | 0 | 0 | 110.8 | F331 T332 F422 T423 | F331-V419 HydrophobicContact CD1-CG1 4.4Å; T332-V419 HydrophobicContact CG2-CB 4.13Å; T332-V419 HydrophobicContact CG2-CG1 3.31Å; V419-F422 PolarHBondContact O-N 3.15Å; V419-T423 WeakPolarHBondContact O-CB 3.49Å; V419-T423 PolarHBondContact O-N 3.08Å; V419-T423 PolarHBondContact O-OG1 3.29Å |
| 420 | L | 79.6 | Confident | 71 | Confident | 21 Ų | 21 | 25.5 Ų | 25.5 | 11% | 0.11 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -55.7 | -54.5 | 177 | -63.7 | 174.2 | 0 | 0 | 0 | 112.8 | L188 H191 A192 T332 F422 T423 A424 | L188-L420 HydrophobicContact CD2-CD2 3.79Å; H191-L420 HydrophobicContact CB-CD1 4.43Å; A192-L420 HydrophobicContact CB-CB 4.33Å; T332-L420 HydrophobicContact CG2-CD2 4Å; L420-F422 VanDerWaalsContact C-N 3.33Å; L420-F422 PolarHBondContact O-N 3.24Å; L420-T423 PolarHBondContact O-N 3.04Å; L420-A424 WeakPolarHBondContact O-CB 3.38Å; L420-A424 PolarHBondContact O-N 3.02Å |
| 421 | P | 86.4 | Confident | 72.9 | Confident | 0 Ų | 0 | 24.8 Ų | 24.8 | 0% | 0 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -66.3 | -34.3 | 178.3 | 21.4 | -29.5 | 0 | 0 | 0 | 112.9 | A192 V219 W222 V223 G417 W418 A424 G425 | A192-P421 HydrophobicContact CB-CB 4.43Å; A192-P421 HydrophobicContact CB-CG 4.15Å; V219-P421 HydrophobicContact CG1-CB 3.96Å; V219-P421 WeakPolarHBondContact O-CB 3.29Å; W222-P421 HydrophobicContact CB-CB 3.83Å; W222-P421 HydrophobicContact CB-CG 3.64Å; W222-P421 HydrophobicContact CG-CG 4.42Å; V223-P421 WeakPolarHBondContact CA-O 3.43Å; V223-P421 HydrophobicContact CG2-CB 3.66Å; V223-P421 WeakPolarHBondContact CG2-O 3.32Å; G417-P421 WeakPolarHBondContact O-CD 3.49Å; G417-P421 WeakPolarHBondContact O-CG 3.33Å; W418-P421 WeakPolarHBondContact O-CD 3.45Å; W418-P421 WeakPolarHBondContact O-CG 3.42Å; P421-A424 WeakPolarHBondContact O-CB 3.33Å; P421-A424 PolarHBondContact O-N 3.28Å; P421-G425 PolarHBondContact O-N 2.84Å |
| 422 | F | 84.9 | Confident | 75 | Confident | 46 Ų | 46 | 25.8 Ų | 25.8 | 20% | 0.202 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -61.8 | -46.3 | 174.1 | 178.1 | -88.3 | 0 | 0 | 0 | 111.9 | W222 G226 A229 W418 V419 L420 G425 G426 | W222-F422 WeakPolarHBondContact O-CA 3.43Å; G226-F422 VanDerWaalsContact CA-CD2 3.49Å; G226-F422 WeakPolarHBondContact CA-O 3.22Å; A229-F422 HydrophobicContact CB-CE2 3.83Å; A229-F422 HydrophobicContact CB-CZ 3.85Å; W418-F422 HydrophobicContact CE3-CB 4.06Å; W418-F422 HydrophobicContact CE3-CG 4.34Å; W418-F422 HydrophobicContact CZ3-CD1 4.5Å; W418-F422 HydrophobicContact CZ3-CG 4.44Å; W418-F422 WeakPolarHBondContact O-CB 3.37Å; W418-F422 PolarHBondContact O-N 2.91Å; V419-F422 PolarHBondContact O-N 3.15Å; L420-F422 VanDerWaalsContact C-N 3.33Å; L420-F422 PolarHBondContact O-N 3.24Å; F422-G425 PolarHBondContact O-N 2.95Å; F422-G426 PolarHBondContact O-N 3.44Å; F422-G426 VanDerWaalsContact O-N 3.08Å |
| 423 | T | 83.9 | Confident | 77.1 | Confident | 4 Ų | 4 | 28.1 Ų | 28.1 | 3% | 0.025 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -62.4 | -43.1 | 175.6 | -60.3 | 0 | 0 | 0 | 0 | 111.1 | L188 H329 V419 L420 G425 G426 F427 | L188-T423 HydrophobicContact CD1-CG2 4.09Å; H329-T423 HydrophobicContact CB-CG2 3.88Å; V419-T423 WeakPolarHBondContact O-CB 3.49Å; V419-T423 PolarHBondContact O-N 3.08Å; V419-T423 PolarHBondContact O-OG1 3.29Å; L420-T423 PolarHBondContact O-N 3.04Å; T423-G425 VanDerWaalsContact C-N 3.26Å; T423-G425 PolarHBondContact O-N 3.02Å; T423-G426 CarbonylContact O-C 3.55Å; T423-G426 WeakPolarHBondContact O-CA 3.32Å; T423-G426 PolarHBondContact O-N 2.91Å; T423-F427 HydrophobicContact CG2-CE2 4.37Å; T423-F427 HydrophobicContact CG2-CZ 4.4Å; T423-F427 PolarHBondContact O-N 2.84Å |
| 424 | A | 89.7 | Confident | 78.8 | Confident | 0 Ų | 0 | 26.6 Ų | 26.6 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -56.7 | -40.7 | 173.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | A184 L188 I189 L420 P421 G426 F427 I428 | A184-A424 HydrophobicContact CB-CB 4.03Å; L188-A424 HydrophobicContact CB-CB 3.84Å; L188-A424 HydrophobicContact CD1-CB 3.95Å; I189-A424 HydrophobicContact CD1-CB 4.27Å; I189-A424 HydrophobicContact CG1-CB 3.83Å; L420-A424 WeakPolarHBondContact O-CB 3.38Å; L420-A424 PolarHBondContact O-N 3.02Å; P421-A424 WeakPolarHBondContact O-CB 3.33Å; P421-A424 PolarHBondContact O-N 3.28Å; A424-G426 VanDerWaalsContact C-N 3.35Å; A424-G426 PolarHBondContact O-N 3.38Å; A424-F427 PolarHBondContact O-N 3.04Å; A424-I428 WeakPolarHBondContact O-CD1 3.45Å; A424-I428 VanDerWaalsContact O-CG1 3.24Å; A424-I428 WeakPolarHBondContact O-CG1 3.28Å; A424-I428 PolarHBondContact O-N 3.43Å |
| 425 | G | 90.4 | Very high | 80.7 | Confident | 0 Ų | 0 | 23 Ų | 23 | 0% | 0 | 14% | 0.136 | C | C | . | . | H | α-helix | trans | -60.4 | -41 | 172.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | V223 I227 P421 F422 T423 Y429 | V223-G425 WeakPolarHBondContact O-CA 3.5Å; I227-G425 WeakPolarHBondContact CG1-O 3.3Å; P421-G425 PolarHBondContact O-N 2.84Å; F422-G425 PolarHBondContact O-N 2.95Å; T423-G425 VanDerWaalsContact C-N 3.26Å; T423-G425 PolarHBondContact O-N 3.02Å; G425-Y429 WeakPolarHBondContact O-CB 3.28Å; G425-Y429 PolarHBondContact O-N 3.3Å |
| 426 | G | 87.1 | Confident | 82.7 | Confident | 0 Ų | 0 | 24.6 Ų | 24.6 | 0% | 0 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -61.6 | -47.5 | 173.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | F422 T423 A424 Y429 V430 | F422-G426 PolarHBondContact O-N 3.44Å; F422-G426 VanDerWaalsContact O-N 3.08Å; T423-G426 CarbonylContact O-C 3.55Å; T423-G426 WeakPolarHBondContact O-CA 3.32Å; T423-G426 PolarHBondContact O-N 2.91Å; A424-G426 VanDerWaalsContact C-N 3.35Å; A424-G426 PolarHBondContact O-N 3.38Å; G426-Y429 WeakPolarHBondContact O-CB 3.13Å; G426-Y429 PolarHBondContact O-N 3.15Å; G426-Y429 VanDerWaalsContact O-N 3.15Å; G426-V430 WeakPolarHBondContact O-CG2 3.42Å; G426-V430 PolarHBondContact O-N 3.04Å |
| 427 | F | 89.9 | Confident | 84.5 | Confident | 5 Ų | 5 | 24.5 Ų | 24.5 | 2% | 0.022 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -62.7 | -42.8 | 176.8 | -75.9 | -8.4 | 0 | 0 | 0 | 113.1 | L180 D183 A184 L188 A325 H329 T423 A424 Y429 V430 A431 | L180-F427 HydrophobicContact CB-CB 4.47Å; L180-F427 HydrophobicContact CD2-CD1 3.77Å; L180-F427 HydrophobicContact CD2-CD2 4.17Å; L180-F427 HydrophobicContact CD2-CE1 3.8Å; L180-F427 HydrophobicContact CD2-CE2 4.19Å; L180-F427 HydrophobicContact CD2-CG 3.94Å; L180-F427 HydrophobicContact CD2-CZ 3.98Å; D183-F427 WeakPolarHBondContact OD2-CD2 3.02Å; D183-F427 WeakPolarHBondContact OD2-CE2 3.39Å; A184-F427 HydrophobicContact CB-CB 4.19Å; L188-F427 HydrophobicContact CD1-CD2 3.92Å; L188-F427 HydrophobicContact CD1-CE2 4.19Å; A325-F427 HydrophobicContact CB-CD1 3.76Å; A325-F427 HydrophobicContact CB-CE1 3.73Å; H329-F427 HydrophobicContact CB-CE1 4.07Å; H329-F427 HydrophobicContact CB-CE2 4.01Å; H329-F427 HydrophobicContact CB-CZ 3.33Å; H329-F427 AromaticContact CD2-CZ 3.85Å; H329-F427 AromaticContact CE1-CE2 3.73Å; H329-F427 AromaticContact CG-CE2 3.61Å; H329-F427 AromaticContact CG-CZ 3.33Å; H329-F427 AromaticContact ND1-CE2 3.34Å; H329-F427 VanDerWaalsContact ND1-CE2 3.34Å; H329-F427 WeakPolarHBondContact ND1-CE2 3.4Å; H329-F427 AromaticContact ND1-CZ 3.6Å; T423-F427 HydrophobicContact CG2-CE2 4.37Å; T423-F427 HydrophobicContact CG2-CZ 4.4Å; T423-F427 PolarHBondContact O-N 2.84Å; A424-F427 PolarHBondContact O-N 3.04Å; F427-Y429 VanDerWaalsContact C-N 3.29Å; F427-Y429 PolarHBondContact O-N 2.87Å; F427-V430 PolarHBondContact O-N 3.23Å; F427-A431 VanDerWaalsContact O-CB 3.24Å; F427-A431 WeakPolarHBondContact O-CB 3.32Å; F427-A431 PolarHBondContact O-N 3.05Å |
| 428 | I | 93.8 | Very high | 85.3 | Confident | 21 Ų | 21 | 23.8 Ų | 23.8 | 11% | 0.108 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -58.1 | -44.8 | 172.4 | -69 | 164.1 | 0 | 0 | 0 | 110 | L181 A184 F185 I189 V223 I227 A424 T432 | L181-I428 HydrophobicContact CD2-CG1 4.49Å; A184-I428 HydrophobicContact CB-CD1 4.32Å; A184-I428 HydrophobicContact CB-CG1 3.89Å; F185-I428 HydrophobicContact CE1-CD1 4.13Å; F185-I428 HydrophobicContact CE2-CD1 4.08Å; F185-I428 HydrophobicContact CE2-CG1 3.97Å; F185-I428 HydrophobicContact CZ-CD1 3.69Å; F185-I428 HydrophobicContact CZ-CG1 4.07Å; I189-I428 HydrophobicContact CD1-CD1 4.3Å; V223-I428 HydrophobicContact CG1-CD1 4Å; I227-I428 HydrophobicContact CD1-CG2 4.22Å; A424-I428 WeakPolarHBondContact O-CD1 3.45Å; A424-I428 VanDerWaalsContact O-CG1 3.24Å; A424-I428 WeakPolarHBondContact O-CG1 3.28Å; A424-I428 PolarHBondContact O-N 3.43Å; I428-T432 HydrophobicContact CG2-CG2 4.33Å; I428-T432 VanDerWaalsContact O-CB 3.31Å; I428-T432 WeakPolarHBondContact O-CB 3.36Å; I428-T432 VanDerWaalsContact O-CG2 3.3Å; I428-T432 WeakPolarHBondContact O-CG2 3.05Å; I428-T432 PolarHBondContact O-N 2.8Å; I428-T432 PolarHBondContact O-OG1 2.9Å |
| 429 | Y | 90.4 | Very high | 85.7 | Confident | 10 Ų | 10 | 19.4 Ų | 19.4 | 4% | 0.039 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -63.6 | -50 | 179.3 | -173.9 | -90.6 | 0 | 0 | 0 | 112.3 | I227 F230 L231 E234 L321 G425 G426 F427 A431 T432 V433 | I227-Y429 HydrophobicContact CG2-CD2 4.12Å; F230-Y429 HydrophobicContact CB-CD1 3.54Å; F230-Y429 HydrophobicContact CB-CD2 4.38Å; F230-Y429 HydrophobicContact CB-CE1 4.02Å; F230-Y429 HydrophobicContact CB-CG 3.72Å; F230-Y429 HydrophobicContact CD1-CD1 4.17Å; F230-Y429 HydrophobicContact CG-CD1 4.31Å; L231-Y429 WeakPolarHBondContact CA-OH 3.28Å; L231-Y429 HydrophobicContact CB-CE2 3.71Å; L231-Y429 HydrophobicContact CD1-CE2 4.38Å; L231-Y429 HydrophobicContact CG-CE2 4.38Å; E234-Y429 HydrophobicContact CB-CE1 4.47Å; E234-Y429 PolarHBondContact OE1-OH 2.97Å; E234-Y429 VanDerWaalsContact OE2-CE1 3.24Å; E234-Y429 WeakPolarHBondContact OE2-CE1 3.42Å; E234-Y429 PolarHBondContact OE2-OH 3.48Å; E234-Y429 VanDerWaalsContact OE2-OH 3.08Å; L321-Y429 HydrophobicContact CD1-CE1 4.3Å; G425-Y429 WeakPolarHBondContact O-CB 3.28Å; G425-Y429 PolarHBondContact O-N 3.3Å; G426-Y429 WeakPolarHBondContact O-CB 3.13Å; G426-Y429 PolarHBondContact O-N 3.15Å; G426-Y429 VanDerWaalsContact O-N 3.15Å; F427-Y429 VanDerWaalsContact C-N 3.29Å; F427-Y429 PolarHBondContact O-N 2.87Å; Y429-A431 PolarHBondContact O-N 2.66Å; Y429-T432 PolarHBondContact O-N 3.41Å; Y429-V433 HydrophobicContact CD1-CB 4.43Å; Y429-V433 HydrophobicContact CD2-CB 4.33Å; Y429-V433 HydrophobicContact CD2-CG2 3.82Å; Y429-V433 HydrophobicContact CE1-CB 4.24Å; Y429-V433 HydrophobicContact CE1-CG1 4.28Å; Y429-V433 HydrophobicContact CE2-CB 4.11Å; Y429-V433 HydrophobicContact CE2-CG1 4.16Å; Y429-V433 HydrophobicContact CE2-CG2 3.75Å; Y429-V433 HydrophobicContact CG-CG2 4.34Å; Y429-V433 WeakPolarHBondContact O-CA 3.5Å; Y429-V433 VanDerWaalsContact O-CB 3.27Å; Y429-V433 WeakPolarHBondContact O-CB 3.29Å; Y429-V433 PolarHBondContact O-N 3.49Å |
| 430 | V | 88.2 | Confident | 86.2 | Confident | 0 Ų | 0 | 25.6 Ų | 25.6 | 0% | 0 | 14% | 0.141 | C | C | . | . | I | π-helix | trans | -59.2 | -49.5 | 178.4 | 171.7 | 0 | 0 | 0 | 0 | 110.3 | L180 F230 N322 A325 G426 F427 T432 S434 V435 | L180-V430 HydrophobicContact CD1-CG1 4.15Å; F230-V430 HydrophobicContact CD1-CG2 4.09Å; F230-V430 HydrophobicContact CE1-CG2 3.99Å; N322-V430 HydrophobicContact CB-CG1 4.43Å; N322-V430 VanDerWaalsContact OD1-CG1 3.28Å; N322-V430 WeakPolarHBondContact OD1-CG1 3.3Å; A325-V430 HydrophobicContact CB-CG2 4.19Å; G426-V430 WeakPolarHBondContact O-CG2 3.42Å; G426-V430 PolarHBondContact O-N 3.04Å; F427-V430 PolarHBondContact O-N 3.23Å; V430-T432 PolarHBondContact O-N 3.3Å; V430-S434 WeakPolarHBondContact O-CA 3.5Å; V430-S434 WeakPolarHBondContact O-CB 3.38Å; V430-S434 PolarHBondContact O-N 3.12Å; V430-V435 HydrophobicContact CG1-CG2 4.37Å; V430-V435 PolarHBondContact O-N 3.22Å |
| 431 | A | 89.2 | Confident | 86.1 | Confident | 0 Ų | 0 | 32.1 Ų | 32.1 | 0% | 0 | 16% | 0.164 | C | C | . | . | I | π-helix | trans | -62.5 | -44.7 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | L180 L181 F427 Y429 L436 | L180-A431 HydrophobicContact CB-CB 4.24Å; L181-A431 HydrophobicContact CD1-CB 4.23Å; L181-A431 HydrophobicContact CD2-CB 3.79Å; L181-A431 HydrophobicContact CG-CB 3.65Å; F427-A431 VanDerWaalsContact O-CB 3.24Å; F427-A431 WeakPolarHBondContact O-CB 3.32Å; F427-A431 PolarHBondContact O-N 3.05Å; Y429-A431 PolarHBondContact O-N 2.66Å; A431-L436 VanDerWaalsContact O-CB 3.31Å; A431-L436 WeakPolarHBondContact O-CB 3.2Å; A431-L436 PolarHBondContact O-N 3.29Å |
| 432 | T | 91.1 | Very high | 85 | Confident | 58 Ų | 58 | 41.9 Ų | 41.9 | 36% | 0.356 | 21% | 0.209 | S | C | . | . | I | π-helix | trans | -87.9 | -31.9 | -171.8 | 60.1 | 0 | 0 | 0 | 0 | 114.8 | L181 I428 Y429 V430 P437 | L181-T432 HydrophobicContact CD2-CG2 4.18Å; I428-T432 HydrophobicContact CG2-CG2 4.33Å; I428-T432 VanDerWaalsContact O-CB 3.31Å; I428-T432 WeakPolarHBondContact O-CB 3.36Å; I428-T432 VanDerWaalsContact O-CG2 3.3Å; I428-T432 WeakPolarHBondContact O-CG2 3.05Å; I428-T432 PolarHBondContact O-N 2.8Å; I428-T432 PolarHBondContact O-OG1 2.9Å; Y429-T432 PolarHBondContact O-N 3.41Å; V430-T432 PolarHBondContact O-N 3.3Å; T432-P437 VanDerWaalsContact O-CD 3.29Å; T432-P437 WeakPolarHBondContact O-CD 3.5Å; T432-P437 WeakPolarHBondContact O-CG 3.36Å |
| 433 | V | 86.4 | Confident | 84.6 | Confident | 63 Ų | 63 | 41.3 Ų | 41.3 | 38% | 0.382 | 21% | 0.213 | S | C | . | . | I | π-helix | trans | -101.9 | -35.1 | -174.8 | -178.1 | 0 | 0 | 0 | 0 | 111.7 | Y429 P437 | Y429-V433 HydrophobicContact CD1-CB 4.43Å; Y429-V433 HydrophobicContact CD2-CB 4.33Å; Y429-V433 HydrophobicContact CD2-CG2 3.82Å; Y429-V433 HydrophobicContact CE1-CB 4.24Å; Y429-V433 HydrophobicContact CE1-CG1 4.28Å; Y429-V433 HydrophobicContact CE2-CB 4.11Å; Y429-V433 HydrophobicContact CE2-CG1 4.16Å; Y429-V433 HydrophobicContact CE2-CG2 3.75Å; Y429-V433 HydrophobicContact CG-CG2 4.34Å; Y429-V433 WeakPolarHBondContact O-CA 3.5Å; Y429-V433 VanDerWaalsContact O-CB 3.27Å; Y429-V433 WeakPolarHBondContact O-CB 3.29Å; Y429-V433 PolarHBondContact O-N 3.49Å; V433-P437 WeakPolarHBondContact O-CG 3.15Å |
| 434 | S | 80 | Confident | 84.7 | Confident | 20 Ų | 20 | 44.4 Ų | 44.4 | 14% | 0.14 | 24% | 0.235 | C | C | . | . | I | π-helix | trans | -95.2 | -37.7 | -176.8 | -74.1 | 0 | 0 | 0 | 0 | 113.3 | S318 V430 | S318-S434 WeakPolarHBondContact OG-CB 3.08Å; V430-S434 WeakPolarHBondContact O-CA 3.5Å; V430-S434 WeakPolarHBondContact O-CB 3.38Å; V430-S434 PolarHBondContact O-N 3.12Å |
| 435 | V | 83.4 | Confident | 84.7 | Confident | 2 Ų | 2 | 50 Ų | 50 | 1% | 0.012 | 27% | 0.271 | C | S | . | . | I | π-helix | trans | -100.6 | -57 | -171.3 | 176.1 | 0 | 0 | 0 | 0 | 113.2 | L173 I369 V430 P437 E438 L439 | L173-V435 HydrophobicContact CD1-CB 4.26Å; L173-V435 HydrophobicContact CD1-CG1 3.47Å; L173-V435 VanDerWaalsContact CD1-CG1 3.47Å; L173-V435 HydrophobicContact CD1-CG2 3.91Å; L173-V435 HydrophobicContact CD2-CG1 3.98Å; L173-V435 HydrophobicContact CG-CG1 3.41Å; L173-V435 VanDerWaalsContact CG-CG1 3.41Å; I369-V435 HydrophobicContact CD1-CG2 3.7Å; I369-V435 HydrophobicContact CG1-CG2 4.15Å; V430-V435 HydrophobicContact CG1-CG2 4.37Å; V430-V435 PolarHBondContact O-N 3.22Å; V435-P437 VanDerWaalsContact C-CD 3.42Å; V435-E438 WeakPolarHBondContact O-CB 3.42Å; V435-E438 PolarHBondContact O-N 3.39Å; V435-L439 HydrophobicContact CG1-CD1 4.02Å; V435-L439 HydrophobicContact CG1-CG 4.47Å; V435-L439 PolarHBondContact O-N 2.65Å |
| 436 | L | 86.8 | Confident | 84.6 | Confident | 53 Ų | 53 | 55.6 Ų | 55.6 | 28% | 0.277 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -56.7 | -38.8 | -173.3 | -160.1 | 66.4 | 0 | 0 | 0 | 114.1 | A431 E438 L439 L440 L455 | A431-L436 VanDerWaalsContact O-CB 3.31Å; A431-L436 WeakPolarHBondContact O-CB 3.2Å; A431-L436 PolarHBondContact O-N 3.29Å; L436-E438 PolarHBondContact O-N 2.78Å; L436-L439 HydrophobicContact CD1-CD1 4.25Å; L436-L439 PolarHBondContact O-N 3.27Å; L436-L440 WeakPolarHBondContact O-CG 3.49Å; L436-L440 PolarHBondContact O-N 2.98Å; L436-L440 VanDerWaalsContact O-N 3.14Å; L436-L455 HydrophobicContact CD1-CD1 4Å |
| 437 | P | 85.3 | Confident | 84.7 | Confident | 52 Ų | 52 | 56.2 Ų | 56.2 | 34% | 0.338 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -64.2 | -24 | 177.8 | -24.4 | 37.6 | 0 | 0 | 0 | 113.9 | T432 V433 V435 | T432-P437 VanDerWaalsContact O-CD 3.29Å; T432-P437 WeakPolarHBondContact O-CD 3.5Å; T432-P437 WeakPolarHBondContact O-CG 3.36Å; V433-P437 WeakPolarHBondContact O-CG 3.15Å; V435-P437 VanDerWaalsContact C-CD 3.42Å |
| 438 | E | 79 | Confident | 84.8 | Confident | 29 Ų | 29 | 58.2 Ų | 58.2 | 14% | 0.136 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -80.1 | -33.3 | 176.6 | -174 | 61.1 | -170.5 | 0 | 0 | 111.7 | Q372 V435 L436 L440 R441 | Q372-E438 VanDerWaalsContact NE2-CG 3.29Å; V435-E438 WeakPolarHBondContact O-CB 3.42Å; V435-E438 PolarHBondContact O-N 3.39Å; L436-E438 PolarHBondContact O-N 2.78Å; E438-L440 VanDerWaalsContact C-N 3.29Å; E438-L440 PolarHBondContact O-N 3.46Å; E438-R441 PolarHBondContact O-N 3.19Å |
| 439 | L | 81.2 | Confident | 84.7 | Confident | 11 Ų | 11 | 62.1 Ų | 62.1 | 6% | 0.058 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -68.8 | -29.4 | 173.5 | -61.9 | 171.7 | 0 | 0 | 0 | 112.1 | Q170 L173 V435 L436 R441 E451 | Q170-L439 HydrophobicContact CB-CD2 4.43Å; Q170-L439 WeakPolarHBondContact O-CD2 3.33Å; L173-L439 HydrophobicContact CB-CD2 4.36Å; L173-L439 HydrophobicContact CD2-CD2 3.89Å; L173-L439 HydrophobicContact CD2-CG 4.26Å; L173-L439 HydrophobicContact CG-CD2 4.21Å; V435-L439 HydrophobicContact CG1-CD1 4.02Å; V435-L439 HydrophobicContact CG1-CG 4.47Å; V435-L439 PolarHBondContact O-N 2.65Å; L436-L439 HydrophobicContact CD1-CD1 4.25Å; L436-L439 PolarHBondContact O-N 3.27Å; L439-R441 PolarHBondContact O-N 2.86Å; L439-E451 HydrophobicContact CD2-CG 4.35Å |
| 440 | L | 82.7 | Confident | 84.7 | Confident | 143 Ų | 143 | 64.8 Ų | 64.8 | 75% | 0.749 | 35% | 0.353 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78 | -2.6 | 178.5 | -65.9 | 174.1 | 0 | 0 | 0 | 113.9 | L436 E438 | L436-L440 WeakPolarHBondContact O-CG 3.49Å; L436-L440 PolarHBondContact O-N 2.98Å; L436-L440 VanDerWaalsContact O-N 3.14Å; E438-L440 VanDerWaalsContact C-N 3.29Å; E438-L440 PolarHBondContact O-N 3.46Å |
| 441 | R | 78.6 | Confident | 84.9 | Confident | 157 Ų | 157 | 65.1 Ų | 65.1 | 59% | 0.592 | 35% | 0.354 | S | S | * | . | S | Bend | trans | -91.5 | 135.6 | -179.3 | -80.4 | -174 | 155.4 | 97.6 | 2.5 | 112.6 | E438 L439 A443 | E438-R441 PolarHBondContact O-N 3.19Å; L439-R441 PolarHBondContact O-N 2.86Å; R441-A443 PolarHBondContact O-N 3.08Å |
| 442 | E | 64.1 | Low | 85.1 | Confident | 206 Ų | 206 | 69.1 Ų | 69.1 | 96% | 0.963 | 38% | 0.379 | S | S | * | . | S | Bend | trans | 17.2 | 71.4 | 169 | -67.7 | -173.9 | -174.1 | 0 | 0 | 116 | ||
| 443 | A | 75.8 | Confident | 85.2 | Confident | 33 Ų | 33 | 71 Ų | 71 | 27% | 0.273 | 39% | 0.386 | S | S | . | . | trans | -111.2 | 146 | 172.9 | 0 | 0 | 0 | 0 | 0 | 110.5 | R441 Q447 S448 | R441-A443 PolarHBondContact O-N 3.08Å; A443-Q447 HydrophobicContact CB-CB 4.31Å; A443-Q447 HydrophobicContact CB-CG 4.11Å; A443-S448 VanDerWaalsContact CB-OG 3.24Å; A443-S448 WeakPolarHBondContact CB-OG 3.19Å | ||
| 444 | S | 86.8 | Confident | 85.5 | Confident | 69 Ų | 69 | 68.4 Ų | 68.4 | 48% | 0.483 | 37% | 0.372 | S | S | . | . | trans | -63.8 | 150.4 | 167.9 | 75.1 | 0 | 0 | 0 | 0 | 109.5 | L446 Q447 S448 | S444-L446 PolarHBondContact O-N 3.42Å; S444-L446 VanDerWaalsContact O-N 3.1Å; S444-Q447 WeakPolarHBondContact O-CA 3.38Å; S444-Q447 WeakPolarHBondContact O-CB 2.93Å; S444-Q447 PolarHBondContact O-N 2.9Å; S444-Q447 VanDerWaalsContact OG-CB 3.29Å; S444-Q447 WeakPolarHBondContact OG-CB 3.46Å; S444-Q447 PolarHBondContact OG-N 3.22Å; S444-S448 PolarHBondContact O-N 3.32Å; S444-S448 PolarHBondContact O-OG 3.48Å | ||
| 445 | P | 88.2 | Confident | 86.2 | Confident | 118 Ų | 118 | 69.3 Ų | 69.3 | 77% | 0.766 | 38% | 0.375 | S | S | * | . | H | α-helix | trans | -58.2 | -32.4 | -175.2 | 21.6 | -33.9 | 0 | 0 | 0 | 113.6 | L449 | P445-L449 PolarHBondContact O-N 3.34Å; P445-L449 VanDerWaalsContact O-N 3.07Å |
| 446 | L | 89.1 | Confident | 86.7 | Confident | 117 Ų | 117 | 73.5 Ų | 73.5 | 61% | 0.613 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -71.2 | -41 | 175.4 | -171.3 | 153.3 | 0 | 0 | 0 | 111.5 | S444 L449 L450 | S444-L446 PolarHBondContact O-N 3.42Å; S444-L446 VanDerWaalsContact O-N 3.1Å; L446-L449 PolarHBondContact O-N 3.49Å; L446-L450 HydrophobicContact CD2-CD1 3.56Å; L446-L450 HydrophobicContact CD2-CG 4.02Å; L446-L450 WeakPolarHBondContact O-CG 3.4Å; L446-L450 PolarHBondContact O-N 2.87Å |
| 447 | Q | 89.4 | Confident | 87 | Confident | 14 Ų | 14 | 72.4 Ų | 72.4 | 7% | 0.065 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -62.4 | -46.1 | 175.5 | 178 | 64.9 | 24.8 | 0 | 0 | 110.7 | S167 A443 S444 L449 L450 E451 | S167-Q447 PolarHBondContact O-NE2 3.23Å; S167-Q447 VanDerWaalsContact O-NE2 3.16Å; S167-Q447 PolarHBondContact OG-OE1 2.83Å; A443-Q447 HydrophobicContact CB-CB 4.31Å; A443-Q447 HydrophobicContact CB-CG 4.11Å; S444-Q447 WeakPolarHBondContact O-CA 3.38Å; S444-Q447 WeakPolarHBondContact O-CB 2.93Å; S444-Q447 PolarHBondContact O-N 2.9Å; S444-Q447 VanDerWaalsContact OG-CB 3.29Å; S444-Q447 WeakPolarHBondContact OG-CB 3.46Å; S444-Q447 PolarHBondContact OG-N 3.22Å; Q447-L449 VanDerWaalsContact C-N 3.29Å; Q447-L449 PolarHBondContact O-N 2.84Å; Q447-L450 PolarHBondContact O-N 3.12Å; Q447-L450 VanDerWaalsContact O-N 3.1Å; Q447-E451 VanDerWaalsContact CG-OE1 3.23Å; Q447-E451 WeakPolarHBondContact CG-OE1 3.44Å; Q447-E451 PolarHBondContact NE2-OE1 2.82Å; Q447-E451 WeakPolarHBondContact O-CG 2.99Å; Q447-E451 PolarHBondContact O-N 3.2Å |
| 448 | S | 90.5 | Very high | 87.3 | Confident | 46 Ų | 46 | 69.9 Ų | 69.9 | 32% | 0.322 | 38% | 0.382 | S | S | . | . | H | α-helix | trans | -60.1 | -38.6 | 175.4 | -57.8 | 0 | 0 | 0 | 0 | 112.4 | A443 S444 E451 V452 | A443-S448 VanDerWaalsContact CB-OG 3.24Å; A443-S448 WeakPolarHBondContact CB-OG 3.19Å; S444-S448 PolarHBondContact O-N 3.32Å; S444-S448 PolarHBondContact O-OG 3.48Å; S448-E451 PolarHBondContact O-N 3.44Å; S448-V452 WeakPolarHBondContact O-CG2 3.47Å; S448-V452 PolarHBondContact O-N 3.18Å |
| 449 | L | 92.1 | Very high | 87.9 | Confident | 103 Ų | 103 | 70.6 Ų | 70.6 | 54% | 0.539 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -63.1 | -44.6 | 173.8 | 178.9 | 63.7 | 0 | 0 | 0 | 111.5 | P445 L446 Q447 E451 V452 L453 | P445-L449 PolarHBondContact O-N 3.34Å; P445-L449 VanDerWaalsContact O-N 3.07Å; L446-L449 PolarHBondContact O-N 3.49Å; Q447-L449 VanDerWaalsContact C-N 3.29Å; Q447-L449 PolarHBondContact O-N 2.84Å; L449-E451 VanDerWaalsContact C-N 3.33Å; L449-E451 PolarHBondContact O-N 2.92Å; L449-V452 PolarHBondContact O-N 3.4Å; L449-L453 HydrophobicContact CD1-CD1 4.49Å; L449-L453 HydrophobicContact CD1-CG 4.43Å; L449-L453 HydrophobicContact CG-CD1 4.23Å; L449-L453 WeakPolarHBondContact O-CB 3.4Å; L449-L453 VanDerWaalsContact O-CG 3.29Å; L449-L453 WeakPolarHBondContact O-CG 3.31Å; L449-L453 PolarHBondContact O-N 3.13Å |
| 450 | L | 91.8 | Very high | 88.5 | Confident | 66 Ų | 66 | 74 Ų | 74 | 35% | 0.346 | 41% | 0.41 | S | S | . | . | H | α-helix | trans | -64.5 | -36.8 | 177.2 | -70.6 | 177.4 | 0 | 0 | 0 | 112.4 | I171 L446 Q447 L453 G454 | I171-L450 HydrophobicContact CD1-CB 4.02Å; I171-L450 HydrophobicContact CD1-CD1 4.03Å; I171-L450 HydrophobicContact CG1-CB 4.13Å; L446-L450 HydrophobicContact CD2-CD1 3.56Å; L446-L450 HydrophobicContact CD2-CG 4.02Å; L446-L450 WeakPolarHBondContact O-CG 3.4Å; L446-L450 PolarHBondContact O-N 2.87Å; Q447-L450 PolarHBondContact O-N 3.12Å; Q447-L450 VanDerWaalsContact O-N 3.1Å; L450-L453 PolarHBondContact O-N 2.92Å; L450-G454 PolarHBondContact O-N 3.32Å |
| 451 | E | 92.3 | Very high | 88.8 | Confident | 7 Ų | 7 | 68.6 Ų | 68.6 | 3% | 0.033 | 38% | 0.381 | C | S | . | . | H | α-helix | trans | -63.9 | -49.3 | 173.9 | -72.8 | 161.5 | -175.5 | 0 | 0 | 110.4 | Q170 S174 L439 Q447 S448 L449 L453 G454 L455 | Q170-E451 HydrophobicContact CB-CG 4.32Å; Q170-E451 VanDerWaalsContact CB-OE1 3.27Å; Q170-E451 WeakPolarHBondContact CB-OE1 3.38Å; S174-E451 VanDerWaalsContact CB-O 3.25Å; S174-E451 WeakPolarHBondContact CB-O 3.36Å; S174-E451 PolarHBondContact OG-O 2.95Å; L439-E451 HydrophobicContact CD2-CG 4.35Å; Q447-E451 VanDerWaalsContact CG-OE1 3.23Å; Q447-E451 WeakPolarHBondContact CG-OE1 3.44Å; Q447-E451 PolarHBondContact NE2-OE1 2.82Å; Q447-E451 WeakPolarHBondContact O-CG 2.99Å; Q447-E451 PolarHBondContact O-N 3.2Å; S448-E451 PolarHBondContact O-N 3.44Å; L449-E451 VanDerWaalsContact C-N 3.33Å; L449-E451 PolarHBondContact O-N 2.92Å; E451-L453 VanDerWaalsContact C-N 3.31Å; E451-L453 PolarHBondContact O-N 3.05Å; E451-G454 CarbonylContact O-C 3.59Å; E451-G454 WeakPolarHBondContact O-CA 3.5Å; E451-G454 PolarHBondContact O-N 2.82Å; E451-L455 PolarHBondContact O-N 3Å |
| 452 | V | 92.9 | Very high | 89.3 | Confident | 85 Ų | 85 | 61.2 Ų | 61.2 | 52% | 0.515 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -59.3 | -42.7 | 176.2 | 171.9 | 0 | 0 | 0 | 0 | 111.6 | S448 L449 G454 L455 L456 | S448-V452 WeakPolarHBondContact O-CG2 3.47Å; S448-V452 PolarHBondContact O-N 3.18Å; L449-V452 PolarHBondContact O-N 3.4Å; V452-G454 VanDerWaalsContact C-N 3.3Å; V452-G454 PolarHBondContact O-N 3.13Å; V452-L455 PolarHBondContact O-N 2.85Å; V452-L456 HydrophobicContact CG1-CD1 4.2Å; V452-L456 WeakPolarHBondContact O-CG 2.86Å; V452-L456 PolarHBondContact O-N 3.42Å |
| 453 | L | 93.9 | Very high | 90.6 | Very high | 96 Ų | 96 | 54 Ų | 54 | 50% | 0.503 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -63.7 | -36.5 | 174.3 | -71.2 | 175 | 0 | 0 | 0 | 112.1 | L449 L450 E451 G457 | L449-L453 HydrophobicContact CD1-CD1 4.49Å; L449-L453 HydrophobicContact CD1-CG 4.43Å; L449-L453 HydrophobicContact CG-CD1 4.23Å; L449-L453 WeakPolarHBondContact O-CB 3.4Å; L449-L453 VanDerWaalsContact O-CG 3.29Å; L449-L453 WeakPolarHBondContact O-CG 3.31Å; L449-L453 PolarHBondContact O-N 3.13Å; L450-L453 PolarHBondContact O-N 2.92Å; E451-L453 VanDerWaalsContact C-N 3.31Å; E451-L453 PolarHBondContact O-N 3.05Å; L453-G457 PolarHBondContact O-N 2.96Å |
| 454 | G | 92.6 | Very high | 91.2 | Very high | 9 Ų | 9 | 57.3 Ų | 57.3 | 9% | 0.093 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -59.7 | -50.9 | 172 | 0 | 0 | 0 | 0 | 0 | 111.4 | F175 L450 E451 V452 L456 G457 G458 | F175-G454 VanDerWaalsContact CA-O 3.27Å; F175-G454 WeakPolarHBondContact CA-O 2.88Å; F175-G454 WeakPolarHBondContact CD2-O 3.04Å; L450-G454 PolarHBondContact O-N 3.32Å; E451-G454 CarbonylContact O-C 3.59Å; E451-G454 WeakPolarHBondContact O-CA 3.5Å; E451-G454 PolarHBondContact O-N 2.82Å; V452-G454 VanDerWaalsContact C-N 3.3Å; V452-G454 PolarHBondContact O-N 3.13Å; G454-L456 PolarHBondContact O-N 2.91Å; G454-G457 CarbonylContact O-C 3.55Å; G454-G457 WeakPolarHBondContact O-CA 2.8Å; G454-G457 PolarHBondContact O-N 3.44Å; G454-G458 PolarHBondContact O-N 3.46Å |
| 455 | L | 93.1 | Very high | 91 | Very high | 39 Ų | 39 | 54.6 Ų | 54.6 | 20% | 0.204 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -58.6 | -48.3 | 177.9 | -173.2 | 151.9 | 0 | 0 | 0 | 111.6 | S174 G178 L436 E451 V452 G457 G458 V459 | S174-L455 VanDerWaalsContact O-CA 3.24Å; S174-L455 WeakPolarHBondContact O-CA 3.34Å; S174-L455 WeakPolarHBondContact OG-CB 3.45Å; G178-L455 WeakPolarHBondContact CA-O 3.49Å; L436-L455 HydrophobicContact CD1-CD1 4Å; E451-L455 PolarHBondContact O-N 3Å; V452-L455 PolarHBondContact O-N 2.85Å; L455-G457 VanDerWaalsContact C-N 3.27Å; L455-G457 PolarHBondContact O-N 3.38Å; L455-G458 PolarHBondContact O-N 3.49Å; L455-V459 HydrophobicContact CD2-CG2 4.33Å; L455-V459 WeakPolarHBondContact O-CG2 3.3Å; L455-V459 PolarHBondContact O-N 2.95Å |
| 456 | L | 94.5 | Very high | 90.7 | Very high | 91 Ų | 91 | 50.6 Ų | 50.6 | 48% | 0.476 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -61.4 | -38.1 | 174.8 | -69.1 | 174.7 | 0 | 0 | 0 | 111.8 | V452 G454 G458 V459 V460 | V452-L456 HydrophobicContact CG1-CD1 4.2Å; V452-L456 WeakPolarHBondContact O-CG 2.86Å; V452-L456 PolarHBondContact O-N 3.42Å; G454-L456 PolarHBondContact O-N 2.91Å; L456-G458 VanDerWaalsContact C-N 3.34Å; L456-G458 PolarHBondContact O-N 3.4Å; L456-V459 PolarHBondContact O-N 3.13Å; L456-V460 WeakPolarHBondContact O-CB 3.32Å; L456-V460 VanDerWaalsContact O-CG2 3.28Å; L456-V460 WeakPolarHBondContact O-CG2 3.25Å; L456-V460 PolarHBondContact O-N 3.32Å |
| 457 | G | 93 | Very high | 90.3 | Very high | 29 Ų | 29 | 52 Ų | 52 | 30% | 0.299 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -59.4 | -42.9 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | L453 G454 L455 V460 M461 | L453-G457 PolarHBondContact O-N 2.96Å; G454-G457 CarbonylContact O-C 3.55Å; G454-G457 WeakPolarHBondContact O-CA 2.8Å; G454-G457 PolarHBondContact O-N 3.44Å; L455-G457 VanDerWaalsContact C-N 3.27Å; L455-G457 PolarHBondContact O-N 3.38Å; G457-V460 PolarHBondContact O-N 2.75Å; G457-M461 WeakPolarHBondContact O-CB 3.24Å; G457-M461 PolarHBondContact O-N 2.97Å |
| 458 | G | 91.3 | Very high | 89.6 | Confident | 0 Ų | 0 | 56.9 Ų | 56.9 | 0% | 0 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -63.7 | -43.3 | 175 | 0 | 0 | 0 | 0 | 0 | 112.5 | G454 L455 L456 M461 M462 | G454-G458 PolarHBondContact O-N 3.46Å; L455-G458 PolarHBondContact O-N 3.49Å; L456-G458 VanDerWaalsContact C-N 3.34Å; L456-G458 PolarHBondContact O-N 3.4Å; G458-M461 WeakPolarHBondContact O-CB 3.45Å; G458-M461 PolarHBondContact O-N 3.19Å; G458-M462 PolarHBondContact O-N 2.86Å; G458-M462 VanDerWaalsContact O-N 3.07Å |
| 459 | V | 93.1 | Very high | 88.4 | Confident | 43 Ų | 43 | 59.7 Ų | 59.7 | 26% | 0.261 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -63.5 | -47.5 | 175.6 | 175.3 | 0 | 0 | 0 | 0 | 111.3 | G178 L186 L455 L456 M461 M462 V463 | G178-V459 WeakPolarHBondContact O-CG2 3.43Å; L186-V459 HydrophobicContact CD1-CG1 4.42Å; L455-V459 HydrophobicContact CD2-CG2 4.33Å; L455-V459 WeakPolarHBondContact O-CG2 3.3Å; L455-V459 PolarHBondContact O-N 2.95Å; L456-V459 PolarHBondContact O-N 3.13Å; V459-M461 VanDerWaalsContact C-N 3.28Å; V459-M461 PolarHBondContact O-N 2.94Å; V459-M462 PolarHBondContact O-N 3.1Å; V459-M462 VanDerWaalsContact O-N 3.13Å; V459-V463 HydrophobicContact CG1-CG2 4.49Å; V459-V463 WeakPolarHBondContact O-CG2 3.2Å; V459-V463 PolarHBondContact O-N 3.02Å |
| 460 | V | 92.7 | Very high | 88.3 | Confident | 84 Ų | 84 | 57.5 Ų | 57.5 | 51% | 0.509 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -61 | -40.2 | 178.7 | 167.5 | 0 | 0 | 0 | 0 | 110.8 | L456 G457 V463 L464 | L456-V460 WeakPolarHBondContact O-CB 3.32Å; L456-V460 VanDerWaalsContact O-CG2 3.28Å; L456-V460 WeakPolarHBondContact O-CG2 3.25Å; L456-V460 PolarHBondContact O-N 3.32Å; G457-V460 PolarHBondContact O-N 2.75Å; V460-V463 WeakPolarHBondContact O-CB 3.5Å; V460-V463 PolarHBondContact O-N 2.91Å; V460-L464 HydrophobicContact CG1-CD1 4.25Å; V460-L464 HydrophobicContact CG1-CG 4.42Å; V460-L464 WeakPolarHBondContact O-CG 3.31Å; V460-L464 PolarHBondContact O-N 3.25Å |
| 461 | M | 89.7 | Confident | 88.1 | Confident | 29 Ų | 29 | 57.1 Ų | 57.1 | 14% | 0.143 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -59.2 | -46.5 | 174.3 | 179.3 | -154.1 | 81.8 | 0 | 0 | 111.3 | F175 P361 G457 G458 V459 V463 L464 I465 | F175-M461 HydrophobicContact CE1-SD 4.18Å; F175-M461 HydrophobicContact CE2-SD 4.36Å; F175-M461 HydrophobicContact CZ-SD 3.5Å; F175-M461 VanDerWaalsContact CZ-SD 3.5Å; P361-M461 HydrophobicContact CB-CE 3.45Å; P361-M461 VanDerWaalsContact CB-CE 3.45Å; P361-M461 HydrophobicContact CB-SD 3.3Å; P361-M461 WeakPolarHBondContact CB-SD 3.49Å; P361-M461 HydrophobicContact CG-CE 3.67Å; P361-M461 HydrophobicContact CG-SD 3.14Å; P361-M461 WeakPolarHBondContact CG-SD 3.27Å; G457-M461 WeakPolarHBondContact O-CB 3.24Å; G457-M461 PolarHBondContact O-N 2.97Å; G458-M461 WeakPolarHBondContact O-CB 3.45Å; G458-M461 PolarHBondContact O-N 3.19Å; V459-M461 VanDerWaalsContact C-N 3.28Å; V459-M461 PolarHBondContact O-N 2.94Å; M461-V463 VanDerWaalsContact C-N 3.32Å; M461-V463 PolarHBondContact O-N 3.03Å; M461-L464 WeakPolarHBondContact O-CB 3.45Å; M461-L464 PolarHBondContact O-N 3Å; M461-L464 VanDerWaalsContact O-N 3.12Å; M461-I465 HydrophobicContact CE-CD1 4.11Å; M461-I465 HydrophobicContact CG-CD1 4.1Å; M461-I465 WeakPolarHBondContact O-CG1 3.01Å; M461-I465 PolarHBondContact O-N 3.11Å |
| 462 | M | 89.1 | Confident | 87.8 | Confident | 2 Ų | 2 | 59.8 Ų | 59.8 | 1% | 0.01 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -63.8 | -36.7 | 176.1 | -69.2 | -49.4 | -56.4 | 0 | 0 | 112.8 | G179 D183 H187 H358 G458 V459 L464 I465 A466 | G179-M462 WeakPolarHBondContact O-CG 3.12Å; D183-M462 HydrophobicContact CB-CE 3.81Å; D183-M462 HydrophobicContact CB-SD 4.4Å; H187-M462 HydrophobicContact CB-CE 4.49Å; H358-M462 HydrophobicContact CB-CE 4.15Å; H358-M462 HydrophobicContact CB-SD 4.23Å; G458-M462 PolarHBondContact O-N 2.86Å; G458-M462 VanDerWaalsContact O-N 3.07Å; V459-M462 PolarHBondContact O-N 3.1Å; V459-M462 VanDerWaalsContact O-N 3.13Å; M462-L464 VanDerWaalsContact C-N 3.33Å; M462-L464 PolarHBondContact O-N 3.46Å; M462-I465 PolarHBondContact O-N 3.49Å; M462-I465 HydrophobicContact SD-CD1 4.18Å; M462-A466 WeakPolarHBondContact O-CB 3.42Å; M462-A466 PolarHBondContact O-N 3.22Å |
| 463 | V | 90 | Very high | 87.6 | Confident | 53 Ų | 53 | 58.4 Ų | 58.4 | 32% | 0.321 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -59.8 | -43.9 | 171.7 | 172.2 | 0 | 0 | 0 | 0 | 111.1 | L186 V459 V460 M461 A466 H467 | L186-V463 HydrophobicContact CD1-CG2 3.45Å; L186-V463 VanDerWaalsContact CD1-CG2 3.45Å; V459-V463 HydrophobicContact CG1-CG2 4.49Å; V459-V463 WeakPolarHBondContact O-CG2 3.2Å; V459-V463 PolarHBondContact O-N 3.02Å; V460-V463 WeakPolarHBondContact O-CB 3.5Å; V460-V463 PolarHBondContact O-N 2.91Å; M461-V463 VanDerWaalsContact C-N 3.32Å; M461-V463 PolarHBondContact O-N 3.03Å; V463-A466 PolarHBondContact O-N 2.99Å; V463-H467 PolarHBondContact O-CD2 3.34Å; V463-H467 PolarHBondContact O-N 3.34Å; V463-H467 VanDerWaalsContact O-N 3.16Å |
| 464 | L | 88.6 | Confident | 87.2 | Confident | 103 Ų | 103 | 56 Ų | 56 | 54% | 0.539 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -64.8 | -40.7 | 178.6 | -69 | 173.3 | 0 | 0 | 0 | 111.6 | V460 M461 M462 H467 L468 | V460-L464 HydrophobicContact CG1-CD1 4.25Å; V460-L464 HydrophobicContact CG1-CG 4.42Å; V460-L464 WeakPolarHBondContact O-CG 3.31Å; V460-L464 PolarHBondContact O-N 3.25Å; M461-L464 WeakPolarHBondContact O-CB 3.45Å; M461-L464 PolarHBondContact O-N 3Å; M461-L464 VanDerWaalsContact O-N 3.12Å; M462-L464 VanDerWaalsContact C-N 3.33Å; M462-L464 PolarHBondContact O-N 3.46Å; L464-H467 PolarHBondContact O-N 2.83Å; L464-L468 WeakPolarHBondContact O-CG 3.41Å; L464-L468 PolarHBondContact O-N 3.42Å |
| 465 | I | 83 | Confident | 86.8 | Confident | 12 Ų | 12 | 59.1 Ų | 59.1 | 6% | 0.062 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -65.4 | -45.5 | 177.5 | -65.7 | 172.2 | 0 | 0 | 0 | 110.5 | L357 H358 M461 M462 H467 L468 E469 | L357-I465 HydrophobicContact CB-CD1 4.5Å; H358-I465 HydrophobicContact CB-CD1 3.67Å; H358-I465 HydrophobicContact CB-CG2 4.3Å; M461-I465 HydrophobicContact CE-CD1 4.11Å; M461-I465 HydrophobicContact CG-CD1 4.1Å; M461-I465 WeakPolarHBondContact O-CG1 3.01Å; M461-I465 PolarHBondContact O-N 3.11Å; M462-I465 PolarHBondContact O-N 3.49Å; M462-I465 HydrophobicContact SD-CD1 4.18Å; I465-H467 PolarHBondContact O-N 3.32Å; I465-H467 VanDerWaalsContact O-N 3.11Å; I465-L468 WeakPolarHBondContact O-CB 3.21Å; I465-L468 PolarHBondContact O-N 2.69Å; I465-E469 PolarHBondContact O-N 3.03Å; I465-E469 VanDerWaalsContact O-N 3.11Å |
| 466 | A | 81.6 | Confident | 86.3 | Confident | 34 Ų | 34 | 60.6 Ų | 60.6 | 28% | 0.281 | 33% | 0.334 | S | S | . | . | H | α-helix | trans | -62.5 | -18 | 176 | 0 | 0 | 0 | 0 | 0 | 113.8 | M462 V463 | M462-A466 WeakPolarHBondContact O-CB 3.42Å; M462-A466 PolarHBondContact O-N 3.22Å; V463-A466 PolarHBondContact O-N 2.99Å |
| 467 | H | 82.2 | Confident | 85.7 | Confident | 146 Ų | 146 | 58.2 Ų | 58.2 | 68% | 0.676 | 32% | 0.323 | S | S | * | . | H | α-helix | trans | -87.5 | -18.4 | 171.6 | -79.5 | -55.2 | 0 | 0 | 0 | 113.9 | V463 L464 I465 | V463-H467 PolarHBondContact O-CD2 3.34Å; V463-H467 PolarHBondContact O-N 3.34Å; V463-H467 VanDerWaalsContact O-N 3.16Å; L464-H467 PolarHBondContact O-N 2.83Å; I465-H467 PolarHBondContact O-N 3.32Å; I465-H467 VanDerWaalsContact O-N 3.11Å |
| 468 | L | 74.3 | Confident | 85.1 | Confident | 117 Ų | 117 | 60.7 Ų | 60.7 | 61% | 0.613 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -90.6 | -21 | 178.1 | -66.9 | 171.7 | 0 | 0 | 0 | 112.3 | L357 L464 I465 | L357-L468 HydrophobicContact CD1-CD1 4.48Å; L464-L468 WeakPolarHBondContact O-CG 3.41Å; L464-L468 PolarHBondContact O-N 3.42Å; I465-L468 WeakPolarHBondContact O-CB 3.21Å; I465-L468 PolarHBondContact O-N 2.69Å |
| 469 | E | 65.8 | Low | 84.5 | Confident | 105 Ų | 105 | 66.2 Ų | 66.2 | 49% | 0.491 | 36% | 0.355 | S | S | . | . | trans | -72.5 | 0 | 167.7 | -72.8 | 171.6 | 177.1 | 0 | 0 | 112.2 | H187 T354 H358 I465 | H187-E469 IonicContact CE1-OE1 3.25Å; H187-E469 PolarHBondContact CE1-OE1 3.46Å; H187-E469 IonicContact CE1-OE2 3.98Å; H187-E469 PolarHBondContact CE1-OE2 3.47Å; H187-E469 IonicContact CG-OE2 3.07Å; H187-E469 IonicContact ND1-OE1 3.38Å; H187-E469 PolarHBondContact ND1-OE1 3.07Å; H187-E469 IonicContact ND1-OE2 3.37Å; H187-E469 PolarHBondContact ND1-OE2 3.25Å; H187-E469 IonicContact NE2-OE1 3.69Å; T354-E469 VanDerWaalsContact CG2-CD 3.49Å; T354-E469 HydrophobicContact CG2-CG 3.21Å; T354-E469 WeakPolarHBondContact CG2-OE1 3.35Å; H358-E469 IonicContact ND1-OE1 3.42Å; I465-E469 PolarHBondContact O-N 3.03Å; I465-E469 VanDerWaalsContact O-N 3.11Å |
Retrieved 469 of 469 residues in 72.6 ms
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