| 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 | 32.6 | Very low | 28.8 | Very low | 251 Ų | 251 | 161.1 Ų | 161.1 | 100% | 1.236 | 85% | 0.854 | S | S | * | * | 0 | 117.4 | 0 | -65.1 | 162.7 | 80.9 | 0 | 0 | 106.5 | |||||
| 2 | S | 32.1 | Very low | 28.6 | Very low | 115 Ų | 115 | 152.8 Ų | 152.8 | 80% | 0.804 | 84% | 0.836 | S | S | * | * | cis | -153.1 | 141.9 | 3.7 | -174.7 | 0 | 0 | 0 | 0 | 108.4 | ||||
| 3 | S | 27.6 | Very low | 28.8 | Very low | 97 Ų | 97 | 150.1 Ų | 150.1 | 68% | 0.678 | 83% | 0.834 | S | S | * | * | trans | -57 | 151.9 | 160.2 | 27 | 0 | 0 | 0 | 0 | 113 | ||||
| 4 | N | 26.5 | Very low | 29.3 | Very low | 155 Ų | 155 | 153.6 Ų | 153.6 | 83% | 0.829 | 84% | 0.841 | S | S | * | * | -174.6 | 144.7 | 110.9 | -113.1 | 8.9 | 0 | 0 | 0 | 115.4 | |||||
| 5 | E | 29.9 | Very low | 30 | Very low | 173 Ų | 173 | 150.7 Ų | 150.7 | 81% | 0.808 | 83% | 0.83 | S | S | * | * | trans | -71.3 | 159.1 | 175.7 | -63.7 | 163.5 | 116.5 | 0 | 0 | 114.1 | ||||
| 6 | S | 29 | Very low | 30.3 | Very low | 116 Ų | 116 | 157.1 Ų | 157.1 | 81% | 0.811 | 84% | 0.838 | S | S | * | * | trans | -157.6 | 95.8 | 134 | -166.7 | 0 | 0 | 0 | 0 | 111.8 | ||||
| 7 | S | 29.8 | Very low | 30.7 | Very low | 97 Ų | 97 | 150.9 Ų | 150.9 | 68% | 0.678 | 82% | 0.82 | S | S | * | * | trans | 23.8 | 113.9 | 135.3 | -50.8 | 0 | 0 | 0 | 0 | 120.4 | ||||
| 8 | K | 30.1 | Very low | 31 | Very low | 215 Ų | 215 | 147.7 Ų | 147.7 | 94% | 0.935 | 81% | 0.811 | S | S | * | * | trans | -136.5 | 101.4 | 138.4 | -89 | -172.1 | -178.4 | 173.5 | 0 | 110.9 | ||||
| 9 | T | 29.1 | Very low | 31.4 | Very low | 132 Ų | 132 | 146.6 Ų | 146.6 | 81% | 0.81 | 80% | 0.804 | S | S | * | * | trans | -67 | 126.4 | 162.3 | -20.5 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 10 | Q | 25 | Very low | 32 | Very low | 197 Ų | 197 | 142.9 Ų | 142.9 | 92% | 0.921 | 79% | 0.789 | S | S | * | * | trans | -151.7 | 125.1 | 140 | -152.7 | 155.3 | -13.7 | 0 | 0 | 111.8 | ||||
| 11 | Y | 25.7 | Very low | 33 | Very low | 224 Ų | 224 | 139.8 Ų | 139.8 | 88% | 0.878 | 77% | 0.774 | S | S | * | * | trans | -92.5 | 146.3 | -171.8 | -171.8 | -91.3 | 0 | 0 | 0 | 110.4 | ||||
| 12 | G | 26.6 | Very low | 33.6 | Very low | 62 Ų | 62 | 131.3 Ų | 131.3 | 64% | 0.639 | 74% | 0.738 | S | S | * | * | trans | 81.3 | 139.2 | 164.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 13 | S | 30.1 | Very low | 34.4 | Very low | 117 Ų | 117 | 129.9 Ų | 129.9 | 82% | 0.818 | 73% | 0.728 | S | S | * | * | cis | -163.9 | 108.1 | 40 | -55.2 | 0 | 0 | 0 | 0 | 110 | V15 | S13-V15 VanDerWaalsContact C-N 3.33Å; S13-V15 PolarHBondContact O-N 3.46Å | ||
| 14 | E | 36.3 | Very low | 35.7 | Very low | 199 Ų | 199 | 131 Ų | 131 | 93% | 0.93 | 72% | 0.722 | S | S | * | * | trans | -95.7 | 57.7 | 168.7 | -150 | 179.3 | -178.2 | 0 | 0 | 109.3 | ||||
| 15 | V | 39.6 | Very low | 37.2 | Very low | 111 Ų | 111 | 129.1 Ų | 129.1 | 67% | 0.673 | 71% | 0.706 | S | S | * | * | trans | -148.9 | 80 | 174 | -173.2 | 0 | 0 | 0 | 0 | 109.7 | S13 | S13-V15 VanDerWaalsContact C-N 3.33Å; S13-V15 PolarHBondContact O-N 3.46Å | ||
| 16 | R | 34.9 | Very low | 38.7 | Very low | 252 Ų | 252 | 126.4 Ų | 126.4 | 95% | 0.951 | 69% | 0.694 | S | S | * | * | trans | -148.5 | 36.7 | 168.6 | -138 | 174 | -153.2 | -162.5 | 4.7 | 115.4 | ||||
| 17 | G | 36.8 | Very low | 40.2 | Very low | 53 Ų | 53 | 126.9 Ų | 126.9 | 55% | 0.546 | 69% | 0.686 | S | S | . | * | S | Bend | trans | -122.1 | -21.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 116.2 | T21 | G17-T21 PolarHBondContact O-OG1 3.3Å; G17-T21 VanDerWaalsContact O-OG1 3.08Å |
| 18 | S | 35.8 | Very low | 42.2 | Very low | 92 Ų | 92 | 123.1 Ų | 123.1 | 64% | 0.643 | 66% | 0.66 | S | S | * | * | S | Bend | trans | -96.1 | -29.3 | -172.2 | -85.4 | 0 | 0 | 0 | 0 | 115.6 | C22 | S18-C22 WeakPolarHBondContact O-CB 3.43Å; S18-C22 PolarHBondContact O-N 2.99Å |
| 19 | N | 38.5 | Very low | 44.3 | Very low | 127 Ų | 127 | 114.7 Ų | 114.7 | 68% | 0.679 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -76.3 | -36.7 | -169.1 | -74.6 | -0.6 | 0 | 0 | 0 | 113.8 | C23 | N19-C23 WeakPolarHBondContact O-CB 3.38Å; N19-C23 PolarHBondContact O-N 3.35Å; N19-C23 VanDerWaalsContact O-N 3.11Å |
| 20 | S | 45.2 | Very low | 46.8 | Very low | 73 Ų | 73 | 111.8 Ų | 111.8 | 51% | 0.51 | 61% | 0.609 | S | S | . | * | H | α-helix | trans | -70.1 | -40.4 | 179.2 | 29.8 | 0 | 0 | 0 | 0 | 112 | C23 H24 | S20-C23 PolarHBondContact O-N 2.96Å; S20-H24 WeakPolarHBondContact O-CB 3.3Å; S20-H24 PolarHBondContact O-CD2 3.49Å; S20-H24 VanDerWaalsContact O-CD2 3.32Å; S20-H24 PolarHBondContact O-N 3.33Å |
| 21 | T | 51.1 | Low | 49.3 | Very low | 78 Ų | 78 | 104.4 Ų | 104.4 | 48% | 0.479 | 58% | 0.582 | S | S | . | * | H | α-helix | trans | -71.7 | -33.2 | -179.8 | -18 | 0 | 0 | 0 | 0 | 112.4 | G17 K25 | G17-T21 PolarHBondContact O-OG1 3.3Å; G17-T21 VanDerWaalsContact O-OG1 3.08Å; T21-K25 VanDerWaalsContact O-CG 3.31Å; T21-K25 WeakPolarHBondContact O-CG 3.46Å; T21-K25 PolarHBondContact O-N 2.86Å |
| 22 | C | 46.5 | Very low | 52 | Low | 72 Ų | 72 | 95.3 Ų | 95.3 | 49% | 0.486 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -68.6 | -48.3 | 173 | -173 | 0 | 0 | 0 | 0 | 111.1 | S18 H24 K25 E26 | S18-C22 WeakPolarHBondContact O-CB 3.43Å; S18-C22 PolarHBondContact O-N 2.99Å; C22-H24 VanDerWaalsContact C-N 3.34Å; C22-H24 PolarHBondContact O-N 3.06Å; C22-K25 PolarHBondContact O-N 3.11Å; C22-K25 VanDerWaalsContact O-N 3.09Å; C22-E26 PolarHBondContact O-N 2.87Å |
| 23 | C | 49.3 | Very low | 54.8 | Low | 86 Ų | 86 | 95.4 Ų | 95.4 | 58% | 0.581 | 54% | 0.539 | S | S | * | . | H | α-helix | trans | -61 | -39.9 | 179 | -157.3 | 0 | 0 | 0 | 0 | 112.4 | N19 S20 L27 | N19-C23 WeakPolarHBondContact O-CB 3.38Å; N19-C23 PolarHBondContact O-N 3.35Å; N19-C23 VanDerWaalsContact O-N 3.11Å; S20-C23 PolarHBondContact O-N 2.96Å; C23-L27 WeakPolarHBondContact O-CB 3.37Å; C23-L27 PolarHBondContact O-N 3.42Å |
| 24 | H | 55.1 | Low | 57.6 | Low | 121 Ų | 121 | 94.3 Ų | 94.3 | 56% | 0.56 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -68.1 | -31.7 | 174.7 | -91.8 | -82.4 | 0 | 0 | 0 | 114.1 | S20 C22 S28 | S20-H24 WeakPolarHBondContact O-CB 3.3Å; S20-H24 PolarHBondContact O-CD2 3.49Å; S20-H24 VanDerWaalsContact O-CD2 3.32Å; S20-H24 PolarHBondContact O-N 3.33Å; C22-H24 VanDerWaalsContact C-N 3.34Å; C22-H24 PolarHBondContact O-N 3.06Å; H24-S28 VanDerWaalsContact O-CB 3.24Å; H24-S28 WeakPolarHBondContact O-CB 3.48Å; H24-S28 PolarHBondContact O-N 3.3Å |
| 25 | K | 57.5 | Low | 59.9 | Low | 114 Ų | 114 | 85.7 Ų | 85.7 | 50% | 0.496 | 49% | 0.485 | S | S | . | . | H | α-helix | trans | -69.8 | -47.2 | 175.8 | -79 | 174.2 | -177.1 | 177.8 | 0 | 111 | T21 C22 S28 V29 | T21-K25 VanDerWaalsContact O-CG 3.31Å; T21-K25 WeakPolarHBondContact O-CG 3.46Å; T21-K25 PolarHBondContact O-N 2.86Å; C22-K25 PolarHBondContact O-N 3.11Å; C22-K25 VanDerWaalsContact O-N 3.09Å; K25-S28 PolarHBondContact O-N 3.35Å; K25-V29 WeakPolarHBondContact O-CG2 3.32Å; K25-V29 PolarHBondContact O-N 3.07Å |
| 26 | E | 59.9 | Low | 62.3 | Low | 117 Ų | 117 | 82.3 Ų | 82.3 | 55% | 0.547 | 46% | 0.462 | S | S | . | . | H | α-helix | trans | -63 | -43 | 178.8 | -68.7 | -58 | 139.9 | 0 | 0 | 112.3 | C22 S28 V29 T30 | C22-E26 PolarHBondContact O-N 2.87Å; E26-S28 VanDerWaalsContact C-N 3.31Å; E26-S28 PolarHBondContact O-N 3.24Å; E26-V29 PolarHBondContact O-N 3.27Å; E26-T30 WeakPolarHBondContact O-CB 3.31Å; E26-T30 PolarHBondContact O-N 2.97Å; E26-T30 PolarHBondContact O-OG1 3Å |
| 27 | L | 62.1 | Low | 64.9 | Low | 125 Ų | 125 | 72.9 Ų | 72.9 | 65% | 0.654 | 43% | 0.433 | S | S | * | . | H | α-helix | trans | -65.1 | -36.6 | 177.9 | -158.7 | 79.3 | 0 | 0 | 0 | 111.8 | C23 A31 | C23-L27 WeakPolarHBondContact O-CB 3.37Å; C23-L27 PolarHBondContact O-N 3.42Å; L27-A31 WeakPolarHBondContact O-CB 3.34Å; L27-A31 PolarHBondContact O-N 2.83Å |
| 28 | S | 70.1 | Confident | 67.5 | Low | 18 Ų | 18 | 73.5 Ų | 73.5 | 13% | 0.126 | 43% | 0.426 | C | S | . | . | H | α-helix | trans | -71.2 | -38.6 | 179.8 | -171.4 | 0 | 0 | 0 | 0 | 112.6 | H24 K25 E26 S32 R289 | H24-S28 VanDerWaalsContact O-CB 3.24Å; H24-S28 WeakPolarHBondContact O-CB 3.48Å; H24-S28 PolarHBondContact O-N 3.3Å; K25-S28 PolarHBondContact O-N 3.35Å; E26-S28 VanDerWaalsContact C-N 3.31Å; E26-S28 PolarHBondContact O-N 3.24Å; S28-S32 PolarHBondContact O-N 3.01Å; S28-S32 PolarHBondContact O-OG 3.5Å; S28-R289 PolarHBondContact O-NH2 3.2Å; S28-R289 PolarHBondContact OG-NH2 3.5Å |
| 29 | V | 76 | Confident | 70.2 | Confident | 39 Ų | 39 | 69.1 Ų | 69.1 | 24% | 0.236 | 40% | 0.395 | C | S | . | . | H | α-helix | trans | -64.8 | -51 | 173.8 | 177.7 | 0 | 0 | 0 | 0 | 109.8 | K25 E26 A31 S32 V33 Y91 | K25-V29 WeakPolarHBondContact O-CG2 3.32Å; K25-V29 PolarHBondContact O-N 3.07Å; E26-V29 PolarHBondContact O-N 3.27Å; V29-A31 VanDerWaalsContact C-N 3.35Å; V29-A31 PolarHBondContact O-N 3.49Å; V29-S32 PolarHBondContact O-N 3.46Å; V29-S32 VanDerWaalsContact O-N 3.12Å; V29-V33 HydrophobicContact CG1-CG2 4.32Å; V29-V33 WeakPolarHBondContact O-CG2 3.47Å; V29-V33 PolarHBondContact O-N 3.41Å; V29-Y91 HydrophobicContact CB-CE1 4.27Å; V29-Y91 HydrophobicContact CG2-CD1 3.64Å; V29-Y91 HydrophobicContact CG2-CE1 3.2Å; V29-Y91 HydrophobicContact CG2-CE2 4.48Å; V29-Y91 HydrophobicContact CG2-CG 4.43Å |
| 30 | T | 80.3 | Confident | 72.8 | Confident | 70 Ų | 70 | 65 Ų | 65 | 43% | 0.429 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -59 | -45.3 | -177.1 | -56.7 | 0 | 0 | 0 | 0 | 111.5 | E26 S32 V33 I34 | E26-T30 WeakPolarHBondContact O-CB 3.31Å; E26-T30 PolarHBondContact O-N 2.97Å; E26-T30 PolarHBondContact O-OG1 3Å; T30-S32 VanDerWaalsContact C-N 3.34Å; T30-S32 PolarHBondContact O-N 3.22Å; T30-V33 PolarHBondContact O-N 2.82Å; T30-I34 HydrophobicContact CG2-CD1 3.71Å; T30-I34 HydrophobicContact CG2-CG1 4.37Å; T30-I34 WeakPolarHBondContact O-CB 3.44Å; T30-I34 VanDerWaalsContact O-CG1 3.26Å; T30-I34 WeakPolarHBondContact O-CG1 3.5Å; T30-I34 PolarHBondContact O-N 3.47Å |
| 31 | A | 79 | Confident | 75 | Confident | 43 Ų | 43 | 69.1 Ų | 69.1 | 36% | 0.355 | 38% | 0.381 | S | S | . | . | H | α-helix | trans | -60.7 | -40.6 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | L27 V29 S35 | L27-A31 WeakPolarHBondContact O-CB 3.34Å; L27-A31 PolarHBondContact O-N 2.83Å; V29-A31 VanDerWaalsContact C-N 3.35Å; V29-A31 PolarHBondContact O-N 3.49Å; A31-S35 VanDerWaalsContact O-CB 3.28Å; A31-S35 WeakPolarHBondContact O-CB 3.44Å; A31-S35 PolarHBondContact O-N 3.26Å |
| 32 | S | 81.6 | Confident | 76.9 | Confident | 33 Ų | 33 | 65.6 Ų | 65.6 | 23% | 0.231 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -67.8 | -41.3 | 177.1 | -74.6 | 0 | 0 | 0 | 0 | 112.3 | S28 V29 T30 M36 | S28-S32 PolarHBondContact O-N 3.01Å; S28-S32 PolarHBondContact O-OG 3.5Å; V29-S32 PolarHBondContact O-N 3.46Å; V29-S32 VanDerWaalsContact O-N 3.12Å; T30-S32 VanDerWaalsContact C-N 3.34Å; T30-S32 PolarHBondContact O-N 3.22Å; S32-M36 VanDerWaalsContact O-CB 3.27Å; S32-M36 WeakPolarHBondContact O-CB 3.47Å; S32-M36 PolarHBondContact O-N 3.29Å |
| 33 | V | 85.5 | Confident | 79 | Confident | 63 Ų | 63 | 62.1 Ų | 62.1 | 38% | 0.382 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -66.1 | -43 | 176.9 | 174.1 | 0 | 0 | 0 | 0 | 111.3 | V29 T30 M36 T37 | V29-V33 HydrophobicContact CG1-CG2 4.32Å; V29-V33 WeakPolarHBondContact O-CG2 3.47Å; V29-V33 PolarHBondContact O-N 3.41Å; T30-V33 PolarHBondContact O-N 2.82Å; V33-M36 PolarHBondContact O-N 3.12Å; V33-T37 HydrophobicContact CG1-CG2 4.47Å; V33-T37 WeakPolarHBondContact O-CB 3.14Å; V33-T37 WeakPolarHBondContact O-CG2 3.5Å; V33-T37 PolarHBondContact O-N 3.34Å; V33-T37 PolarHBondContact O-OG1 2.96Å |
| 34 | I | 87.8 | Confident | 81 | Confident | 94 Ų | 94 | 60.4 Ų | 60.4 | 48% | 0.482 | 33% | 0.325 | S | S | . | . | H | α-helix | trans | -63.1 | -49.8 | 176.5 | -68.2 | 169.8 | 0 | 0 | 0 | 110.4 | T30 M36 T37 V38 | T30-I34 HydrophobicContact CG2-CD1 3.71Å; T30-I34 HydrophobicContact CG2-CG1 4.37Å; T30-I34 WeakPolarHBondContact O-CB 3.44Å; T30-I34 VanDerWaalsContact O-CG1 3.26Å; T30-I34 WeakPolarHBondContact O-CG1 3.5Å; T30-I34 PolarHBondContact O-N 3.47Å; I34-M36 VanDerWaalsContact C-N 3.31Å; I34-M36 PolarHBondContact O-N 2.97Å; I34-T37 WeakPolarHBondContact CA-OG1 3.35Å; I34-T37 PolarHBondContact O-N 2.87Å; I34-T37 PolarHBondContact O-OG1 3.03Å; I34-V38 HydrophobicContact CG2-CG2 4.16Å; I34-V38 WeakPolarHBondContact O-CB 3.3Å; I34-V38 VanDerWaalsContact O-CG2 3.24Å; I34-V38 WeakPolarHBondContact O-CG2 3.25Å; I34-V38 PolarHBondContact O-N 3.49Å |
| 35 | S | 86 | Confident | 82.7 | Confident | 19 Ų | 19 | 59.4 Ų | 59.4 | 13% | 0.133 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -59 | -42.7 | 179.1 | 176.5 | 0 | 0 | 0 | 0 | 112 | A31 G39 I296 | A31-S35 VanDerWaalsContact O-CB 3.28Å; A31-S35 WeakPolarHBondContact O-CB 3.44Å; A31-S35 PolarHBondContact O-N 3.26Å; S35-G39 PolarHBondContact O-N 2.86Å; S35-I296 WeakPolarHBondContact O-CD1 3.42Å |
| 36 | M | 88.6 | Confident | 84.1 | Confident | 39 Ų | 39 | 54 Ų | 54 | 19% | 0.192 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -62.4 | -50.9 | 176.6 | -178.9 | -175.6 | 74.9 | 0 | 0 | 112.2 | S32 V33 I34 G39 I40 G84 | S32-M36 VanDerWaalsContact O-CB 3.27Å; S32-M36 WeakPolarHBondContact O-CB 3.47Å; S32-M36 PolarHBondContact O-N 3.29Å; V33-M36 PolarHBondContact O-N 3.12Å; I34-M36 VanDerWaalsContact C-N 3.31Å; I34-M36 PolarHBondContact O-N 2.97Å; M36-G39 PolarHBondContact O-N 3.44Å; M36-I40 HydrophobicContact CG-CD1 3.86Å; M36-I40 VanDerWaalsContact O-CG1 3.28Å; M36-I40 WeakPolarHBondContact O-CG1 3.13Å; M36-I40 PolarHBondContact O-N 2.91Å; M36-G84 VanDerWaalsContact SD-C 3.56Å; M36-G84 WeakPolarHBondContact SD-CA 3.35Å |
| 37 | T | 90.3 | Very high | 85.4 | Confident | 55 Ų | 55 | 50.1 Ų | 50.1 | 34% | 0.337 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -62.8 | -48.3 | -178.8 | 48.5 | 0 | 0 | 0 | 0 | 111.3 | V33 I34 G39 I40 F41 | V33-T37 HydrophobicContact CG1-CG2 4.47Å; V33-T37 WeakPolarHBondContact O-CB 3.14Å; V33-T37 WeakPolarHBondContact O-CG2 3.5Å; V33-T37 PolarHBondContact O-N 3.34Å; V33-T37 PolarHBondContact O-OG1 2.96Å; I34-T37 WeakPolarHBondContact CA-OG1 3.35Å; I34-T37 PolarHBondContact O-N 2.87Å; I34-T37 PolarHBondContact O-OG1 3.03Å; T37-G39 VanDerWaalsContact C-N 3.31Å; T37-G39 PolarHBondContact O-N 2.93Å; T37-I40 PolarHBondContact O-N 3.25Å; T37-F41 WeakPolarHBondContact O-CD2 3.26Å; T37-F41 PolarHBondContact O-N 2.86Å |
| 38 | V | 92.1 | Very high | 86.6 | Confident | 66 Ų | 66 | 50 Ų | 50 | 40% | 0.4 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -59.1 | -43.2 | 176.4 | 174.5 | 0 | 0 | 0 | 0 | 111 | I34 F41 S42 I296 | I34-V38 HydrophobicContact CG2-CG2 4.16Å; I34-V38 WeakPolarHBondContact O-CB 3.3Å; I34-V38 VanDerWaalsContact O-CG2 3.24Å; I34-V38 WeakPolarHBondContact O-CG2 3.25Å; I34-V38 PolarHBondContact O-N 3.49Å; V38-F41 PolarHBondContact O-N 2.88Å; V38-S42 WeakPolarHBondContact O-CB 3.48Å; V38-S42 PolarHBondContact O-N 3.47Å; V38-I296 HydrophobicContact CG1-CG2 3.79Å |
| 39 | G | 90.8 | Very high | 87.2 | Confident | 0 Ų | 0 | 51.6 Ų | 51.6 | 0% | 0 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -61.8 | -43.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | S35 M36 T37 N43 | S35-G39 PolarHBondContact O-N 2.86Å; M36-G39 PolarHBondContact O-N 3.44Å; T37-G39 VanDerWaalsContact C-N 3.31Å; T37-G39 PolarHBondContact O-N 2.93Å; G39-N43 WeakPolarHBondContact O-CB 3.42Å; G39-N43 PolarHBondContact O-N 2.69Å; G39-N43 PolarHBondContact O-ND2 3.01Å |
| 40 | I | 93 | Very high | 87.5 | Confident | 40 Ų | 40 | 50.8 Ų | 50.8 | 21% | 0.205 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -64.2 | -49.6 | 177 | -68 | 163.8 | 0 | 0 | 0 | 110.8 | M36 T37 S44 L77 H80 L81 | M36-I40 HydrophobicContact CG-CD1 3.86Å; M36-I40 VanDerWaalsContact O-CG1 3.28Å; M36-I40 WeakPolarHBondContact O-CG1 3.13Å; M36-I40 PolarHBondContact O-N 2.91Å; T37-I40 PolarHBondContact O-N 3.25Å; I40-S44 WeakPolarHBondContact O-CB 3.24Å; I40-S44 PolarHBondContact O-N 3.23Å; I40-S44 PolarHBondContact O-OG 3.33Å; I40-L77 HydrophobicContact CB-CD1 4.4Å; I40-L77 HydrophobicContact CG1-CD1 4.5Å; I40-L77 HydrophobicContact CG2-CD1 4.09Å; I40-H80 HydrophobicContact CG1-CB 3.93Å; I40-L81 HydrophobicContact CD1-CD2 3.73Å; I40-L81 HydrophobicContact CD1-CG 4.5Å; I40-L81 HydrophobicContact CG1-CD2 4.03Å; I40-L81 HydrophobicContact CG1-CG 4.37Å; I40-L81 HydrophobicContact CG2-CD2 4.47Å |
| 41 | F | 92.6 | Very high | 87.5 | Confident | 159 Ų | 159 | 52.3 Ų | 52.3 | 70% | 0.697 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -63 | -44.9 | 179.5 | -80 | -67.2 | 0 | 0 | 0 | 111.8 | T37 V38 F45 | T37-F41 WeakPolarHBondContact O-CD2 3.26Å; T37-F41 PolarHBondContact O-N 2.86Å; V38-F41 PolarHBondContact O-N 2.88Å; F41-F45 VanDerWaalsContact O-CB 3.29Å; F41-F45 WeakPolarHBondContact O-CB 3.33Å; F41-F45 PolarHBondContact O-N 3.37Å |
| 42 | S | 89.9 | Confident | 87.5 | Confident | 4 Ų | 4 | 55.9 Ų | 55.9 | 3% | 0.028 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -54.6 | -57.7 | 176.7 | 171.8 | 0 | 0 | 0 | 0 | 111.7 | V38 S44 F45 A46 I296 W300 | V38-S42 WeakPolarHBondContact O-CB 3.48Å; V38-S42 PolarHBondContact O-N 3.47Å; S42-S44 PolarHBondContact O-N 3.04Å; S42-F45 PolarHBondContact O-N 2.76Å; S42-A46 WeakPolarHBondContact O-CB 3.5Å; S42-A46 PolarHBondContact O-N 2.97Å; S42-I296 PolarHBondContact OG-O 3.27Å; S42-W300 PolarHBondContact OG-NE1 3.47Å |
| 43 | N | 91.9 | Very high | 87.1 | Confident | 0 Ų | 0 | 55.7 Ų | 55.7 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -69.9 | -35.8 | -175.5 | -78 | -70.4 | 0 | 0 | 0 | 112.1 | G39 F45 A46 L47 V73 L77 Q295 | G39-N43 WeakPolarHBondContact O-CB 3.42Å; G39-N43 PolarHBondContact O-N 2.69Å; G39-N43 PolarHBondContact O-ND2 3.01Å; N43-F45 PolarHBondContact O-N 3.49Å; N43-A46 PolarHBondContact O-N 3.44Å; N43-L47 VanDerWaalsContact O-CB 3.3Å; N43-L47 WeakPolarHBondContact O-CB 3.46Å; N43-L47 PolarHBondContact O-N 3.23Å; N43-V73 HydrophobicContact CB-CG1 3.97Å; N43-V73 WeakPolarHBondContact O-CG1 3.35Å; N43-L77 HydrophobicContact CB-CB 4Å; N43-L77 HydrophobicContact CB-CD1 4.34Å; N43-Q295 PolarHBondContact ND2-O 3.44Å |
| 44 | S | 91.1 | Very high | 86.4 | Confident | 49 Ų | 49 | 60 Ų | 60 | 34% | 0.343 | 30% | 0.295 | S | S | . | . | H | α-helix | trans | -62.2 | -43.8 | 174.1 | -59.8 | 0 | 0 | 0 | 0 | 111.8 | I40 S42 L47 F48 | I40-S44 WeakPolarHBondContact O-CB 3.24Å; I40-S44 PolarHBondContact O-N 3.23Å; I40-S44 PolarHBondContact O-OG 3.33Å; S42-S44 PolarHBondContact O-N 3.04Å; S44-L47 PolarHBondContact O-N 2.9Å; S44-F48 PolarHBondContact O-N 3.46Å |
| 45 | F | 89.4 | Confident | 85.5 | Confident | 101 Ų | 101 | 60 Ų | 60 | 44% | 0.443 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -66.7 | -41.9 | 177.4 | -177.1 | -108.4 | 0 | 0 | 0 | 112.1 | F41 S42 N43 F48 I49 W300 | F41-F45 VanDerWaalsContact O-CB 3.29Å; F41-F45 WeakPolarHBondContact O-CB 3.33Å; F41-F45 PolarHBondContact O-N 3.37Å; S42-F45 PolarHBondContact O-N 2.76Å; N43-F45 PolarHBondContact O-N 3.49Å; F45-F48 PolarHBondContact O-N 2.92Å; F45-I49 HydrophobicContact CD1-CD1 3.79Å; F45-I49 HydrophobicContact CE1-CD1 3.35Å; F45-I49 HydrophobicContact CE1-CG1 4.37Å; F45-I49 HydrophobicContact CE2-CD1 4.45Å; F45-I49 HydrophobicContact CZ-CD1 3.73Å; F45-I49 HydrophobicContact CZ-CG1 4.41Å; F45-I49 WeakPolarHBondContact O-CG1 3.37Å; F45-I49 PolarHBondContact O-N 3.49Å; F45-W300 AromaticContact CD1-CH2 3.41Å; F45-W300 HydrophobicContact CD1-CH2 3.41Å; F45-W300 VanDerWaalsContact CD1-CH2 3.41Å; F45-W300 HydrophobicContact CD1-CZ2 4.19Å; F45-W300 HydrophobicContact CD1-CZ3 4Å; F45-W300 AromaticContact CE1-CH2 3.74Å; F45-W300 HydrophobicContact CE1-CH2 3.74Å; F45-W300 AromaticContact CE1-CZ3 3.97Å; F45-W300 HydrophobicContact CE1-CZ3 3.97Å; F45-W300 HydrophobicContact CG-CH2 4.48Å |
| 46 | A | 87.8 | Confident | 84.5 | Confident | 1 Ų | 1 | 68.1 Ų | 68.1 | 1% | 0.008 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -61.1 | -44.2 | 174.9 | 0 | 0 | 0 | 0 | 0 | 111.9 | S42 N43 F48 I49 L50 V73 P299 I303 | S42-A46 WeakPolarHBondContact O-CB 3.5Å; S42-A46 PolarHBondContact O-N 2.97Å; N43-A46 PolarHBondContact O-N 3.44Å; A46-F48 PolarHBondContact O-N 3.33Å; A46-I49 PolarHBondContact O-N 3.16Å; A46-L50 WeakPolarHBondContact O-CG 3.32Å; A46-L50 PolarHBondContact O-N 3.36Å; A46-V73 HydrophobicContact CB-CG1 4.05Å; A46-V73 HydrophobicContact CB-CG2 4.23Å; A46-P299 HydrophobicContact CB-CB 3.34Å; A46-P299 HydrophobicContact CB-CG 4.11Å; A46-I303 HydrophobicContact CB-CD1 4.07Å |
| 47 | L | 87.9 | Confident | 83 | Confident | 34 Ų | 34 | 70.8 Ų | 70.8 | 18% | 0.178 | 34% | 0.344 | C | S | . | . | H | α-helix | trans | -61.3 | -44.1 | 176.7 | -174.4 | 61.9 | 0 | 0 | 0 | 111.2 | N43 S44 I49 L50 I51 V73 L77 | N43-L47 VanDerWaalsContact O-CB 3.3Å; N43-L47 WeakPolarHBondContact O-CB 3.46Å; N43-L47 PolarHBondContact O-N 3.23Å; S44-L47 PolarHBondContact O-N 2.9Å; L47-I49 VanDerWaalsContact C-N 3.34Å; L47-I49 PolarHBondContact O-N 3.19Å; L47-L50 PolarHBondContact O-N 2.68Å; L47-I51 HydrophobicContact CD1-CD1 4.17Å; L47-I51 HydrophobicContact CD1-CG1 4.32Å; L47-I51 HydrophobicContact CD2-CD1 4.47Å; L47-I51 HydrophobicContact CG-CD1 3.82Å; L47-I51 HydrophobicContact CG-CG1 4.39Å; L47-I51 WeakPolarHBondContact O-CB 3.17Å; L47-I51 VanDerWaalsContact O-CG1 3.3Å; L47-I51 WeakPolarHBondContact O-CG1 3.3Å; L47-I51 PolarHBondContact O-N 3.22Å; L47-V73 HydrophobicContact CB-CG1 3.88Å; L47-L77 HydrophobicContact CD2-CD2 4.45Å |
| 48 | F | 86.1 | Confident | 81.3 | Confident | 123 Ų | 123 | 79.7 Ų | 79.7 | 54% | 0.539 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -57.7 | -44.7 | 174.9 | 175.8 | -101.4 | 0 | 0 | 0 | 112.3 | S44 F45 A46 K52 | S44-F48 PolarHBondContact O-N 3.46Å; F45-F48 PolarHBondContact O-N 2.92Å; A46-F48 PolarHBondContact O-N 3.33Å; F48-K52 WeakPolarHBondContact O-CB 3.47Å; F48-K52 PolarHBondContact O-N 3.34Å |
| 49 | I | 84.4 | Confident | 79.5 | Confident | 52 Ų | 52 | 81.2 Ų | 81.2 | 27% | 0.267 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -62 | -44.8 | 175.6 | -69.7 | 170.2 | 0 | 0 | 0 | 111 | F45 A46 L47 K52 S53 I303 | F45-I49 HydrophobicContact CD1-CD1 3.79Å; F45-I49 HydrophobicContact CE1-CD1 3.35Å; F45-I49 HydrophobicContact CE1-CG1 4.37Å; F45-I49 HydrophobicContact CE2-CD1 4.45Å; F45-I49 HydrophobicContact CZ-CD1 3.73Å; F45-I49 HydrophobicContact CZ-CG1 4.41Å; F45-I49 WeakPolarHBondContact O-CG1 3.37Å; F45-I49 PolarHBondContact O-N 3.49Å; A46-I49 PolarHBondContact O-N 3.16Å; L47-I49 VanDerWaalsContact C-N 3.34Å; L47-I49 PolarHBondContact O-N 3.19Å; I49-K52 PolarHBondContact O-N 3.23Å; I49-S53 VanDerWaalsContact O-CB 3.25Å; I49-S53 WeakPolarHBondContact O-CB 3.5Å; I49-S53 PolarHBondContact O-N 3.35Å; I49-I303 HydrophobicContact CD1-CD1 4.16Å; I49-I303 HydrophobicContact CD1-CG2 4.48Å |
| 50 | L | 81.6 | Confident | 77.8 | Confident | 22 Ų | 22 | 90.8 Ų | 90.8 | 12% | 0.115 | 42% | 0.417 | C | S | . | . | H | α-helix | trans | -64.6 | -45.7 | -179.2 | -72.5 | 171.8 | 0 | 0 | 0 | 111.7 | A46 L47 K52 S53 Y54 L66 A69 V73 | A46-L50 WeakPolarHBondContact O-CG 3.32Å; A46-L50 PolarHBondContact O-N 3.36Å; L47-L50 PolarHBondContact O-N 2.68Å; L50-K52 PolarHBondContact O-N 2.94Å; L50-S53 WeakPolarHBondContact O-CB 3.36Å; L50-S53 PolarHBondContact O-N 2.87Å; L50-Y54 WeakPolarHBondContact O-CB 3.42Å; L50-Y54 PolarHBondContact O-N 2.97Å; L50-L66 HydrophobicContact CD2-CD2 3.86Å; L50-A69 HydrophobicContact CD1-CB 4.29Å; L50-A69 HydrophobicContact CD2-CB 4.37Å; L50-V73 HydrophobicContact CD1-CB 4.46Å; L50-V73 HydrophobicContact CD1-CG2 4.01Å |
| 51 | I | 80.6 | Confident | 76.1 | Confident | 101 Ų | 101 | 92.9 Ų | 92.9 | 52% | 0.518 | 44% | 0.435 | S | S | . | . | H | α-helix | trans | -60.1 | -47.7 | 176.7 | -69.2 | 168.9 | 0 | 0 | 0 | 110.5 | L47 S53 Y54 S55 | L47-I51 HydrophobicContact CD1-CD1 4.17Å; L47-I51 HydrophobicContact CD1-CG1 4.32Å; L47-I51 HydrophobicContact CD2-CD1 4.47Å; L47-I51 HydrophobicContact CG-CD1 3.82Å; L47-I51 HydrophobicContact CG-CG1 4.39Å; L47-I51 WeakPolarHBondContact O-CB 3.17Å; L47-I51 VanDerWaalsContact O-CG1 3.3Å; L47-I51 WeakPolarHBondContact O-CG1 3.3Å; L47-I51 PolarHBondContact O-N 3.22Å; I51-S53 VanDerWaalsContact C-N 3.31Å; I51-S53 PolarHBondContact O-N 2.89Å; I51-Y54 WeakPolarHBondContact O-CB 3.5Å; I51-Y54 PolarHBondContact O-N 3.47Å; I51-S55 PolarHBondContact O-N 2.86Å |
| 52 | K | 78.5 | Confident | 74.8 | Confident | 119 Ų | 119 | 91.7 Ų | 91.7 | 52% | 0.517 | 43% | 0.43 | S | S | . | . | H | α-helix | trans | -63.5 | -38.8 | 177.8 | -172.3 | 171.7 | -176.8 | 162.5 | 0 | 111.8 | F48 I49 L50 R56 | F48-K52 WeakPolarHBondContact O-CB 3.47Å; F48-K52 PolarHBondContact O-N 3.34Å; I49-K52 PolarHBondContact O-N 3.23Å; L50-K52 PolarHBondContact O-N 2.94Å; K52-R56 WeakPolarHBondContact O-CB 3.43Å; K52-R56 PolarHBondContact O-N 3.29Å; K52-R56 VanDerWaalsContact O-N 3.07Å |
| 53 | S | 73.8 | Confident | 74 | Confident | 28 Ų | 28 | 93.4 Ų | 93.4 | 20% | 0.196 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -65 | -40.7 | 175.7 | -174.5 | 0 | 0 | 0 | 0 | 111.8 | I49 L50 I51 R56 H57 | I49-S53 VanDerWaalsContact O-CB 3.25Å; I49-S53 WeakPolarHBondContact O-CB 3.5Å; I49-S53 PolarHBondContact O-N 3.35Å; L50-S53 WeakPolarHBondContact O-CB 3.36Å; L50-S53 PolarHBondContact O-N 2.87Å; I51-S53 VanDerWaalsContact C-N 3.31Å; I51-S53 PolarHBondContact O-N 2.89Å; S53-R56 PolarHBondContact O-N 2.84Å; S53-H57 WeakPolarHBondContact O-CB 3.43Å; S53-H57 PolarHBondContact O-N 2.81Å; S53-H57 PolarHBondContact O-ND1 3.33Å |
| 54 | Y | 70.1 | Confident | 73.3 | Confident | 154 Ų | 154 | 94.1 Ų | 94.1 | 60% | 0.604 | 45% | 0.449 | S | S | * | . | H | α-helix | trans | -63.5 | -46.3 | 177.7 | -175.3 | -91.2 | 0 | 0 | 0 | 111.5 | L50 I51 R56 L66 | L50-Y54 WeakPolarHBondContact O-CB 3.42Å; L50-Y54 PolarHBondContact O-N 2.97Å; I51-Y54 WeakPolarHBondContact O-CB 3.5Å; I51-Y54 PolarHBondContact O-N 3.47Å; Y54-R56 PolarHBondContact O-N 3.39Å; Y54-L66 HydrophobicContact CD2-CD1 4.33Å |
| 55 | S | 68.1 | Low | 72.8 | Confident | 95 Ų | 95 | 93.4 Ų | 93.4 | 66% | 0.664 | 44% | 0.44 | S | S | * | . | H | α-helix | trans | -62.2 | -41.9 | 176.5 | 174.8 | 0 | 0 | 0 | 0 | 112.5 | I51 | I51-S55 PolarHBondContact O-N 2.86Å |
| 56 | R | 66.4 | Low | 72.3 | Confident | 189 Ų | 189 | 89.4 Ų | 89.4 | 71% | 0.713 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -77.2 | -30.5 | -177 | -176.8 | 176.4 | -86.3 | -166.7 | -7.8 | 113.8 | K52 S53 Y54 | K52-R56 WeakPolarHBondContact O-CB 3.43Å; K52-R56 PolarHBondContact O-N 3.29Å; K52-R56 VanDerWaalsContact O-N 3.07Å; S53-R56 PolarHBondContact O-N 2.84Å; Y54-R56 PolarHBondContact O-N 3.39Å |
| 57 | H | 57.4 | Low | 72.2 | Confident | 95 Ų | 95 | 91.2 Ų | 91.2 | 44% | 0.44 | 43% | 0.433 | S | S | . | . | trans | -115.8 | 84.2 | -175.9 | -60.6 | 80.6 | 0 | 0 | 0 | 110.2 | S53 I59 | S53-H57 WeakPolarHBondContact O-CB 3.43Å; S53-H57 PolarHBondContact O-N 2.81Å; S53-H57 PolarHBondContact O-ND1 3.33Å; H57-I59 PolarHBondContact O-N 2.97Å | ||
| 58 | R | 54.2 | Low | 72.3 | Confident | 241 Ų | 241 | 89.7 Ų | 89.7 | 91% | 0.909 | 42% | 0.424 | S | S | * | . | trans | -66 | 31.9 | 168 | -71.8 | -80.7 | -143.3 | 164.9 | 6.2 | 113.2 | ||||
| 59 | I | 53.4 | Low | 72.3 | Confident | 98 Ų | 98 | 84.1 Ų | 84.1 | 50% | 0.503 | 40% | 0.402 | S | S | . | . | trans | -93.9 | 109.7 | -174.1 | -57.9 | 174.2 | 0 | 0 | 0 | 108.5 | H57 S61 K62 | H57-I59 PolarHBondContact O-N 2.97Å; I59-S61 VanDerWaalsContact CG2-OG 3.3Å; I59-S61 WeakPolarHBondContact CG2-OG 3.35Å; I59-S61 PolarHBondContact O-N 3.06Å; I59-K62 PolarHBondContact O-N 3.05Å | ||
| 60 | K | 56 | Low | 72.5 | Confident | 202 Ų | 202 | 83.4 Ų | 83.4 | 88% | 0.878 | 40% | 0.401 | S | S | * | . | G | 310 helix | trans | -50.4 | -27.1 | -178.5 | -71.1 | -178.4 | 176.3 | 178.2 | 0 | 114.2 | K62 | K60-K62 VanDerWaalsContact C-N 3.33Å; K60-K62 PolarHBondContact O-N 3.41Å |
| 61 | S | 56.4 | Low | 73 | Confident | 83 Ų | 83 | 83 Ų | 83 | 58% | 0.58 | 40% | 0.4 | S | S | * | . | G | 310 helix | trans | -72.4 | -14.6 | -174.5 | 66.8 | 0 | 0 | 0 | 0 | 115.9 | I59 | I59-S61 VanDerWaalsContact CG2-OG 3.3Å; I59-S61 WeakPolarHBondContact CG2-OG 3.35Å; I59-S61 PolarHBondContact O-N 3.06Å |
| 62 | K | 66.6 | Low | 73.6 | Confident | 135 Ų | 135 | 78.3 Ų | 78.3 | 59% | 0.587 | 38% | 0.376 | S | S | * | . | G | 310 helix | trans | -115 | 7.8 | 179.3 | -63 | -174.2 | -179.5 | 178.5 | 0 | 113.8 | I59 K60 S64 L66 | I59-K62 PolarHBondContact O-N 3.05Å; K60-K62 VanDerWaalsContact C-N 3.33Å; K60-K62 PolarHBondContact O-N 3.41Å; K62-S64 PolarHBondContact O-N 2.99Å; K62-L66 HydrophobicContact CB-CD1 4.42Å; K62-L66 WeakPolarHBondContact O-CB 3.46Å; K62-L66 VanDerWaalsContact O-CG 3.26Å; K62-L66 WeakPolarHBondContact O-CG 3.32Å; K62-L66 PolarHBondContact O-N 3.24Å; K62-L66 VanDerWaalsContact O-N 3.12Å |
| 63 | A | 72.7 | Confident | 74.2 | Confident | 40 Ų | 40 | 73 Ų | 73 | 33% | 0.331 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -66.5 | -38.9 | -172.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | L67 | A63-L67 VanDerWaalsContact O-CB 3.31Å; A63-L67 WeakPolarHBondContact O-CB 3.45Å; A63-L67 PolarHBondContact O-N 3.34Å |
| 64 | S | 76.8 | Confident | 75.1 | Confident | 15 Ų | 15 | 74 Ų | 74 | 11% | 0.105 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -66.2 | -53.4 | -179.8 | -54.1 | 0 | 0 | 0 | 0 | 111.7 | K62 L66 L67 F68 E131 M151 | K62-S64 PolarHBondContact O-N 2.99Å; S64-L66 VanDerWaalsContact C-N 3.33Å; S64-L66 PolarHBondContact O-N 3.48Å; S64-L67 WeakPolarHBondContact O-CA 3.33Å; S64-L67 WeakPolarHBondContact O-CB 3.35Å; S64-L67 PolarHBondContact O-N 3.05Å; S64-F68 WeakPolarHBondContact O-CD2 3.3Å; S64-F68 PolarHBondContact O-N 2.9Å; S64-E131 WeakPolarHBondContact CB-OE1 3.09Å; S64-M151 WeakPolarHBondContact OG-CG 3.25Å |
| 65 | F | 79.7 | Confident | 76.3 | Confident | 34 Ų | 34 | 67 Ų | 67 | 15% | 0.149 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -55.4 | -45.2 | 174.9 | 174.3 | -102.9 | 0 | 0 | 0 | 113.1 | L67 F68 A69 M128 E131 R132 Y302 | F65-L67 VanDerWaalsContact C-N 3.29Å; F65-L67 PolarHBondContact O-N 2.99Å; F65-F68 PolarHBondContact O-N 3Å; F65-A69 HydrophobicContact CE1-CB 4.49Å; F65-A69 HydrophobicContact CZ-CB 4.3Å; F65-A69 VanDerWaalsContact O-CB 3.25Å; F65-A69 WeakPolarHBondContact O-CB 3.46Å; F65-A69 PolarHBondContact O-N 2.93Å; F65-M128 HydrophobicContact CD2-CG 4.1Å; F65-M128 HydrophobicContact CD2-SD 4.28Å; F65-M128 HydrophobicContact CE2-CG 4.01Å; F65-M128 HydrophobicContact CE2-SD 3.62Å; F65-E131 VanDerWaalsContact CA-OE1 3.32Å; F65-E131 WeakPolarHBondContact CA-OE1 3.35Å; F65-E131 WeakPolarHBondContact CA-OE2 3.43Å; F65-E131 WeakPolarHBondContact CB-OE1 3.31Å; F65-E131 PolarHBondContact N-OE1 3.42Å; F65-E131 PolarHBondContact N-OE2 3.17Å; F65-R132 VanDerWaalsContact CZ-NH2 3.28Å; F65-Y302 HydrophobicContact CZ-CD1 4.41Å |
| 66 | L | 80.9 | Confident | 77.6 | Confident | 16 Ų | 16 | 62.5 Ų | 62.5 | 8% | 0.084 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -64.7 | -35 | 177.8 | -73 | 173.7 | 0 | 0 | 0 | 111.9 | L50 Y54 K62 S64 S70 | L50-L66 HydrophobicContact CD2-CD2 3.86Å; Y54-L66 HydrophobicContact CD2-CD1 4.33Å; K62-L66 HydrophobicContact CB-CD1 4.42Å; K62-L66 WeakPolarHBondContact O-CB 3.46Å; K62-L66 VanDerWaalsContact O-CG 3.26Å; K62-L66 WeakPolarHBondContact O-CG 3.32Å; K62-L66 PolarHBondContact O-N 3.24Å; K62-L66 VanDerWaalsContact O-N 3.12Å; S64-L66 VanDerWaalsContact C-N 3.33Å; S64-L66 PolarHBondContact O-N 3.48Å; L66-S70 WeakPolarHBondContact O-CB 2.99Å; L66-S70 PolarHBondContact O-N 2.86Å |
| 67 | L | 85.5 | Confident | 78.9 | Confident | 40 Ų | 40 | 54.7 Ų | 54.7 | 21% | 0.209 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -66 | -48 | 176.4 | 177.8 | 147.4 | 0 | 0 | 0 | 111.4 | A63 S64 F65 S70 S71 K152 L155 | A63-L67 VanDerWaalsContact O-CB 3.31Å; A63-L67 WeakPolarHBondContact O-CB 3.45Å; A63-L67 PolarHBondContact O-N 3.34Å; S64-L67 WeakPolarHBondContact O-CA 3.33Å; S64-L67 WeakPolarHBondContact O-CB 3.35Å; S64-L67 PolarHBondContact O-N 3.05Å; F65-L67 VanDerWaalsContact C-N 3.29Å; F65-L67 PolarHBondContact O-N 2.99Å; L67-S70 PolarHBondContact O-N 2.68Å; L67-S71 WeakPolarHBondContact O-CB 3.25Å; L67-S71 PolarHBondContact O-N 2.96Å; L67-S71 PolarHBondContact O-OG 2.69Å; L67-K152 HydrophobicContact CD1-CG 3.99Å; L67-L155 HydrophobicContact CD2-CB 4.29Å; L67-L155 HydrophobicContact CD2-CD2 3.73Å; L67-L155 HydrophobicContact CG-CD2 4.38Å |
| 68 | F | 88.3 | Confident | 80.7 | Confident | 1 Ų | 1 | 53.8 Ų | 53.8 | 0% | 0.004 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -65.9 | -44.2 | 176.4 | -77.6 | -68.4 | 0 | 0 | 0 | 112.4 | S64 F65 S70 S71 L72 L124 A127 M128 E131 M151 L154 L155 | S64-F68 WeakPolarHBondContact O-CD2 3.3Å; S64-F68 PolarHBondContact O-N 2.9Å; F65-F68 PolarHBondContact O-N 3Å; F68-S70 PolarHBondContact O-N 3.47Å; F68-S71 PolarHBondContact O-N 3.25Å; F68-L72 WeakPolarHBondContact O-CB 3.44Å; F68-L72 PolarHBondContact O-N 3.22Å; F68-L124 HydrophobicContact CD1-CD2 4.04Å; F68-L124 HydrophobicContact CE1-CD2 4.46Å; F68-A127 HydrophobicContact CD1-CB 4.45Å; F68-A127 HydrophobicContact CE1-CB 4.09Å; F68-A127 HydrophobicContact CZ-CB 4.44Å; F68-M128 HydrophobicContact CB-CE 4.29Å; F68-E131 WeakPolarHBondContact CD2-OE2 3.26Å; F68-M151 HydrophobicContact CE2-CB 4.3Å; F68-M151 HydrophobicContact CE2-SD 3.74Å; F68-M151 HydrophobicContact CZ-SD 4.46Å; F68-L154 HydrophobicContact CZ-CB 4.28Å; F68-L154 HydrophobicContact CZ-CD2 3.91Å; F68-L154 HydrophobicContact CZ-CG 4.16Å; F68-L155 HydrophobicContact CE1-CB 4.15Å |
| 69 | A | 87.9 | Confident | 82.6 | Confident | 7 Ų | 7 | 42.3 Ų | 42.3 | 6% | 0.058 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -62.6 | -41.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | L50 F65 S71 L72 V73 M128 | L50-A69 HydrophobicContact CD1-CB 4.29Å; L50-A69 HydrophobicContact CD2-CB 4.37Å; F65-A69 HydrophobicContact CE1-CB 4.49Å; F65-A69 HydrophobicContact CZ-CB 4.3Å; F65-A69 VanDerWaalsContact O-CB 3.25Å; F65-A69 WeakPolarHBondContact O-CB 3.46Å; F65-A69 PolarHBondContact O-N 2.93Å; A69-S71 VanDerWaalsContact C-N 3.33Å; A69-L72 PolarHBondContact O-N 3.49Å; A69-V73 WeakPolarHBondContact O-CG2 3.3Å; A69-V73 PolarHBondContact O-N 2.95Å; A69-M128 HydrophobicContact CB-CE 4.25Å |
| 70 | S | 87.8 | Confident | 84.6 | Confident | 36 Ų | 36 | 38.2 Ų | 38.2 | 25% | 0.252 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -64.5 | -40.1 | 175.2 | -171.6 | 0 | 0 | 0 | 0 | 111.5 | L66 L67 F68 T74 | L66-S70 WeakPolarHBondContact O-CB 2.99Å; L66-S70 PolarHBondContact O-N 2.86Å; L67-S70 PolarHBondContact O-N 2.68Å; F68-S70 PolarHBondContact O-N 3.47Å; S70-T74 VanDerWaalsContact O-CB 3.32Å; S70-T74 WeakPolarHBondContact O-CB 3.44Å; S70-T74 PolarHBondContact O-N 3.47Å; S70-T74 PolarHBondContact O-OG1 3.43Å |
| 71 | S | 91.7 | Very high | 86.4 | Confident | 14 Ų | 14 | 32 Ų | 32 | 10% | 0.098 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -68.2 | -39.7 | 179.5 | -56.9 | 0 | 0 | 0 | 0 | 111.8 | L67 F68 A69 T74 T75 L155 | L67-S71 WeakPolarHBondContact O-CB 3.25Å; L67-S71 PolarHBondContact O-N 2.96Å; L67-S71 PolarHBondContact O-OG 2.69Å; F68-S71 PolarHBondContact O-N 3.25Å; A69-S71 VanDerWaalsContact C-N 3.33Å; S71-T74 PolarHBondContact O-N 3.5Å; S71-T75 WeakPolarHBondContact O-CB 3.38Å; S71-T75 PolarHBondContact O-N 3.28Å; S71-T75 PolarHBondContact O-OG1 3.07Å; S71-L155 VanDerWaalsContact OG-CD2 3.24Å; S71-L155 WeakPolarHBondContact OG-CD2 3.47Å |
| 72 | L | 92.6 | Very high | 88.3 | Confident | 3 Ų | 3 | 30.8 Ų | 30.8 | 2% | 0.016 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -59.3 | -56.8 | 173.8 | -179.4 | 66.9 | 0 | 0 | 0 | 110.7 | F68 A69 T74 T75 D76 P121 L124 M128 D298 Y302 | F68-L72 WeakPolarHBondContact O-CB 3.44Å; F68-L72 PolarHBondContact O-N 3.22Å; A69-L72 PolarHBondContact O-N 3.49Å; L72-T74 VanDerWaalsContact C-N 3.27Å; L72-T74 PolarHBondContact O-N 3.47Å; L72-T75 CarbonylContact O-C 3.6Å; L72-T75 WeakPolarHBondContact O-CA 3.37Å; L72-T75 WeakPolarHBondContact O-CB 3.41Å; L72-T75 PolarHBondContact O-N 2.85Å; L72-D76 PolarHBondContact O-N 3.31Å; L72-P121 HydrophobicContact CD1-CB 3.77Å; L72-L124 HydrophobicContact CB-CD1 4.36Å; L72-L124 HydrophobicContact CD1-CB 4.01Å; L72-L124 HydrophobicContact CD1-CD1 4.28Å; L72-M128 HydrophobicContact CD2-CE 3.91Å; L72-D298 HydrophobicContact CD2-CB 4.44Å; L72-Y302 HydrophobicContact CD2-CE2 4.2Å |
| 73 | V | 92.6 | Very high | 89.5 | Confident | 6 Ų | 6 | 25.2 Ų | 25.2 | 4% | 0.036 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -60.2 | -36.8 | 180 | 173.2 | 0 | 0 | 0 | 0 | 112.2 | N43 A46 L47 L50 A69 L77 P299 | N43-V73 HydrophobicContact CB-CG1 3.97Å; N43-V73 WeakPolarHBondContact O-CG1 3.35Å; A46-V73 HydrophobicContact CB-CG1 4.05Å; A46-V73 HydrophobicContact CB-CG2 4.23Å; L47-V73 HydrophobicContact CB-CG1 3.88Å; L50-V73 HydrophobicContact CD1-CB 4.46Å; L50-V73 HydrophobicContact CD1-CG2 4.01Å; A69-V73 WeakPolarHBondContact O-CG2 3.3Å; A69-V73 PolarHBondContact O-N 2.95Å; V73-L77 VanDerWaalsContact O-CB 3.28Å; V73-L77 WeakPolarHBondContact O-CB 3.32Å; V73-L77 PolarHBondContact O-N 3.46Å; V73-P299 HydrophobicContact CG2-CB 4.13Å |
| 74 | T | 93 | Very high | 90.4 | Very high | 51 Ų | 51 | 23.8 Ų | 23.8 | 31% | 0.313 | 13% | 0.134 | S | C | . | . | H | α-helix | trans | -66.6 | -41.4 | 175.1 | -55.5 | 0 | 0 | 0 | 0 | 111.2 | S70 S71 L72 L77 L78 | S70-T74 VanDerWaalsContact O-CB 3.32Å; S70-T74 WeakPolarHBondContact O-CB 3.44Å; S70-T74 PolarHBondContact O-N 3.47Å; S70-T74 PolarHBondContact O-OG1 3.43Å; S71-T74 PolarHBondContact O-N 3.5Å; L72-T74 VanDerWaalsContact C-N 3.27Å; L72-T74 PolarHBondContact O-N 3.47Å; T74-L77 PolarHBondContact O-N 2.71Å; T74-L78 HydrophobicContact CG2-CD1 4.24Å; T74-L78 WeakPolarHBondContact O-CB 3.21Å; T74-L78 VanDerWaalsContact O-CG 3.31Å; T74-L78 WeakPolarHBondContact O-CG 3.47Å; T74-L78 PolarHBondContact O-N 2.72Å |
| 75 | T | 95.1 | Very high | 91.2 | Very high | 5 Ų | 5 | 26.6 Ų | 26.6 | 3% | 0.031 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -64 | -44.8 | 177.3 | -57.7 | 0 | 0 | 0 | 0 | 110.7 | S71 L72 L78 G79 Y117 P121 W159 | S71-T75 WeakPolarHBondContact O-CB 3.38Å; S71-T75 PolarHBondContact O-N 3.28Å; S71-T75 PolarHBondContact O-OG1 3.07Å; L72-T75 CarbonylContact O-C 3.6Å; L72-T75 WeakPolarHBondContact O-CA 3.37Å; L72-T75 WeakPolarHBondContact O-CB 3.41Å; L72-T75 PolarHBondContact O-N 2.85Å; T75-L78 PolarHBondContact O-N 2.99Å; T75-G79 PolarHBondContact O-N 3.12Å; T75-Y117 HydrophobicContact CG2-CD1 3.81Å; T75-Y117 HydrophobicContact CG2-CE1 4.19Å; T75-Y117 VanDerWaalsContact O-CD1 3.27Å; T75-Y117 WeakPolarHBondContact O-CD1 3.39Å; T75-Y117 WeakPolarHBondContact O-CE1 3.3Å; T75-P121 HydrophobicContact CG2-CG 4.42Å; T75-W159 PolarHBondContact OG1-NE1 3.4Å |
| 76 | D | 94.4 | Very high | 91.8 | Very high | 1 Ų | 1 | 26.4 Ų | 26.4 | 1% | 0.005 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -65.3 | -42.2 | 178.3 | -65.7 | -22.7 | 0 | 0 | 0 | 111.7 | L72 G79 H80 P121 Q295 | L72-D76 PolarHBondContact O-N 3.31Å; D76-G79 PolarHBondContact O-N 3.37Å; D76-H80 PolarHBondContact O-CD2 2.74Å; D76-H80 PolarHBondContact O-N 3.37Å; D76-P121 VanDerWaalsContact OD1-CG 3.25Å; D76-P121 WeakPolarHBondContact OD1-CG 3.3Å; D76-Q295 HydrophobicContact CB-CB 4.14Å |
| 77 | L | 94.6 | Very high | 92.3 | Very high | 25 Ų | 25 | 27 Ų | 27 | 13% | 0.131 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -60.2 | -48.6 | 175.1 | -179.6 | 60.9 | 0 | 0 | 0 | 111.6 | I40 N43 L47 V73 T74 G79 H80 L81 | I40-L77 HydrophobicContact CB-CD1 4.4Å; I40-L77 HydrophobicContact CG1-CD1 4.5Å; I40-L77 HydrophobicContact CG2-CD1 4.09Å; N43-L77 HydrophobicContact CB-CB 4Å; N43-L77 HydrophobicContact CB-CD1 4.34Å; L47-L77 HydrophobicContact CD2-CD2 4.45Å; V73-L77 VanDerWaalsContact O-CB 3.28Å; V73-L77 WeakPolarHBondContact O-CB 3.32Å; V73-L77 PolarHBondContact O-N 3.46Å; T74-L77 PolarHBondContact O-N 2.71Å; L77-G79 VanDerWaalsContact C-N 3.29Å; L77-G79 PolarHBondContact O-N 3.05Å; L77-H80 PolarHBondContact O-N 3.17Å; L77-L81 HydrophobicContact CD1-CD1 4.2Å; L77-L81 HydrophobicContact CD1-CG 4.38Å; L77-L81 HydrophobicContact CG-CD1 4.03Å; L77-L81 WeakPolarHBondContact O-CB 3.48Å; L77-L81 VanDerWaalsContact O-CG 3.31Å; L77-L81 WeakPolarHBondContact O-CG 3.27Å; L77-L81 PolarHBondContact O-N 3.16Å |
| 78 | L | 95.4 | Very high | 92.6 | Very high | 76 Ų | 76 | 30 Ų | 30 | 40% | 0.398 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -63 | -38.3 | 176.7 | -71.9 | 174.7 | 0 | 0 | 0 | 111.4 | T74 T75 L81 I82 Y117 | T74-L78 HydrophobicContact CG2-CD1 4.24Å; T74-L78 WeakPolarHBondContact O-CB 3.21Å; T74-L78 VanDerWaalsContact O-CG 3.31Å; T74-L78 WeakPolarHBondContact O-CG 3.47Å; T74-L78 PolarHBondContact O-N 2.72Å; T75-L78 PolarHBondContact O-N 2.99Å; L78-L81 PolarHBondContact O-N 3.31Å; L78-I82 HydrophobicContact CB-CD1 4.39Å; L78-I82 WeakPolarHBondContact O-CB 3.34Å; L78-I82 WeakPolarHBondContact O-CG1 3.06Å; L78-I82 PolarHBondContact O-N 2.86Å; L78-Y117 HydrophobicContact CB-CE1 3.75Å |
| 79 | G | 94.4 | Very high | 92.7 | Very high | 1 Ų | 1 | 33.6 Ų | 33.6 | 1% | 0.01 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -59.5 | -48.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 112.4 | T75 D76 L77 N83 Y117 | T75-G79 PolarHBondContact O-N 3.12Å; D76-G79 PolarHBondContact O-N 3.37Å; L77-G79 VanDerWaalsContact C-N 3.29Å; L77-G79 PolarHBondContact O-N 3.05Å; G79-N83 WeakPolarHBondContact O-CB 3.3Å; G79-N83 PolarHBondContact O-N 3.47Å; G79-Y117 VanDerWaalsContact CA-CG 3.41Å |
| 80 | H | 93.6 | Very high | 92.8 | Very high | 11 Ų | 11 | 33.3 Ų | 33.3 | 5% | 0.051 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -64.3 | -40 | 175.7 | -74.5 | -61.1 | 0 | 0 | 0 | 112.8 | I40 D76 L77 G84 | I40-H80 HydrophobicContact CG1-CB 3.93Å; D76-H80 PolarHBondContact O-CD2 2.74Å; D76-H80 PolarHBondContact O-N 3.37Å; L77-H80 PolarHBondContact O-N 3.17Å; H80-G84 WeakPolarHBondContact O-CA 3.24Å; H80-G84 PolarHBondContact O-N 3.45Å |
| 81 | L | 94.6 | Very high | 92.9 | Very high | 71 Ų | 71 | 33.1 Ų | 33.1 | 37% | 0.372 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -67.7 | -49.8 | 179.4 | -72.8 | 171.2 | 0 | 0 | 0 | 111.9 | I40 L77 L78 S85 | I40-L81 HydrophobicContact CD1-CD2 3.73Å; I40-L81 HydrophobicContact CD1-CG 4.5Å; I40-L81 HydrophobicContact CG1-CD2 4.03Å; I40-L81 HydrophobicContact CG1-CG 4.37Å; I40-L81 HydrophobicContact CG2-CD2 4.47Å; L77-L81 HydrophobicContact CD1-CD1 4.2Å; L77-L81 HydrophobicContact CD1-CG 4.38Å; L77-L81 HydrophobicContact CG-CD1 4.03Å; L77-L81 WeakPolarHBondContact O-CB 3.48Å; L77-L81 VanDerWaalsContact O-CG 3.31Å; L77-L81 WeakPolarHBondContact O-CG 3.27Å; L77-L81 PolarHBondContact O-N 3.16Å; L78-L81 PolarHBondContact O-N 3.31Å; L81-S85 WeakPolarHBondContact O-CB 3.42Å; L81-S85 PolarHBondContact O-N 3.39Å; L81-S85 PolarHBondContact O-OG 2.98Å |
| 82 | I | 95.5 | Very high | 92.7 | Very high | 59 Ų | 59 | 42 Ų | 42 | 30% | 0.303 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -74.4 | -54.8 | -174.7 | -68.7 | 161.1 | 0 | 0 | 0 | 110.4 | L78 G84 S85 L86 C113 Y117 | L78-I82 HydrophobicContact CB-CD1 4.39Å; L78-I82 WeakPolarHBondContact O-CB 3.34Å; L78-I82 WeakPolarHBondContact O-CG1 3.06Å; L78-I82 PolarHBondContact O-N 2.86Å; I82-G84 VanDerWaalsContact C-N 3.28Å; I82-G84 PolarHBondContact O-N 3.15Å; I82-S85 PolarHBondContact O-N 2.88Å; I82-L86 HydrophobicContact CG2-CD1 4.06Å; I82-L86 WeakPolarHBondContact O-CG 3.48Å; I82-L86 PolarHBondContact O-N 3.35Å; I82-C113 HydrophobicContact CG2-CB 4.13Å; I82-Y117 HydrophobicContact CB-CE2 4.22Å; I82-Y117 HydrophobicContact CD1-CE2 3.92Å; I82-Y117 WeakPolarHBondContact CD1-OH 3.07Å; I82-Y117 HydrophobicContact CG2-CE2 4.41Å |
| 83 | N | 93.3 | Very high | 92.6 | Very high | 18 Ų | 18 | 45.5 Ų | 45.5 | 10% | 0.096 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -64.6 | -38.1 | 179.2 | -63.7 | -24.2 | 0 | 0 | 0 | 110.6 | G79 L86 V87 F110 C113 M114 | G79-N83 WeakPolarHBondContact O-CB 3.3Å; G79-N83 PolarHBondContact O-N 3.47Å; N83-L86 PolarHBondContact O-N 2.93Å; N83-V87 WeakPolarHBondContact O-CB 3.42Å; N83-V87 WeakPolarHBondContact O-CG2 3.34Å; N83-V87 PolarHBondContact O-N 3.36Å; N83-F110 HydrophobicContact CB-CE2 4.13Å; N83-C113 WeakPolarHBondContact OD1-CB 3.33Å; N83-M114 HydrophobicContact CB-SD 4.29Å |
| 84 | G | 91.3 | Very high | 92.3 | Very high | 9 Ų | 9 | 52.6 Ų | 52.6 | 9% | 0.093 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -62.9 | -43.1 | 176 | 0 | 0 | 0 | 0 | 0 | 113.5 | M36 H80 I82 V87 L88 | M36-G84 VanDerWaalsContact SD-C 3.56Å; M36-G84 WeakPolarHBondContact SD-CA 3.35Å; H80-G84 WeakPolarHBondContact O-CA 3.24Å; H80-G84 PolarHBondContact O-N 3.45Å; I82-G84 VanDerWaalsContact C-N 3.28Å; I82-G84 PolarHBondContact O-N 3.15Å; G84-V87 PolarHBondContact O-N 3.33Å; G84-L88 WeakPolarHBondContact O-CB 3.46Å; G84-L88 PolarHBondContact O-N 2.95Å |
| 85 | S | 92.4 | Very high | 91.9 | Very high | 75 Ų | 75 | 52.2 Ų | 52.2 | 52% | 0.524 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -63.8 | -41.5 | 175.4 | -62.1 | 0 | 0 | 0 | 0 | 111.9 | L81 I82 L88 H89 | L81-S85 WeakPolarHBondContact O-CB 3.42Å; L81-S85 PolarHBondContact O-N 3.39Å; L81-S85 PolarHBondContact O-OG 2.98Å; I82-S85 PolarHBondContact O-N 2.88Å; S85-L88 PolarHBondContact O-N 3.48Å; S85-H89 WeakPolarHBondContact O-CB 3.2Å; S85-H89 PolarHBondContact O-N 3.37Å |
| 86 | L | 93.4 | Very high | 91.6 | Very high | 29 Ų | 29 | 57.9 Ų | 57.9 | 15% | 0.152 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -64 | -43.7 | 175.8 | -69.8 | 167.6 | 0 | 0 | 0 | 111.5 | I82 N83 L88 H89 V90 V106 F110 | I82-L86 HydrophobicContact CG2-CD1 4.06Å; I82-L86 WeakPolarHBondContact O-CG 3.48Å; I82-L86 PolarHBondContact O-N 3.35Å; N83-L86 PolarHBondContact O-N 2.93Å; L86-L88 PolarHBondContact O-N 3.47Å; L86-H89 WeakPolarHBondContact O-CB 3.29Å; L86-H89 PolarHBondContact O-N 3.4Å; L86-V90 WeakPolarHBondContact O-CG2 3.45Å; L86-V90 PolarHBondContact O-N 3.37Å; L86-V106 HydrophobicContact CD2-CG1 4.27Å; L86-F110 HydrophobicContact CB-CD1 4.16Å; L86-F110 HydrophobicContact CB-CD2 4.04Å; L86-F110 HydrophobicContact CB-CE1 4.36Å; L86-F110 HydrophobicContact CB-CE2 4.31Å; L86-F110 HydrophobicContact CB-CG 4.03Å; L86-F110 HydrophobicContact CB-CZ 4.49Å; L86-F110 HydrophobicContact CD1-CB 3.9Å; L86-F110 HydrophobicContact CD1-CD2 3.75Å; L86-F110 HydrophobicContact CD1-CG 3.94Å |
| 87 | V | 91.5 | Very high | 91.3 | Very high | 30 Ų | 30 | 58.7 Ų | 58.7 | 18% | 0.182 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -59.2 | -47.2 | 174.4 | 169.1 | 0 | 0 | 0 | 0 | 110.9 | N83 G84 H89 V90 Y91 F110 | N83-V87 WeakPolarHBondContact O-CB 3.42Å; N83-V87 WeakPolarHBondContact O-CG2 3.34Å; N83-V87 PolarHBondContact O-N 3.36Å; G84-V87 PolarHBondContact O-N 3.33Å; V87-H89 VanDerWaalsContact C-N 3.29Å; V87-H89 PolarHBondContact O-N 2.93Å; V87-V90 PolarHBondContact O-N 3.23Å; V87-Y91 HydrophobicContact CG1-CD2 3.51Å; V87-Y91 HydrophobicContact CG1-CE2 3.39Å; V87-Y91 WeakPolarHBondContact O-CD2 3.27Å; V87-Y91 PolarHBondContact O-N 2.85Å; V87-F110 HydrophobicContact CG2-CE1 4.07Å; V87-F110 HydrophobicContact CG2-CE2 4.27Å; V87-F110 HydrophobicContact CG2-CZ 3.42Å; V87-F110 VanDerWaalsContact CG2-CZ 3.42Å |
| 88 | L | 90.3 | Very high | 91 | Very high | 102 Ų | 102 | 64 Ų | 64 | 53% | 0.534 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -62.1 | -38.4 | 178.1 | -176.1 | 61.8 | 0 | 0 | 0 | 111.8 | G84 S85 L86 Y91 R92 | G84-L88 WeakPolarHBondContact O-CB 3.46Å; G84-L88 PolarHBondContact O-N 2.95Å; S85-L88 PolarHBondContact O-N 3.48Å; L86-L88 PolarHBondContact O-N 3.47Å; L88-Y91 PolarHBondContact O-N 3.04Å; L88-R92 WeakPolarHBondContact O-CB 3.4Å; L88-R92 PolarHBondContact O-N 2.87Å |
| 89 | H | 91.1 | Very high | 90.6 | Very high | 76 Ų | 76 | 64.7 Ų | 64.7 | 35% | 0.352 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -60.7 | -49.1 | 174.5 | -172 | 86.9 | 0 | 0 | 0 | 111.6 | S85 L86 V87 Y91 R92 F93 F100 | S85-H89 WeakPolarHBondContact O-CB 3.2Å; S85-H89 PolarHBondContact O-N 3.37Å; L86-H89 WeakPolarHBondContact O-CB 3.29Å; L86-H89 PolarHBondContact O-N 3.4Å; V87-H89 VanDerWaalsContact C-N 3.29Å; V87-H89 PolarHBondContact O-N 2.93Å; H89-Y91 VanDerWaalsContact C-N 3.26Å; H89-Y91 PolarHBondContact O-N 3.11Å; H89-R92 WeakPolarHBondContact O-CB 3.02Å; H89-R92 PolarHBondContact O-N 2.97Å; H89-R92 VanDerWaalsContact O-N 3.17Å; H89-F93 AromaticContact CE1-CE2 3.46Å; H89-F93 VanDerWaalsContact CE1-CE2 3.46Å; H89-F93 WeakPolarHBondContact CE1-CE2 3.48Å; H89-F93 AromaticContact ND1-CE2 3.98Å; H89-F93 AromaticContact NE2-CD2 3.85Å; H89-F93 AromaticContact NE2-CE2 3.56Å; H89-F93 WeakPolarHBondContact O-CD2 3.24Å; H89-F93 PolarHBondContact O-N 3.44Å; H89-F100 AromaticContact NE2-CD2 3.79Å |
| 90 | V | 91.2 | Very high | 90.4 | Very high | 1 Ų | 1 | 66.3 Ų | 66.3 | 1% | 0.006 | 32% | 0.324 | C | S | . | . | H | α-helix | trans | -58.7 | -39.7 | 176.2 | 174.2 | 0 | 0 | 0 | 0 | 111.6 | L86 V87 F93 R95 W97 F100 R182 | L86-V90 WeakPolarHBondContact O-CG2 3.45Å; L86-V90 PolarHBondContact O-N 3.37Å; V87-V90 PolarHBondContact O-N 3.23Å; V90-F93 PolarHBondContact O-N 2.89Å; V90-R95 HydrophobicContact CG1-CB 4.5Å; V90-R95 HydrophobicContact CG1-CG 4.24Å; V90-R95 PolarHBondContact O-N 3.15Å; V90-W97 HydrophobicContact CB-CZ2 4.22Å; V90-W97 HydrophobicContact CG1-CZ2 3.68Å; V90-W97 HydrophobicContact CG2-CH2 3.43Å; V90-W97 VanDerWaalsContact CG2-CH2 3.43Å; V90-W97 HydrophobicContact CG2-CZ2 3.39Å; V90-W97 HydrophobicContact CG2-CZ3 4.27Å; V90-F100 HydrophobicContact CG2-CZ 4.09Å; V90-R182 WeakPolarHBondContact CG1-O 3.36Å |
| 91 | Y | 88.3 | Confident | 90.4 | Very high | 33 Ų | 33 | 66.5 Ų | 66.5 | 13% | 0.129 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -67.9 | -39 | 177.2 | -83.9 | -61.4 | 0 | 0 | 0 | 113.4 | V29 V87 L88 H89 F93 H94 R95 | V29-Y91 HydrophobicContact CB-CE1 4.27Å; V29-Y91 HydrophobicContact CG2-CD1 3.64Å; V29-Y91 HydrophobicContact CG2-CE1 3.2Å; V29-Y91 HydrophobicContact CG2-CE2 4.48Å; V29-Y91 HydrophobicContact CG2-CG 4.43Å; V87-Y91 HydrophobicContact CG1-CD2 3.51Å; V87-Y91 HydrophobicContact CG1-CE2 3.39Å; V87-Y91 WeakPolarHBondContact O-CD2 3.27Å; V87-Y91 PolarHBondContact O-N 2.85Å; L88-Y91 PolarHBondContact O-N 3.04Å; H89-Y91 VanDerWaalsContact C-N 3.26Å; H89-Y91 PolarHBondContact O-N 3.11Å; Y91-F93 PolarHBondContact O-N 2.98Å; Y91-H94 PolarHBondContact O-N 3.41Å; Y91-R95 HydrophobicContact CD1-CG 4.49Å; Y91-R95 PolarHBondContact OH-NH2 3.18Å |
| 92 | R | 89.2 | Confident | 90.1 | Very high | 200 Ų | 200 | 67.8 Ų | 67.8 | 76% | 0.755 | 34% | 0.338 | S | S | * | . | H | α-helix | trans | -59.1 | -35.8 | 175.7 | -179 | 179.2 | 176.1 | 145.5 | 0.4 | 112 | L88 H89 H94 | L88-R92 WeakPolarHBondContact O-CB 3.4Å; L88-R92 PolarHBondContact O-N 2.87Å; H89-R92 WeakPolarHBondContact O-CB 3.02Å; H89-R92 PolarHBondContact O-N 2.97Å; H89-R92 VanDerWaalsContact O-N 3.17Å; R92-H94 VanDerWaalsContact C-N 3.27Å; R92-H94 PolarHBondContact O-N 2.91Å |
| 93 | F | 88.7 | Confident | 89.7 | Confident | 76 Ų | 76 | 72.4 Ų | 72.4 | 33% | 0.333 | 36% | 0.358 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -89.9 | 21.7 | 176 | -70.6 | -77.9 | 0 | 0 | 0 | 113.6 | H89 V90 Y91 R95 K96 F100 | H89-F93 AromaticContact CE1-CE2 3.46Å; H89-F93 VanDerWaalsContact CE1-CE2 3.46Å; H89-F93 WeakPolarHBondContact CE1-CE2 3.48Å; H89-F93 AromaticContact ND1-CE2 3.98Å; H89-F93 AromaticContact NE2-CD2 3.85Å; H89-F93 AromaticContact NE2-CE2 3.56Å; H89-F93 WeakPolarHBondContact O-CD2 3.24Å; H89-F93 PolarHBondContact O-N 3.44Å; V90-F93 PolarHBondContact O-N 2.89Å; Y91-F93 PolarHBondContact O-N 2.98Å; F93-R95 PolarHBondContact O-N 3.01Å; F93-K96 WeakPolarHBondContact O-CB 3.28Å; F93-K96 PolarHBondContact O-N 3.49Å; F93-F100 HydrophobicContact CB-CD1 3.5Å; F93-F100 HydrophobicContact CB-CE1 3.89Å; F93-F100 HydrophobicContact CB-CG 4.3Å; F93-F100 HydrophobicContact CD1-CB 4.23Å; F93-F100 HydrophobicContact CD1-CD1 4.48Å; F93-F100 HydrophobicContact CD2-CB 4.17Å; F93-F100 HydrophobicContact CD2-CD1 4.1Å; F93-F100 HydrophobicContact CD2-CG 4.06Å; F93-F100 HydrophobicContact CE1-CB 4.4Å; F93-F100 HydrophobicContact CE2-CB 4.37Å; F93-F100 HydrophobicContact CG-CB 4.12Å; F93-F100 AromaticContact CG-CD1 3.79Å; F93-F100 HydrophobicContact CG-CD1 3.79Å; F93-F100 HydrophobicContact CG-CG 4.1Å; F93-F100 HydrophobicContact CZ-CB 4.47Å |
| 94 | H | 85.9 | Confident | 89.6 | Confident | 156 Ų | 156 | 72.8 Ų | 72.8 | 72% | 0.722 | 37% | 0.366 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 52.3 | 30.8 | 177.9 | -57.4 | -75.9 | 0 | 0 | 0 | 114.1 | Y91 R92 K96 | Y91-H94 PolarHBondContact O-N 3.41Å; R92-H94 VanDerWaalsContact C-N 3.27Å; R92-H94 PolarHBondContact O-N 2.91Å; H94-K96 PolarHBondContact O-N 3.34Å |
| 95 | R | 85.3 | Confident | 89.7 | Confident | 43 Ų | 43 | 77.1 Ų | 77.1 | 16% | 0.162 | 39% | 0.386 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 60.6 | 23.6 | -177.6 | -51 | 177.7 | -178.7 | 172.6 | 0.5 | 114.3 | V90 Y91 F93 W97 S181 R182 | V90-R95 HydrophobicContact CG1-CB 4.5Å; V90-R95 HydrophobicContact CG1-CG 4.24Å; V90-R95 PolarHBondContact O-N 3.15Å; Y91-R95 HydrophobicContact CD1-CG 4.49Å; Y91-R95 PolarHBondContact OH-NH2 3.18Å; F93-R95 PolarHBondContact O-N 3.01Å; R95-W97 PolarHBondContact O-N 3.27Å; R95-S181 PolarHBondContact NH1-O 3.48Å; R95-R182 HydrophobicContact CB-CB 4.01Å; R95-R182 WeakPolarHBondContact CB-O 3.31Å |
| 96 | K | 88.3 | Confident | 89.8 | Confident | 124 Ų | 124 | 75.2 Ų | 75.2 | 54% | 0.539 | 37% | 0.371 | S | S | . | . | trans | -89.9 | 76.3 | 176.6 | -65.8 | -174.8 | 178.7 | -179.2 | 0 | 111 | F93 H94 D98 T99 F100 | F93-K96 WeakPolarHBondContact O-CB 3.28Å; F93-K96 PolarHBondContact O-N 3.49Å; H94-K96 PolarHBondContact O-N 3.34Å; K96-D98 PolarHBondContact O-N 3.34Å; K96-T99 HydrophobicContact CB-CG2 4Å; K96-T99 HydrophobicContact CD-CG2 4.41Å; K96-T99 PolarHBondContact O-N 3.12Å; K96-T99 PolarHBondContact O-OG1 3.17Å; K96-F100 VanDerWaalsContact O-CD1 3.31Å; K96-F100 WeakPolarHBondContact O-CD1 3.43Å | ||
| 97 | W | 89.9 | Confident | 89.8 | Confident | 18 Ų | 18 | 74 Ų | 74 | 7% | 0.068 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -53.5 | -36.3 | -177.6 | -70 | 86.3 | 0 | 0 | 0 | 114 | V90 R95 T99 F100 D101 C107 F110 V178 R182 C185 | V90-W97 HydrophobicContact CB-CZ2 4.22Å; V90-W97 HydrophobicContact CG1-CZ2 3.68Å; V90-W97 HydrophobicContact CG2-CH2 3.43Å; V90-W97 VanDerWaalsContact CG2-CH2 3.43Å; V90-W97 HydrophobicContact CG2-CZ2 3.39Å; V90-W97 HydrophobicContact CG2-CZ3 4.27Å; R95-W97 PolarHBondContact O-N 3.27Å; W97-T99 PolarHBondContact O-N 3.19Å; W97-F100 HydrophobicContact CD2-CE1 4.25Å; W97-F100 AromaticContact CD2-CZ 3.67Å; W97-F100 HydrophobicContact CD2-CZ 3.67Å; W97-F100 HydrophobicContact CE3-CE1 4.36Å; W97-F100 AromaticContact CE3-CE2 3.86Å; W97-F100 HydrophobicContact CE3-CE2 3.86Å; W97-F100 AromaticContact CE3-CZ 3.44Å; W97-F100 HydrophobicContact CE3-CZ 3.44Å; W97-F100 VanDerWaalsContact CE3-CZ 3.44Å; W97-F100 HydrophobicContact CG-CE1 4.35Å; W97-F100 HydrophobicContact CG-CZ 4.23Å; W97-F100 HydrophobicContact CH2-CZ 4.31Å; W97-F100 AromaticContact CZ3-CE2 3.96Å; W97-F100 HydrophobicContact CZ3-CE2 3.96Å; W97-F100 AromaticContact CZ3-CZ 3.78Å; W97-F100 HydrophobicContact CZ3-CZ 3.78Å; W97-F100 PolarHBondContact O-N 3.09Å; W97-D101 HydrophobicContact CE3-CB 4.23Å; W97-D101 PolarHBondContact O-N 3.47Å; W97-C107 HydrophobicContact CE3-CB 4.25Å; W97-C107 HydrophobicContact CH2-CB 4.47Å; W97-C107 HydrophobicContact CZ3-CB 3.77Å; W97-F110 HydrophobicContact CH2-CD1 4.2Å; W97-V178 HydrophobicContact CB-CG2 4.32Å; W97-V178 HydrophobicContact CD2-CG1 4.18Å; W97-V178 HydrophobicContact CD2-CG2 3.48Å; W97-V178 VanDerWaalsContact CD2-CG2 3.48Å; W97-V178 HydrophobicContact CE3-CG2 3.78Å; W97-V178 HydrophobicContact CG-CG1 4.08Å; W97-V178 HydrophobicContact CG-CG2 3.73Å; W97-V178 HydrophobicContact CZ2-CG1 4.43Å; W97-V178 HydrophobicContact CZ2-CG2 4.33Å; W97-V178 HydrophobicContact CZ3-CG2 4.32Å; W97-R182 PolarHBondContact NE1-O 2.94Å; W97-C185 WeakPolarHBondContact CH2-SG 3.38Å |
| 98 | D | 87 | Confident | 90 | Very high | 135 Ų | 135 | 73.6 Ų | 73.6 | 72% | 0.722 | 36% | 0.364 | S | S | * | . | H | α-helix | trans | -59.7 | -21.5 | 178.2 | -47.4 | -58.4 | 0 | 0 | 0 | 113.6 | K96 | K96-D98 PolarHBondContact O-N 3.34Å |
| 99 | T | 87.6 | Confident | 90.3 | Very high | 92 Ų | 92 | 73 Ų | 73 | 56% | 0.564 | 36% | 0.36 | S | S | * | . | H | α-helix | trans | -89.5 | -30.8 | -175.1 | 61.3 | 0 | 0 | 0 | 0 | 114.1 | K96 W97 | K96-T99 HydrophobicContact CB-CG2 4Å; K96-T99 HydrophobicContact CD-CG2 4.41Å; K96-T99 PolarHBondContact O-N 3.12Å; K96-T99 PolarHBondContact O-OG1 3.17Å; W97-T99 PolarHBondContact O-N 3.19Å |
| 100 | F | 90.7 | Very high | 90.5 | Very high | 34 Ų | 34 | 69.4 Ų | 69.4 | 15% | 0.149 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -120.3 | -15.4 | -173.2 | 72.8 | -92.9 | 0 | 0 | 0 | 113.8 | H89 V90 F93 K96 W97 P102 V106 | H89-F100 AromaticContact NE2-CD2 3.79Å; V90-F100 HydrophobicContact CG2-CZ 4.09Å; F93-F100 HydrophobicContact CB-CD1 3.5Å; F93-F100 HydrophobicContact CB-CE1 3.89Å; F93-F100 HydrophobicContact CB-CG 4.3Å; F93-F100 HydrophobicContact CD1-CB 4.23Å; F93-F100 HydrophobicContact CD1-CD1 4.48Å; F93-F100 HydrophobicContact CD2-CB 4.17Å; F93-F100 HydrophobicContact CD2-CD1 4.1Å; F93-F100 HydrophobicContact CD2-CG 4.06Å; F93-F100 HydrophobicContact CE1-CB 4.4Å; F93-F100 HydrophobicContact CE2-CB 4.37Å; F93-F100 HydrophobicContact CG-CB 4.12Å; F93-F100 AromaticContact CG-CD1 3.79Å; F93-F100 HydrophobicContact CG-CD1 3.79Å; F93-F100 HydrophobicContact CG-CG 4.1Å; F93-F100 HydrophobicContact CZ-CB 4.47Å; K96-F100 VanDerWaalsContact O-CD1 3.31Å; K96-F100 WeakPolarHBondContact O-CD1 3.43Å; W97-F100 HydrophobicContact CD2-CE1 4.25Å; W97-F100 AromaticContact CD2-CZ 3.67Å; W97-F100 HydrophobicContact CD2-CZ 3.67Å; W97-F100 HydrophobicContact CE3-CE1 4.36Å; W97-F100 AromaticContact CE3-CE2 3.86Å; W97-F100 HydrophobicContact CE3-CE2 3.86Å; W97-F100 AromaticContact CE3-CZ 3.44Å; W97-F100 HydrophobicContact CE3-CZ 3.44Å; W97-F100 VanDerWaalsContact CE3-CZ 3.44Å; W97-F100 HydrophobicContact CG-CE1 4.35Å; W97-F100 HydrophobicContact CG-CZ 4.23Å; W97-F100 HydrophobicContact CH2-CZ 4.31Å; W97-F100 AromaticContact CZ3-CE2 3.96Å; W97-F100 HydrophobicContact CZ3-CE2 3.96Å; W97-F100 AromaticContact CZ3-CZ 3.78Å; W97-F100 HydrophobicContact CZ3-CZ 3.78Å; W97-F100 PolarHBondContact O-N 3.09Å; F100-P102 VanDerWaalsContact C-CD 3.5Å; F100-V106 HydrophobicContact CE2-CB 4.36Å; F100-V106 HydrophobicContact CE2-CG1 4.13Å |
| 101 | D | 92.3 | Very high | 90.7 | Very high | 16 Ų | 16 | 69.3 Ų | 69.3 | 9% | 0.086 | 34% | 0.343 | C | S | . | . | trans | -133.5 | 58.7 | 179.7 | -167.9 | 28.5 | 0 | 0 | 0 | 112.3 | W97 H103 G104 I105 V106 C107 | W97-D101 HydrophobicContact CE3-CB 4.23Å; W97-D101 PolarHBondContact O-N 3.47Å; D101-H103 PolarHBondContact O-N 2.7Å; D101-H103 VanDerWaalsContact O-N 3.13Å; D101-G104 PolarHBondContact O-N 2.93Å; D101-G104 WeakPolarHBondContact OD1-CA 3.45Å; D101-G104 PolarHBondContact OD1-N 2.98Å; D101-G104 VanDerWaalsContact OD1-N 3.17Å; D101-G104 VanDerWaalsContact OD2-C 3.31Å; D101-G104 VanDerWaalsContact OD2-CA 3.26Å; D101-G104 WeakPolarHBondContact OD2-CA 3.43Å; D101-I105 PolarHBondContact OD1-N 3.32Å; D101-V106 HydrophobicContact CB-CB 4.09Å; D101-V106 HydrophobicContact CB-CG2 4.22Å; D101-V106 PolarHBondContact OD1-N 3.48Å; D101-V106 PolarHBondContact OD2-N 3.35Å; D101-C107 WeakPolarHBondContact OD2-CB 3.21Å; D101-C107 PolarHBondContact OD2-N 2.84Å | ||
| 102 | P | 88.5 | Confident | 91.2 | Very high | 97 Ų | 97 | 69 Ų | 69 | 63% | 0.63 | 34% | 0.344 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -63.6 | -20.3 | -178.7 | 28 | -35.9 | 0 | 0 | 0 | 113.2 | F100 | F100-P102 VanDerWaalsContact C-CD 3.5Š|
| 103 | H | 88.4 | Confident | 91.5 | Very high | 157 Ų | 157 | 60.5 Ų | 60.5 | 73% | 0.727 | 32% | 0.315 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -101.6 | -0.6 | -179.4 | -59.6 | -59.5 | 0 | 0 | 0 | 113.8 | D101 I105 | D101-H103 PolarHBondContact O-N 2.7Å; D101-H103 VanDerWaalsContact O-N 3.13Å; H103-I105 HydrophobicContact CB-CD1 3.91Å; H103-I105 HydrophobicContact CB-CG1 3.92Å; H103-I105 PolarHBondContact O-N 3.37Å |
| 104 | G | 90.5 | Very high | 91.9 | Very high | 25 Ų | 25 | 58.4 Ų | 58.4 | 26% | 0.258 | 31% | 0.307 | S | S | . | . | S | Bend | trans | 67.3 | 17 | 179.9 | 0 | 0 | 0 | 0 | 0 | 115.2 | D101 S108 | D101-G104 PolarHBondContact O-N 2.93Å; D101-G104 WeakPolarHBondContact OD1-CA 3.45Å; D101-G104 PolarHBondContact OD1-N 2.98Å; D101-G104 VanDerWaalsContact OD1-N 3.17Å; D101-G104 VanDerWaalsContact OD2-C 3.31Å; D101-G104 VanDerWaalsContact OD2-CA 3.26Å; D101-G104 WeakPolarHBondContact OD2-CA 3.43Å; G104-S108 WeakPolarHBondContact O-CB 3.33Å; G104-S108 PolarHBondContact O-N 3.29Å; G104-S108 PolarHBondContact O-OG 3.06Å |
| 105 | I | 92.6 | Very high | 92.4 | Very high | 101 Ų | 101 | 51 Ų | 51 | 52% | 0.518 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -73.8 | -45.4 | -177 | -62.1 | 171.7 | 0 | 0 | 0 | 109.8 | D101 H103 C107 S108 I109 | D101-I105 PolarHBondContact OD1-N 3.32Å; H103-I105 HydrophobicContact CB-CD1 3.91Å; H103-I105 HydrophobicContact CB-CG1 3.92Å; H103-I105 PolarHBondContact O-N 3.37Å; I105-C107 VanDerWaalsContact C-N 3.32Å; I105-C107 PolarHBondContact O-N 2.88Å; I105-S108 PolarHBondContact O-N 2.95Å; I105-I109 HydrophobicContact CG2-CD1 3.96Å; I105-I109 WeakPolarHBondContact O-CG1 3.44Å; I105-I109 PolarHBondContact O-N 2.91Å |
| 106 | V | 94.2 | Very high | 93 | Very high | 34 Ų | 34 | 51 Ų | 51 | 21% | 0.206 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -64.8 | -42 | -179.6 | -177.7 | 0 | 0 | 0 | 0 | 109.8 | L86 F100 D101 I109 F110 | L86-V106 HydrophobicContact CD2-CG1 4.27Å; F100-V106 HydrophobicContact CE2-CB 4.36Å; F100-V106 HydrophobicContact CE2-CG1 4.13Å; D101-V106 HydrophobicContact CB-CB 4.09Å; D101-V106 HydrophobicContact CB-CG2 4.22Å; D101-V106 PolarHBondContact OD1-N 3.48Å; D101-V106 PolarHBondContact OD2-N 3.35Å; V106-I109 PolarHBondContact O-N 3.46Å; V106-F110 WeakPolarHBondContact O-CB 3.47Å; V106-F110 PolarHBondContact O-N 3.5Å |
| 107 | C | 95.1 | Very high | 93.3 | Very high | 4 Ų | 4 | 46.1 Ų | 46.1 | 3% | 0.027 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -63.3 | -41.6 | 175.9 | -169.6 | 0 | 0 | 0 | 0 | 112.4 | W97 D101 I105 F110 G111 E177 V178 C185 | W97-C107 HydrophobicContact CE3-CB 4.25Å; W97-C107 HydrophobicContact CH2-CB 4.47Å; W97-C107 HydrophobicContact CZ3-CB 3.77Å; D101-C107 WeakPolarHBondContact OD2-CB 3.21Å; D101-C107 PolarHBondContact OD2-N 2.84Å; I105-C107 VanDerWaalsContact C-N 3.32Å; I105-C107 PolarHBondContact O-N 2.88Å; C107-F110 PolarHBondContact O-N 3.13Å; C107-G111 PolarHBondContact O-N 3.37Å; C107-E177 VanDerWaalsContact SG-C 3.56Å; C107-V178 HydrophobicContact CB-CG2 4.39Å; C107-V178 VanDerWaalsContact SG-CG2 3.58Å; C107-C185 WeakPolarHBondContact CA-SG 3.4Å; C107-C185 HydrophobicContact CB-CB 4.12Å; C107-C185 WeakPolarHBondContact CB-SG 3.37Å; C107-C185 VanDerWaalsContact O-CB 3.32Å; C107-C185 WeakPolarHBondContact O-CB 3.22Å; C107-C185 WeakPolarHBondContact SG-CB 3.14Å; C107-C185 CovalentContact SG-SG 2.04Å; C107-C185 PolarHBondContact SG-SG 2.99Å |
| 108 | S | 95.3 | Very high | 93.6 | Very high | 21 Ų | 21 | 45.5 Ų | 45.5 | 15% | 0.147 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -60.7 | -49.2 | 174.8 | -65.3 | 0 | 0 | 0 | 0 | 111.7 | G104 I105 F110 G111 V112 P175 Y176 | G104-S108 WeakPolarHBondContact O-CB 3.33Å; G104-S108 PolarHBondContact O-N 3.29Å; G104-S108 PolarHBondContact O-OG 3.06Å; I105-S108 PolarHBondContact O-N 2.95Å; S108-F110 VanDerWaalsContact C-N 3.3Å; S108-F110 PolarHBondContact O-N 2.94Å; S108-G111 PolarHBondContact O-N 2.74Å; S108-V112 VanDerWaalsContact O-CG2 3.26Å; S108-V112 WeakPolarHBondContact O-CG2 3.1Å; S108-V112 PolarHBondContact O-N 3.3Å; S108-P175 WeakPolarHBondContact OG-CB 3.42Å; S108-Y176 WeakPolarHBondContact O-CD2 3.42Å |
| 109 | I | 95.9 | Very high | 94 | Very high | 89 Ų | 89 | 39 Ų | 39 | 46% | 0.456 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -59.1 | -44.9 | 176.8 | -68.4 | 168.1 | 0 | 0 | 0 | 110.3 | I105 V106 G111 V112 C113 | I105-I109 HydrophobicContact CG2-CD1 3.96Å; I105-I109 WeakPolarHBondContact O-CG1 3.44Å; I105-I109 PolarHBondContact O-N 2.91Å; V106-I109 PolarHBondContact O-N 3.46Å; I109-G111 PolarHBondContact O-N 2.78Å; I109-V112 PolarHBondContact O-N 3.25Å; I109-C113 WeakPolarHBondContact O-CB 2.9Å; I109-C113 PolarHBondContact O-N 2.94Å; I109-C113 PolarHBondContact O-SG 3.27Å |
| 110 | F | 96.1 | Very high | 94.4 | Very high | 1 Ų | 1 | 34.7 Ų | 34.7 | 0% | 0.004 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -63.9 | -42.9 | -179.6 | -168.8 | -175 | 0 | 0 | 0 | 112 | N83 L86 V87 W97 V106 C107 S108 C113 M114 W184 C185 | N83-F110 HydrophobicContact CB-CE2 4.13Å; L86-F110 HydrophobicContact CB-CD1 4.16Å; L86-F110 HydrophobicContact CB-CD2 4.04Å; L86-F110 HydrophobicContact CB-CE1 4.36Å; L86-F110 HydrophobicContact CB-CE2 4.31Å; L86-F110 HydrophobicContact CB-CG 4.03Å; L86-F110 HydrophobicContact CB-CZ 4.49Å; L86-F110 HydrophobicContact CD1-CB 3.9Å; L86-F110 HydrophobicContact CD1-CD2 3.75Å; L86-F110 HydrophobicContact CD1-CG 3.94Å; V87-F110 HydrophobicContact CG2-CE1 4.07Å; V87-F110 HydrophobicContact CG2-CE2 4.27Å; V87-F110 HydrophobicContact CG2-CZ 3.42Å; V87-F110 VanDerWaalsContact CG2-CZ 3.42Å; W97-F110 HydrophobicContact CH2-CD1 4.2Å; V106-F110 WeakPolarHBondContact O-CB 3.47Å; V106-F110 PolarHBondContact O-N 3.5Å; C107-F110 PolarHBondContact O-N 3.13Å; S108-F110 VanDerWaalsContact C-N 3.3Å; S108-F110 PolarHBondContact O-N 2.94Å; F110-C113 PolarHBondContact O-N 2.92Å; F110-M114 HydrophobicContact CD2-CG 3.68Å; F110-M114 HydrophobicContact CE2-CG 3.52Å; F110-M114 HydrophobicContact CE2-SD 3.8Å; F110-M114 HydrophobicContact CZ-CG 4.5Å; F110-M114 WeakPolarHBondContact O-CB 3.35Å; F110-M114 VanDerWaalsContact O-CG 3.24Å; F110-M114 WeakPolarHBondContact O-CG 3.27Å; F110-M114 PolarHBondContact O-N 3.2Å; F110-W184 HydrophobicContact CE1-CB 4.08Å; F110-W184 HydrophobicContact CZ-CB 4.03Å; F110-C185 HydrophobicContact CB-CB 4.28Å; F110-C185 HydrophobicContact CD1-CB 4.37Å; F110-C185 HydrophobicContact CG-CB 4.49Å |
| 111 | G | 96 | Very high | 94.6 | Very high | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -61.7 | -44.7 | 174 | 0 | 0 | 0 | 0 | 0 | 113.1 | C107 S108 I109 C113 M114 V115 | C107-G111 PolarHBondContact O-N 3.37Å; S108-G111 PolarHBondContact O-N 2.74Å; I109-G111 PolarHBondContact O-N 2.78Å; G111-C113 PolarHBondContact O-N 2.86Å; G111-M114 PolarHBondContact O-N 3.22Å; G111-V115 WeakPolarHBondContact O-CG2 3.45Å; G111-V115 PolarHBondContact O-N 3.06Å |
| 112 | V | 97.4 | Very high | 94.8 | Very high | 26 Ų | 26 | 32.3 Ų | 32.3 | 16% | 0.158 | 18% | 0.179 | C | C | . | . | H | α-helix | trans | -57.8 | -49.1 | 175.2 | 172.9 | 0 | 0 | 0 | 0 | 110.2 | S108 I109 M114 V115 F116 A166 L167 V170 Y176 | S108-V112 VanDerWaalsContact O-CG2 3.26Å; S108-V112 WeakPolarHBondContact O-CG2 3.1Å; S108-V112 PolarHBondContact O-N 3.3Å; I109-V112 PolarHBondContact O-N 3.25Å; V112-M114 PolarHBondContact O-N 2.92Å; V112-V115 PolarHBondContact O-N 2.87Å; V112-F116 VanDerWaalsContact O-CB 3.3Å; V112-F116 WeakPolarHBondContact O-CB 3.38Å; V112-F116 PolarHBondContact O-N 3.41Å; V112-A166 HydrophobicContact CG1-CB 4.02Å; V112-A166 WeakPolarHBondContact O-CB 3.36Å; V112-L167 HydrophobicContact CG1-CD2 3.97Å; V112-L167 HydrophobicContact CG1-CG 4.48Å; V112-L167 HydrophobicContact CG2-CD2 4.32Å; V112-V170 HydrophobicContact CG2-CG2 3.88Å; V112-Y176 HydrophobicContact CB-CE2 4.28Å; V112-Y176 HydrophobicContact CG2-CD2 4.15Å; V112-Y176 HydrophobicContact CG2-CE2 3.61Å; V112-Y176 VanDerWaalsContact N-CE2 3.31Å |
| 113 | C | 96.8 | Very high | 95.2 | Very high | 21 Ų | 21 | 28.5 Ų | 28.5 | 14% | 0.142 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -63 | -42.8 | 179.3 | -67.5 | 0 | 0 | 0 | 0 | 111.9 | I82 N83 I109 F110 G111 V115 F116 Y117 | I82-C113 HydrophobicContact CG2-CB 4.13Å; N83-C113 WeakPolarHBondContact OD1-CB 3.33Å; I109-C113 WeakPolarHBondContact O-CB 2.9Å; I109-C113 PolarHBondContact O-N 2.94Å; I109-C113 PolarHBondContact O-SG 3.27Å; F110-C113 PolarHBondContact O-N 2.92Å; G111-C113 PolarHBondContact O-N 2.86Å; C113-V115 PolarHBondContact O-N 3.27Å; C113-F116 PolarHBondContact O-N 3.26Å; C113-Y117 HydrophobicContact CB-CD2 4.12Å; C113-Y117 HydrophobicContact CB-CE2 4.21Å; C113-Y117 WeakPolarHBondContact O-CB 3.44Å; C113-Y117 WeakPolarHBondContact O-CD2 3.1Å; C113-Y117 PolarHBondContact O-N 3.36Å |
| 114 | M | 95.2 | Very high | 95.5 | Very high | 32 Ų | 32 | 21 Ų | 21 | 16% | 0.158 | 12% | 0.118 | C | C | . | . | H | α-helix | trans | -59.6 | -44.4 | 176.6 | -76.8 | -72.9 | -72.8 | 0 | 0 | 111.9 | N83 F110 G111 V112 G118 W184 V288 | N83-M114 HydrophobicContact CB-SD 4.29Å; F110-M114 HydrophobicContact CD2-CG 3.68Å; F110-M114 HydrophobicContact CE2-CG 3.52Å; F110-M114 HydrophobicContact CE2-SD 3.8Å; F110-M114 HydrophobicContact CZ-CG 4.5Å; F110-M114 WeakPolarHBondContact O-CB 3.35Å; F110-M114 VanDerWaalsContact O-CG 3.24Å; F110-M114 WeakPolarHBondContact O-CG 3.27Å; F110-M114 PolarHBondContact O-N 3.2Å; G111-M114 PolarHBondContact O-N 3.22Å; V112-M114 PolarHBondContact O-N 2.92Å; M114-G118 WeakPolarHBondContact O-CA 3.5Å; M114-G118 PolarHBondContact O-N 2.98Å; M114-W184 HydrophobicContact CE-CE3 4.09Å; M114-V288 HydrophobicContact CE-CG1 3.65Å |
| 115 | V | 97 | Very high | 95.6 | Very high | 0 Ų | 0 | 20 Ų | 20 | 0% | 0 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -70.6 | -43 | 179.1 | 172.5 | 0 | 0 | 0 | 0 | 111.6 | G111 V112 C113 G118 L119 V165 A166 Y176 F186 F187 F204 | G111-V115 WeakPolarHBondContact O-CG2 3.45Å; G111-V115 PolarHBondContact O-N 3.06Å; V112-V115 PolarHBondContact O-N 2.87Å; C113-V115 PolarHBondContact O-N 3.27Å; V115-G118 PolarHBondContact O-N 3.46Å; V115-L119 HydrophobicContact CG1-CD1 4.11Å; V115-L119 PolarHBondContact O-N 3.25Å; V115-V165 HydrophobicContact CG1-CG1 4.35Å; V115-A166 HydrophobicContact CB-CB 4.03Å; V115-A166 HydrophobicContact CG1-CB 3.83Å; V115-Y176 HydrophobicContact CG2-CE1 3.73Å; V115-Y176 WeakPolarHBondContact CG2-OH 3.41Å; V115-F186 HydrophobicContact CG2-CD2 4.38Å; V115-F186 HydrophobicContact CG2-CE2 3.86Å; V115-F187 HydrophobicContact CG1-CZ 4.25Å; V115-F187 HydrophobicContact CG2-CD2 4.45Å; V115-F187 HydrophobicContact CG2-CE2 3.54Å; V115-F187 HydrophobicContact CG2-CZ 3.62Å; V115-F204 HydrophobicContact CG1-CD2 3.85Å; V115-F204 HydrophobicContact CG1-CE2 4.36Å; V115-F204 HydrophobicContact CG2-CD2 4.47Å |
| 116 | F | 97.7 | Very high | 95.6 | Very high | 43 Ų | 43 | 15.8 Ų | 15.8 | 19% | 0.189 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -62.8 | -51.4 | 178.5 | 175.7 | -100.7 | 0 | 0 | 0 | 112.4 | V112 C113 G118 L119 S120 A162 A163 A166 | V112-F116 VanDerWaalsContact O-CB 3.3Å; V112-F116 WeakPolarHBondContact O-CB 3.38Å; V112-F116 PolarHBondContact O-N 3.41Å; C113-F116 PolarHBondContact O-N 3.26Å; F116-G118 PolarHBondContact O-N 3.17Å; F116-L119 PolarHBondContact O-N 3.18Å; F116-S120 WeakPolarHBondContact CE2-OG 3.21Å; F116-S120 WeakPolarHBondContact O-CB 3.24Å; F116-S120 PolarHBondContact O-N 2.91Å; F116-S120 PolarHBondContact O-OG 3.3Å; F116-A162 HydrophobicContact CD2-CB 3.96Å; F116-A162 HydrophobicContact CE2-CB 4.18Å; F116-A163 HydrophobicContact CD2-CB 4.06Å; F116-A163 HydrophobicContact CE2-CB 4.06Å; F116-A166 HydrophobicContact CB-CB 3.96Å |
| 117 | Y | 96 | Very high | 95.6 | Very high | 22 Ų | 22 | 14.6 Ų | 14.6 | 9% | 0.086 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -74.2 | -10.8 | 176.4 | -65.3 | -61.5 | 0 | 0 | 0 | 112.7 | T75 L78 G79 I82 C113 P121 Q295 | T75-Y117 HydrophobicContact CG2-CD1 3.81Å; T75-Y117 HydrophobicContact CG2-CE1 4.19Å; T75-Y117 VanDerWaalsContact O-CD1 3.27Å; T75-Y117 WeakPolarHBondContact O-CD1 3.39Å; T75-Y117 WeakPolarHBondContact O-CE1 3.3Å; L78-Y117 HydrophobicContact CB-CE1 3.75Å; G79-Y117 VanDerWaalsContact CA-CG 3.41Å; I82-Y117 HydrophobicContact CB-CE2 4.22Å; I82-Y117 HydrophobicContact CD1-CE2 3.92Å; I82-Y117 WeakPolarHBondContact CD1-OH 3.07Å; I82-Y117 HydrophobicContact CG2-CE2 4.41Å; C113-Y117 HydrophobicContact CB-CD2 4.12Å; C113-Y117 HydrophobicContact CB-CE2 4.21Å; C113-Y117 WeakPolarHBondContact O-CB 3.44Å; C113-Y117 WeakPolarHBondContact O-CD2 3.1Å; C113-Y117 PolarHBondContact O-N 3.36Å; Y117-P121 WeakPolarHBondContact O-CD 3.39Å; Y117-P121 VanDerWaalsContact O-CG 3.24Å; Y117-P121 WeakPolarHBondContact O-CG 3.33Å; Y117-Q295 PolarHBondContact O-NE2 3.4Å; Y117-Q295 VanDerWaalsContact O-NE2 3.1Å |
| 118 | G | 94.8 | Very high | 95.3 | Very high | 5 Ų | 5 | 14.4 Ų | 14.4 | 5% | 0.052 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -77 | -53.8 | 168.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | M114 V115 F116 W261 | M114-G118 WeakPolarHBondContact O-CA 3.5Å; M114-G118 PolarHBondContact O-N 2.98Å; V115-G118 PolarHBondContact O-N 3.46Å; F116-G118 PolarHBondContact O-N 3.17Å; G118-W261 WeakPolarHBondContact O-CH2 3.44Å; G118-W261 WeakPolarHBondContact O-CZ3 3.25Å |
| 119 | L | 96.8 | Very high | 95.1 | Very high | 0 Ų | 0 | 13.5 Ų | 13.5 | 0% | 0 | 7% | 0.073 | C | C | . | . | H | α-helix | trans | -80.2 | -35.3 | -175.3 | -71.6 | 176.2 | 0 | 0 | 0 | 113.6 | V115 F116 L122 F123 A162 V165 F204 | V115-L119 HydrophobicContact CG1-CD1 4.11Å; V115-L119 PolarHBondContact O-N 3.25Å; F116-L119 PolarHBondContact O-N 3.18Å; L119-L122 WeakPolarHBondContact O-CB 3.24Å; L119-L122 PolarHBondContact O-N 2.99Å; L119-L122 VanDerWaalsContact O-N 3.12Å; L119-F123 HydrophobicContact CB-CD2 4.41Å; L119-F123 HydrophobicContact CB-CE2 4.04Å; L119-F123 HydrophobicContact CB-CZ 4.45Å; L119-F123 HydrophobicContact CD2-CZ 4.42Å; L119-F123 PolarHBondContact O-N 3.34Å; L119-A162 HydrophobicContact CB-CB 4.04Å; L119-V165 HydrophobicContact CD1-CB 3.8Å; L119-V165 HydrophobicContact CD1-CG1 3.51Å; L119-V165 HydrophobicContact CD1-CG2 4.36Å; L119-F204 HydrophobicContact CD1-CD2 3.81Å; L119-F204 HydrophobicContact CD1-CE2 4.44Å; L119-F204 HydrophobicContact CD2-CD2 3.66Å; L119-F204 HydrophobicContact CD2-CE2 3.85Å; L119-F204 HydrophobicContact CD2-CG 4.49Å; L119-F204 HydrophobicContact CG-CD2 3.54Å; L119-F204 HydrophobicContact CG-CE2 3.71Å |
| 120 | S | 96.3 | Very high | 94.9 | Very high | 0 Ų | 0 | 11.5 Ų | 11.5 | 0% | 0 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -58.2 | -46.8 | -175.8 | -61.1 | 0 | 0 | 0 | 0 | 112.2 | F116 L122 F123 L124 A162 | F116-S120 WeakPolarHBondContact CE2-OG 3.21Å; F116-S120 WeakPolarHBondContact O-CB 3.24Å; F116-S120 PolarHBondContact O-N 2.91Å; F116-S120 PolarHBondContact O-OG 3.3Å; S120-L122 VanDerWaalsContact C-N 3.33Å; S120-L122 PolarHBondContact O-N 3.48Å; S120-F123 PolarHBondContact O-N 3.28Å; S120-L124 WeakPolarHBondContact O-CB 3.24Å; S120-L124 WeakPolarHBondContact O-CG 3.21Å; S120-L124 PolarHBondContact O-N 2.88Å; S120-A162 VanDerWaalsContact OG-CB 3.24Å; S120-A162 WeakPolarHBondContact OG-CB 3.26Å |
| 121 | P | 94.6 | Very high | 94.4 | Very high | 0 Ų | 0 | 12.1 Ų | 12.1 | 0% | 0 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -62 | -35.8 | 175.3 | -25.3 | 37.6 | 0 | 0 | 0 | 113.8 | L72 T75 D76 Y117 L124 S125 W261 | L72-P121 HydrophobicContact CD1-CB 3.77Å; T75-P121 HydrophobicContact CG2-CG 4.42Å; D76-P121 VanDerWaalsContact OD1-CG 3.25Å; D76-P121 WeakPolarHBondContact OD1-CG 3.3Å; Y117-P121 WeakPolarHBondContact O-CD 3.39Å; Y117-P121 VanDerWaalsContact O-CG 3.24Å; Y117-P121 WeakPolarHBondContact O-CG 3.33Å; P121-L124 PolarHBondContact O-N 3.35Å; P121-S125 WeakPolarHBondContact O-CB 3.43Å; P121-S125 PolarHBondContact O-N 3.38Å; P121-S125 PolarHBondContact O-OG 3.44Å; P121-W261 HydrophobicContact CB-CZ2 4.26Å |
| 122 | L | 95.6 | Very high | 93.9 | Very high | 1 Ų | 1 | 14.2 Ų | 14.2 | 1% | 0.005 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -65.5 | -43.4 | 175.6 | -72.1 | 171.8 | 0 | 0 | 0 | 112 | L119 S120 S125 S126 A211 L212 W261 L265 | L119-L122 WeakPolarHBondContact O-CB 3.24Å; L119-L122 PolarHBondContact O-N 2.99Å; L119-L122 VanDerWaalsContact O-N 3.12Å; S120-L122 VanDerWaalsContact C-N 3.33Å; S120-L122 PolarHBondContact O-N 3.48Å; L122-S125 WeakPolarHBondContact CA-OG 3.31Å; L122-S125 PolarHBondContact O-OG 3.26Å; L122-S126 WeakPolarHBondContact O-CB 3.36Å; L122-S126 PolarHBondContact O-N 3.28Å; L122-S126 PolarHBondContact O-OG 2.87Å; L122-A211 HydrophobicContact CB-CB 4.21Å; L122-L212 HydrophobicContact CD2-CB 4.48Å; L122-W261 HydrophobicContact CD1-CD2 4.07Å; L122-W261 HydrophobicContact CD1-CE3 3.8Å; L122-W261 HydrophobicContact CD1-CZ3 4.21Å; L122-W261 HydrophobicContact CD2-CB 4.04Å; L122-W261 HydrophobicContact CD2-CD2 3.75Å; L122-W261 HydrophobicContact CD2-CE3 4.34Å; L122-W261 HydrophobicContact CD2-CG 3.58Å; L122-W261 HydrophobicContact CG-CD2 3.93Å; L122-W261 HydrophobicContact CG-CE3 4.13Å; L122-W261 HydrophobicContact CG-CG 4.31Å; L122-L265 HydrophobicContact CD1-CD1 4.24Å; L122-L265 HydrophobicContact CD1-CD2 4.38Å |
| 123 | F | 96.9 | Very high | 93.4 | Very high | 16 Ų | 16 | 15.7 Ų | 15.7 | 7% | 0.07 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -69.1 | -40.5 | 176 | -64.8 | -27.6 | 0 | 0 | 0 | 112.3 | L119 S120 S126 A127 T158 L161 A162 L207 A211 | L119-F123 HydrophobicContact CB-CD2 4.41Å; L119-F123 HydrophobicContact CB-CE2 4.04Å; L119-F123 HydrophobicContact CB-CZ 4.45Å; L119-F123 HydrophobicContact CD2-CZ 4.42Å; L119-F123 PolarHBondContact O-N 3.34Å; S120-F123 PolarHBondContact O-N 3.28Å; F123-S126 PolarHBondContact O-OG 2.71Å; F123-A127 WeakPolarHBondContact O-CB 3.33Å; F123-A127 PolarHBondContact O-N 2.68Å; F123-T158 HydrophobicContact CB-CG2 3.99Å; F123-L161 HydrophobicContact CD2-CD2 4.41Å; F123-L161 HydrophobicContact CE2-CB 4.26Å; F123-L161 HydrophobicContact CE2-CD2 3.84Å; F123-L161 HydrophobicContact CE2-CG 3.84Å; F123-L161 HydrophobicContact CZ-CD2 3.91Å; F123-L161 HydrophobicContact CZ-CG 4.22Å; F123-A162 HydrophobicContact CD2-CB 4.12Å; F123-A162 HydrophobicContact CE2-CB 4.18Å; F123-L207 HydrophobicContact CE1-CB 4.26Å; F123-L207 HydrophobicContact CZ-CB 4.03Å; F123-L207 HydrophobicContact CZ-CD1 4.48Å; F123-A211 HydrophobicContact CD1-CB 3.75Å; F123-A211 HydrophobicContact CE1-CB 4.03Å |
| 124 | L | 94.1 | Very high | 92.9 | Very high | 0 Ų | 0 | 17.1 Ų | 17.1 | 0% | 0 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -66.9 | -41 | 177.2 | -70.1 | 171.8 | 0 | 0 | 0 | 112.1 | F68 L72 S120 P121 A127 M128 L155 | F68-L124 HydrophobicContact CD1-CD2 4.04Å; F68-L124 HydrophobicContact CE1-CD2 4.46Å; L72-L124 HydrophobicContact CB-CD1 4.36Å; L72-L124 HydrophobicContact CD1-CB 4.01Å; L72-L124 HydrophobicContact CD1-CD1 4.28Å; S120-L124 WeakPolarHBondContact O-CB 3.24Å; S120-L124 WeakPolarHBondContact O-CG 3.21Å; S120-L124 PolarHBondContact O-N 2.88Å; P121-L124 PolarHBondContact O-N 3.35Å; L124-A127 PolarHBondContact O-N 3.31Å; L124-M128 VanDerWaalsContact O-CB 3.32Å; L124-M128 WeakPolarHBondContact O-CB 3.44Å; L124-M128 PolarHBondContact O-N 2.94Å; L124-L155 HydrophobicContact CD2-CD1 3.44Å; L124-L155 VanDerWaalsContact CD2-CD1 3.44Å |
| 125 | S | 92.4 | Very high | 92.2 | Very high | 5 Ų | 5 | 16.9 Ų | 16.9 | 4% | 0.035 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -67.1 | -40.2 | 177.4 | 59.5 | 0 | 0 | 0 | 0 | 112.1 | P121 L122 M128 A129 | P121-S125 WeakPolarHBondContact O-CB 3.43Å; P121-S125 PolarHBondContact O-N 3.38Å; P121-S125 PolarHBondContact O-OG 3.44Å; L122-S125 WeakPolarHBondContact CA-OG 3.31Å; L122-S125 PolarHBondContact O-OG 3.26Å; S125-M128 PolarHBondContact O-N 2.95Å; S125-A129 PolarHBondContact O-N 3.5Å |
| 126 | S | 94.4 | Very high | 91.5 | Very high | 11 Ų | 11 | 18.9 Ų | 18.9 | 8% | 0.077 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -65.2 | -44.7 | 173.8 | 65.4 | 0 | 0 | 0 | 0 | 112.1 | L122 F123 M128 A129 V130 A211 | L122-S126 WeakPolarHBondContact O-CB 3.36Å; L122-S126 PolarHBondContact O-N 3.28Å; L122-S126 PolarHBondContact O-OG 2.87Å; F123-S126 PolarHBondContact O-OG 2.71Å; S126-M128 VanDerWaalsContact C-N 3.29Å; S126-M128 PolarHBondContact O-N 3.12Å; S126-A129 WeakPolarHBondContact O-CB 3.46Å; S126-A129 PolarHBondContact O-N 2.88Å; S126-A129 VanDerWaalsContact O-N 3.11Å; S126-V130 WeakPolarHBondContact O-CG2 3.48Å; S126-V130 PolarHBondContact O-N 3.35Å; S126-A211 VanDerWaalsContact CB-O 3.29Å; S126-A211 WeakPolarHBondContact CB-O 3.39Å |
| 127 | A | 92.4 | Very high | 90.8 | Very high | 10 Ų | 10 | 19.7 Ų | 19.7 | 8% | 0.083 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -58.4 | -42 | 174 | 0 | 0 | 0 | 0 | 0 | 111.9 | F68 F123 L124 A129 V130 E131 L154 | F68-A127 HydrophobicContact CD1-CB 4.45Å; F68-A127 HydrophobicContact CE1-CB 4.09Å; F68-A127 HydrophobicContact CZ-CB 4.44Å; F123-A127 WeakPolarHBondContact O-CB 3.33Å; F123-A127 PolarHBondContact O-N 2.68Å; L124-A127 PolarHBondContact O-N 3.31Å; A127-A129 VanDerWaalsContact C-N 3.35Å; A127-A129 PolarHBondContact O-N 2.96Å; A127-V130 PolarHBondContact O-N 3.42Å; A127-E131 PolarHBondContact O-N 2.75Å; A127-L154 HydrophobicContact CB-CD2 4.22Å |
| 128 | M | 89.9 | Confident | 89.9 | Confident | 0 Ų | 0 | 24.7 Ų | 24.7 | 0% | 0 | 13% | 0.134 | C | C | . | . | H | α-helix | trans | -64.5 | -36.9 | 175.8 | -169.5 | -172.1 | -55.6 | 0 | 0 | 112.5 | F65 F68 A69 L72 L124 S125 S126 R132 Y302 | F65-M128 HydrophobicContact CD2-CG 4.1Å; F65-M128 HydrophobicContact CD2-SD 4.28Å; F65-M128 HydrophobicContact CE2-CG 4.01Å; F65-M128 HydrophobicContact CE2-SD 3.62Å; F68-M128 HydrophobicContact CB-CE 4.29Å; A69-M128 HydrophobicContact CB-CE 4.25Å; L72-M128 HydrophobicContact CD2-CE 3.91Å; L124-M128 VanDerWaalsContact O-CB 3.32Å; L124-M128 WeakPolarHBondContact O-CB 3.44Å; L124-M128 PolarHBondContact O-N 2.94Å; S125-M128 PolarHBondContact O-N 2.95Å; S126-M128 VanDerWaalsContact C-N 3.29Å; S126-M128 PolarHBondContact O-N 3.12Å; M128-R132 WeakPolarHBondContact O-CB 3.42Å; M128-R132 WeakPolarHBondContact O-CD 3.23Å; M128-R132 VanDerWaalsContact O-CG 3.24Å; M128-R132 WeakPolarHBondContact O-CG 3.19Å; M128-R132 PolarHBondContact O-N 2.84Å; M128-Y302 HydrophobicContact CE-CE2 4.5Å; M128-Y302 HydrophobicContact SD-CD1 4.48Å; M128-Y302 HydrophobicContact SD-CE1 3.58Å; M128-Y302 VanDerWaalsContact SD-CE1 3.58Å; M128-Y302 HydrophobicContact SD-CE2 4.19Å; M128-Y302 PolarHBondContact SD-OH 3.48Å |
| 129 | A | 91 | Very high | 88.9 | Confident | 2 Ų | 2 | 28.3 Ų | 28.3 | 2% | 0.017 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -66.9 | -41.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | S125 S126 A127 R132 F133 C218 N219 | S125-A129 PolarHBondContact O-N 3.5Å; S126-A129 WeakPolarHBondContact O-CB 3.46Å; S126-A129 PolarHBondContact O-N 2.88Å; S126-A129 VanDerWaalsContact O-N 3.11Å; A127-A129 VanDerWaalsContact C-N 3.35Å; A127-A129 PolarHBondContact O-N 2.96Å; A129-R132 PolarHBondContact O-N 3.3Å; A129-F133 WeakPolarHBondContact O-CB 3.44Å; A129-F133 PolarHBondContact O-N 3.3Å; A129-C218 HydrophobicContact CB-CB 3.92Å; A129-N219 WeakPolarHBondContact CB-OD1 3.26Å |
| 130 | V | 90.8 | Very high | 87.5 | Confident | 47 Ų | 47 | 35.3 Ų | 35.3 | 29% | 0.285 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -62 | -46.4 | 174.4 | 178.3 | 0 | 0 | 0 | 0 | 110.8 | S126 A127 R132 F133 I134 L214 | S126-V130 WeakPolarHBondContact O-CG2 3.48Å; S126-V130 PolarHBondContact O-N 3.35Å; A127-V130 PolarHBondContact O-N 3.42Å; V130-R132 VanDerWaalsContact C-N 3.32Å; V130-R132 PolarHBondContact O-N 3.04Å; V130-F133 PolarHBondContact O-N 3.14Å; V130-I134 HydrophobicContact CG1-CD1 3.76Å; V130-I134 HydrophobicContact CG1-CG1 4.36Å; V130-I134 WeakPolarHBondContact O-CG1 3.44Å; V130-I134 PolarHBondContact O-N 3.05Å; V130-L214 HydrophobicContact CG2-CD1 4.46Å; V130-L214 HydrophobicContact CG2-CD2 4.24Å; V130-L214 HydrophobicContact CG2-CG 4.31Å |
| 131 | E | 86.7 | Confident | 85.8 | Confident | 14 Ų | 14 | 41.3 Ų | 41.3 | 7% | 0.065 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -55.7 | -48.6 | 176.5 | -172.7 | -161.8 | 162.8 | 0 | 0 | 110.9 | S64 F65 F68 A127 F133 I134 G135 H142 L146 | S64-E131 WeakPolarHBondContact CB-OE1 3.09Å; F65-E131 VanDerWaalsContact CA-OE1 3.32Å; F65-E131 WeakPolarHBondContact CA-OE1 3.35Å; F65-E131 WeakPolarHBondContact CA-OE2 3.43Å; F65-E131 WeakPolarHBondContact CB-OE1 3.31Å; F65-E131 PolarHBondContact N-OE1 3.42Å; F65-E131 PolarHBondContact N-OE2 3.17Å; F68-E131 WeakPolarHBondContact CD2-OE2 3.26Å; A127-E131 PolarHBondContact O-N 2.75Å; E131-F133 PolarHBondContact O-N 2.95Å; E131-I134 PolarHBondContact O-N 3.39Å; E131-G135 PolarHBondContact O-N 2.8Å; E131-H142 IonicContact OE1-NE2 3.96Å; E131-L146 HydrophobicContact CG-CD2 4.23Å |
| 132 | R | 84.3 | Confident | 84.5 | Confident | 44 Ų | 44 | 42.8 Ų | 42.8 | 17% | 0.166 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -60.8 | -44.7 | 178.1 | -74.4 | 167.8 | 174.5 | -103.5 | 2.1 | 111.9 | F65 M128 A129 V130 G135 V136 | F65-R132 VanDerWaalsContact CZ-NH2 3.28Å; M128-R132 WeakPolarHBondContact O-CB 3.42Å; M128-R132 WeakPolarHBondContact O-CD 3.23Å; M128-R132 VanDerWaalsContact O-CG 3.24Å; M128-R132 WeakPolarHBondContact O-CG 3.19Å; M128-R132 PolarHBondContact O-N 2.84Å; A129-R132 PolarHBondContact O-N 3.3Å; V130-R132 VanDerWaalsContact C-N 3.32Å; V130-R132 PolarHBondContact O-N 3.04Å; R132-G135 PolarHBondContact O-N 3.1Å; R132-V136 WeakPolarHBondContact O-CG2 3.38Å; R132-V136 PolarHBondContact O-N 2.97Å |
| 133 | F | 87.4 | Confident | 82.9 | Confident | 56 Ų | 56 | 47.9 Ų | 47.9 | 25% | 0.246 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -60.8 | -45.5 | 177.8 | 171.2 | -110.5 | 0 | 0 | 0 | 112.1 | A129 V130 E131 V136 T137 C218 L221 A222 | A129-F133 WeakPolarHBondContact O-CB 3.44Å; A129-F133 PolarHBondContact O-N 3.3Å; V130-F133 PolarHBondContact O-N 3.14Å; E131-F133 PolarHBondContact O-N 2.95Å; F133-V136 PolarHBondContact O-N 3.46Å; F133-T137 HydrophobicContact CD2-CG2 3.89Å; F133-T137 HydrophobicContact CE2-CG2 3.39Å; F133-T137 HydrophobicContact CZ-CG2 3.83Å; F133-T137 PolarHBondContact O-N 2.93Å; F133-T137 PolarHBondContact O-OG1 3.44Å; F133-C218 HydrophobicContact CB-CB 4.19Å; F133-L221 HydrophobicContact CD2-CB 3.75Å; F133-L221 HydrophobicContact CE2-CB 3.47Å; F133-L221 VanDerWaalsContact CE2-CB 3.47Å; F133-L221 HydrophobicContact CE2-CD1 4.2Å; F133-L221 HydrophobicContact CE2-CG 4.46Å; F133-L221 HydrophobicContact CZ-CB 4.3Å; F133-L221 HydrophobicContact CZ-CD1 4.21Å; F133-A222 HydrophobicContact CB-CB 4.38Å; F133-A222 HydrophobicContact CD2-CB 4.31Å |
| 134 | I | 85.9 | Confident | 81.1 | Confident | 51 Ų | 51 | 51 Ų | 51 | 26% | 0.262 | 29% | 0.291 | S | S | . | . | H | α-helix | trans | -63.9 | -43.1 | 176 | -65.6 | 169.8 | 0 | 0 | 0 | 110.5 | V130 E131 V136 T137 K138 H142 L146 | V130-I134 HydrophobicContact CG1-CD1 3.76Å; V130-I134 HydrophobicContact CG1-CG1 4.36Å; V130-I134 WeakPolarHBondContact O-CG1 3.44Å; V130-I134 PolarHBondContact O-N 3.05Å; E131-I134 PolarHBondContact O-N 3.39Å; I134-V136 VanDerWaalsContact C-N 3.28Å; I134-V136 PolarHBondContact O-N 3.1Å; I134-T137 PolarHBondContact O-N 3.03Å; I134-K138 CarbonylContact O-C 3.59Å; I134-K138 WeakPolarHBondContact O-CA 3.35Å; I134-K138 PolarHBondContact O-N 3.29Å; I134-H142 HydrophobicContact CG2-CB 4.43Å; I134-L146 HydrophobicContact CG2-CD1 4.29Å |
| 135 | G | 82.1 | Confident | 79.4 | Confident | 28 Ų | 28 | 54.4 Ų | 54.4 | 29% | 0.289 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -61.1 | -34.1 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.5 | E131 R132 | E131-G135 PolarHBondContact O-N 2.8Å; R132-G135 PolarHBondContact O-N 3.1Å |
| 136 | V | 82.3 | Confident | 78 | Confident | 42 Ų | 42 | 55.5 Ų | 55.5 | 26% | 0.255 | 32% | 0.317 | S | S | . | . | H | α-helix | trans | -77.3 | -44.9 | 176.5 | 170.3 | 0 | 0 | 0 | 0 | 111.9 | R132 F133 I134 A225 L226 | R132-V136 WeakPolarHBondContact O-CG2 3.38Å; R132-V136 PolarHBondContact O-N 2.97Å; F133-V136 PolarHBondContact O-N 3.46Å; I134-V136 VanDerWaalsContact C-N 3.28Å; I134-V136 PolarHBondContact O-N 3.1Å; V136-A225 HydrophobicContact CG1-CB 3.83Å; V136-L226 HydrophobicContact CG1-CD2 4.03Å; V136-L226 HydrophobicContact CG1-CG 3.92Å; V136-L226 HydrophobicContact CG2-CD1 4.42Å; V136-L226 HydrophobicContact CG2-CD2 4.28Å; V136-L226 HydrophobicContact CG2-CG 4.3Å |
| 137 | T | 81.3 | Confident | 76.9 | Confident | 60 Ų | 60 | 57.9 Ų | 57.9 | 37% | 0.368 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -84.5 | -33.9 | -172.1 | 53.4 | 0 | 0 | 0 | 0 | 113.8 | F133 I134 A225 | F133-T137 HydrophobicContact CD2-CG2 3.89Å; F133-T137 HydrophobicContact CE2-CG2 3.39Å; F133-T137 HydrophobicContact CZ-CG2 3.83Å; F133-T137 PolarHBondContact O-N 2.93Å; F133-T137 PolarHBondContact O-OG1 3.44Å; I134-T137 PolarHBondContact O-N 3.03Å; T137-A225 HydrophobicContact CG2-CB 4.21Å |
| 138 | K | 77.9 | Confident | 76.1 | Confident | 126 Ų | 126 | 60.2 Ų | 60.2 | 55% | 0.548 | 35% | 0.349 | S | S | . | . | trans | -136.9 | 67.2 | -174.1 | -63.5 | -168.7 | -179.4 | -177.9 | 0 | 111.6 | I134 I140 F141 H142 | I134-K138 CarbonylContact O-C 3.59Å; I134-K138 WeakPolarHBondContact O-CA 3.35Å; I134-K138 PolarHBondContact O-N 3.29Å; K138-I140 VanDerWaalsContact C-N 3.3Å; K138-I140 PolarHBondContact O-N 2.96Å; K138-F141 HydrophobicContact CB-CB 3.86Å; K138-F141 PolarHBondContact O-N 3.4Å; K138-H142 PolarHBondContact O-N 3.42Å | ||
| 139 | P | 74.6 | Confident | 75.6 | Confident | 82 Ų | 82 | 66.5 Ų | 66.5 | 53% | 0.532 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -61.7 | -33.2 | -174.3 | 23.6 | -34 | 0 | 0 | 0 | 114 | S143 | P139-S143 PolarHBondContact O-N 3.47Å |
| 140 | I | 66 | Low | 75.3 | Confident | 146 Ų | 146 | 70.3 Ų | 70.3 | 75% | 0.749 | 40% | 0.398 | S | S | * | . | H | α-helix | trans | -73.2 | -40.4 | 179.3 | -57.3 | 172.3 | 0 | 0 | 0 | 110.6 | K138 H142 S143 A144 | K138-I140 VanDerWaalsContact C-N 3.3Å; K138-I140 PolarHBondContact O-N 2.96Å; I140-H142 VanDerWaalsContact C-N 3.32Å; I140-H142 PolarHBondContact O-N 3.23Å; I140-S143 PolarHBondContact O-N 2.89Å; I140-A144 PolarHBondContact O-N 3.42Å |
| 141 | F | 62.2 | Low | 75 | Confident | 127 Ų | 127 | 68.7 Ų | 68.7 | 56% | 0.557 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -68 | -34 | 175.7 | -128.8 | -96.7 | 0 | 0 | 0 | 111.6 | K138 S143 A144 V145 | K138-F141 HydrophobicContact CB-CB 3.86Å; K138-F141 PolarHBondContact O-N 3.4Å; F141-S143 VanDerWaalsContact C-N 3.3Å; F141-S143 PolarHBondContact O-N 3.5Å; F141-A144 PolarHBondContact O-N 2.91Å; F141-V145 HydrophobicContact CD1-CB 3.98Å; F141-V145 HydrophobicContact CD1-CG2 3.46Å; F141-V145 VanDerWaalsContact CD1-CG2 3.46Å; F141-V145 HydrophobicContact CE1-CB 4.27Å; F141-V145 HydrophobicContact CE1-CG2 3.45Å; F141-V145 VanDerWaalsContact CE1-CG2 3.45Å; F141-V145 HydrophobicContact CG-CG2 4.26Å; F141-V145 HydrophobicContact CZ-CG2 4.22Å; F141-V145 WeakPolarHBondContact O-CB 3.39Å; F141-V145 PolarHBondContact O-N 3.35Å |
| 142 | H | 65.8 | Low | 75.1 | Confident | 31 Ų | 31 | 73.4 Ų | 73.4 | 14% | 0.144 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -60.9 | -37.5 | 174.2 | -175.5 | -82.1 | 0 | 0 | 0 | 112.3 | E131 I134 K138 I140 | E131-H142 IonicContact OE1-NE2 3.96Å; I134-H142 HydrophobicContact CG2-CB 4.43Å; K138-H142 PolarHBondContact O-N 3.42Å; I140-H142 VanDerWaalsContact C-N 3.32Å; I140-H142 PolarHBondContact O-N 3.23Å |
| 143 | S | 62.8 | Low | 75.4 | Confident | 108 Ų | 108 | 80.4 Ų | 80.4 | 76% | 0.755 | 43% | 0.434 | S | S | * | . | H | α-helix | trans | -77.7 | -24.9 | 177 | -169.3 | 0 | 0 | 0 | 0 | 113.8 | P139 I140 F141 | P139-S143 PolarHBondContact O-N 3.47Å; I140-S143 PolarHBondContact O-N 2.89Å; F141-S143 VanDerWaalsContact C-N 3.3Å; F141-S143 PolarHBondContact O-N 3.5Å |
| 144 | A | 59 | Low | 75.6 | Confident | 82 Ų | 82 | 80.9 Ų | 80.9 | 68% | 0.678 | 44% | 0.438 | S | S | * | . | H | α-helix | trans | -96.6 | -35.1 | -174.1 | 0 | 0 | 0 | 0 | 0 | 113.9 | I140 F141 | I140-A144 PolarHBondContact O-N 3.42Å; F141-A144 PolarHBondContact O-N 2.91Å |
| 145 | V | 57.8 | Low | 75.9 | Confident | 70 Ų | 70 | 79.1 Ų | 79.1 | 42% | 0.424 | 43% | 0.429 | S | S | . | . | H | α-helix | trans | -104.9 | -29.9 | -170.9 | 176.1 | 0 | 0 | 0 | 0 | 113.5 | F141 S147 | F141-V145 HydrophobicContact CD1-CB 3.98Å; F141-V145 HydrophobicContact CD1-CG2 3.46Å; F141-V145 VanDerWaalsContact CD1-CG2 3.46Å; F141-V145 HydrophobicContact CE1-CB 4.27Å; F141-V145 HydrophobicContact CE1-CG2 3.45Å; F141-V145 VanDerWaalsContact CE1-CG2 3.45Å; F141-V145 HydrophobicContact CG-CG2 4.26Å; F141-V145 HydrophobicContact CZ-CG2 4.22Å; F141-V145 WeakPolarHBondContact O-CB 3.39Å; F141-V145 PolarHBondContact O-N 3.35Å; V145-S147 PolarHBondContact O-N 2.87Å |
| 146 | L | 63.9 | Low | 76.5 | Confident | 29 Ų | 29 | 79.4 Ų | 79.4 | 15% | 0.152 | 43% | 0.433 | C | S | . | . | trans | -80.8 | 71.3 | 176.7 | -83.4 | 74.1 | 0 | 0 | 0 | 110.5 | E131 I134 M151 | E131-L146 HydrophobicContact CG-CD2 4.23Å; I134-L146 HydrophobicContact CG2-CD1 4.29Å; L146-M151 HydrophobicContact CB-CE 3.98Å; L146-M151 HydrophobicContact CB-SD 4.48Å; L146-M151 HydrophobicContact CD2-CE 3.42Å; L146-M151 VanDerWaalsContact CD2-CE 3.42Å; L146-M151 HydrophobicContact CD2-SD 3.66Å; L146-M151 HydrophobicContact CG-CE 3.39Å; L146-M151 HydrophobicContact CG-SD 4.18Å | ||
| 147 | S | 71.2 | Confident | 77.1 | Confident | 61 Ų | 61 | 83.2 Ų | 83.2 | 43% | 0.427 | 45% | 0.446 | S | S | . | . | trans | -60.1 | 142.5 | 167.5 | 175.6 | 0 | 0 | 0 | 0 | 110.1 | V145 H149 L150 M151 | V145-S147 PolarHBondContact O-N 2.87Å; S147-H149 PolarHBondContact O-N 3.29Å; S147-H149 PolarHBondContact OG-N 2.75Å; S147-L150 PolarHBondContact O-N 3.41Å; S147-M151 PolarHBondContact O-N 3.49Å | ||
| 148 | S | 74.6 | Confident | 77.8 | Confident | 58 Ų | 58 | 80.9 Ų | 80.9 | 41% | 0.406 | 43% | 0.432 | S | S | . | . | H | α-helix | trans | -53.2 | -31.1 | 176.6 | -177 | 0 | 0 | 0 | 0 | 112.4 | K152 | S148-K152 VanDerWaalsContact O-CG 3.32Å; S148-K152 WeakPolarHBondContact O-CG 3.32Å; S148-K152 PolarHBondContact O-N 2.85Å; S148-K152 VanDerWaalsContact O-N 3.11Å |
| 149 | H | 80.6 | Confident | 78.6 | Confident | 132 Ų | 132 | 79 Ų | 79 | 61% | 0.611 | 42% | 0.421 | S | S | * | . | H | α-helix | trans | -66.8 | -39.9 | 177.2 | -66.2 | -82.8 | 0 | 0 | 0 | 112.7 | S147 K152 R153 | S147-H149 PolarHBondContact O-N 3.29Å; S147-H149 PolarHBondContact OG-N 2.75Å; H149-K152 PolarHBondContact O-N 3.47Å; H149-R153 WeakPolarHBondContact O-CB 3.48Å; H149-R153 WeakPolarHBondContact O-CG 3.39Å; H149-R153 PolarHBondContact O-N 3.42Å |
| 150 | L | 83.9 | Confident | 79.7 | Confident | 83 Ų | 83 | 80.7 Ų | 80.7 | 44% | 0.435 | 43% | 0.425 | S | S | . | . | H | α-helix | trans | -65.9 | -41.6 | 178 | -178.8 | 60.9 | 0 | 0 | 0 | 111 | S147 R153 L154 | S147-L150 PolarHBondContact O-N 3.41Å; L150-R153 PolarHBondContact O-N 2.86Å; L150-L154 WeakPolarHBondContact O-CB 3.29Å; L150-L154 PolarHBondContact O-N 3.14Å |
| 151 | M | 84.4 | Confident | 81.2 | Confident | 12 Ų | 12 | 76.1 Ų | 76.1 | 6% | 0.059 | 40% | 0.402 | C | S | . | . | H | α-helix | trans | -63.1 | -43.2 | 177.3 | -59.5 | -66.9 | 103.1 | 0 | 0 | 112 | S64 F68 L146 S147 L154 L155 | S64-M151 WeakPolarHBondContact OG-CG 3.25Å; F68-M151 HydrophobicContact CE2-CB 4.3Å; F68-M151 HydrophobicContact CE2-SD 3.74Å; F68-M151 HydrophobicContact CZ-SD 4.46Å; L146-M151 HydrophobicContact CB-CE 3.98Å; L146-M151 HydrophobicContact CB-SD 4.48Å; L146-M151 HydrophobicContact CD2-CE 3.42Å; L146-M151 VanDerWaalsContact CD2-CE 3.42Å; L146-M151 HydrophobicContact CD2-SD 3.66Å; L146-M151 HydrophobicContact CG-CE 3.39Å; L146-M151 HydrophobicContact CG-SD 4.18Å; S147-M151 PolarHBondContact O-N 3.49Å; M151-L154 PolarHBondContact O-N 2.93Å; M151-L155 WeakPolarHBondContact O-CB 3.35Å; M151-L155 PolarHBondContact O-N 3.44Å |
| 152 | K | 88.5 | Confident | 82.9 | Confident | 113 Ų | 113 | 70.1 Ų | 70.1 | 49% | 0.491 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -63.8 | -40.3 | 175.3 | -71.2 | 172.6 | -175.7 | 179.6 | 0 | 112.1 | L67 S148 H149 L155 G156 | L67-K152 HydrophobicContact CD1-CG 3.99Å; S148-K152 VanDerWaalsContact O-CG 3.32Å; S148-K152 WeakPolarHBondContact O-CG 3.32Å; S148-K152 PolarHBondContact O-N 2.85Å; S148-K152 VanDerWaalsContact O-N 3.11Å; H149-K152 PolarHBondContact O-N 3.47Å; K152-L155 PolarHBondContact O-N 3.43Å; K152-G156 PolarHBondContact O-N 2.83Å |
| 153 | R | 90.5 | Very high | 84.4 | Confident | 192 Ų | 192 | 70 Ų | 70 | 73% | 0.725 | 38% | 0.38 | S | S | * | . | H | α-helix | trans | -63.7 | -43.8 | 174.6 | -75.8 | -178.5 | 67.8 | -172.1 | 0.6 | 111.7 | H149 L150 G156 F157 | H149-R153 WeakPolarHBondContact O-CB 3.48Å; H149-R153 WeakPolarHBondContact O-CG 3.39Å; H149-R153 PolarHBondContact O-N 3.42Å; L150-R153 PolarHBondContact O-N 2.86Å; R153-G156 PolarHBondContact O-N 3.49Å; R153-F157 WeakPolarHBondContact O-CB 3.36Å; R153-F157 PolarHBondContact O-N 3.18Å |
| 154 | L | 91.4 | Very high | 86.1 | Confident | 65 Ų | 65 | 69.4 Ų | 69.4 | 34% | 0.34 | 37% | 0.368 | S | S | . | . | H | α-helix | trans | -62.6 | -44.5 | 177 | -177.5 | 60.8 | 0 | 0 | 0 | 111.1 | F68 A127 L150 M151 G156 F157 T158 | F68-L154 HydrophobicContact CZ-CB 4.28Å; F68-L154 HydrophobicContact CZ-CD2 3.91Å; F68-L154 HydrophobicContact CZ-CG 4.16Å; A127-L154 HydrophobicContact CB-CD2 4.22Å; L150-L154 WeakPolarHBondContact O-CB 3.29Å; L150-L154 PolarHBondContact O-N 3.14Å; M151-L154 PolarHBondContact O-N 2.93Å; L154-G156 PolarHBondContact O-N 3.32Å; L154-F157 WeakPolarHBondContact O-CB 3.47Å; L154-F157 PolarHBondContact O-N 2.88Å; L154-T158 WeakPolarHBondContact O-CG2 3.3Å; L154-T158 PolarHBondContact O-N 3.34Å; L154-T158 PolarHBondContact O-OG1 3.37Å |
| 155 | L | 92.9 | Very high | 87.9 | Confident | 14 Ų | 14 | 66.1 Ų | 66.1 | 7% | 0.073 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -56.4 | -51.1 | 173.5 | 173.9 | 62.6 | 0 | 0 | 0 | 111.6 | L67 F68 S71 L124 M151 K152 F157 T158 W159 | L67-L155 HydrophobicContact CD2-CB 4.29Å; L67-L155 HydrophobicContact CD2-CD2 3.73Å; L67-L155 HydrophobicContact CG-CD2 4.38Å; F68-L155 HydrophobicContact CE1-CB 4.15Å; S71-L155 VanDerWaalsContact OG-CD2 3.24Å; S71-L155 WeakPolarHBondContact OG-CD2 3.47Å; L124-L155 HydrophobicContact CD2-CD1 3.44Å; L124-L155 VanDerWaalsContact CD2-CD1 3.44Å; M151-L155 WeakPolarHBondContact O-CB 3.35Å; M151-L155 PolarHBondContact O-N 3.44Å; K152-L155 PolarHBondContact O-N 3.43Å; L155-F157 VanDerWaalsContact C-N 3.29Å; L155-F157 PolarHBondContact O-N 2.82Å; L155-T158 WeakPolarHBondContact CA-OG1 3.41Å; L155-T158 PolarHBondContact O-N 3.24Å; L155-T158 PolarHBondContact O-OG1 2.88Å; L155-W159 HydrophobicContact CD1-CD2 4.11Å; L155-W159 HydrophobicContact CD1-CE3 4.22Å; L155-W159 HydrophobicContact CD1-CH2 3.95Å; L155-W159 HydrophobicContact CD1-CZ2 3.82Å; L155-W159 HydrophobicContact CD1-CZ3 4.15Å; L155-W159 HydrophobicContact CD2-CH2 3.87Å; L155-W159 HydrophobicContact CD2-CZ3 3.93Å; L155-W159 HydrophobicContact CG-CD2 4.42Å; L155-W159 HydrophobicContact CG-CE3 4.05Å; L155-W159 HydrophobicContact CG-CH2 4.01Å; L155-W159 HydrophobicContact CG-CZ2 4.38Å; L155-W159 HydrophobicContact CG-CZ3 3.83Å; L155-W159 PolarHBondContact O-N 2.87Å; L155-W159 VanDerWaalsContact O-N 3.16Å |
| 156 | G | 94.8 | Very high | 89.8 | Confident | 35 Ų | 35 | 62.8 Ų | 62.8 | 36% | 0.361 | 32% | 0.319 | S | S | . | . | H | α-helix | trans | -58 | -41.8 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | K152 R153 L154 W159 L160 | K152-G156 PolarHBondContact O-N 2.83Å; R153-G156 PolarHBondContact O-N 3.49Å; L154-G156 PolarHBondContact O-N 3.32Å; G156-W159 PolarHBondContact O-N 2.74Å; G156-L160 VanDerWaalsContact O-CB 3.3Å; G156-L160 WeakPolarHBondContact O-CB 3.5Å; G156-L160 PolarHBondContact O-N 3.44Å |
| 157 | F | 94.9 | Very high | 91.3 | Very high | 122 Ų | 122 | 65.3 Ų | 65.3 | 54% | 0.535 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -63.3 | -42.7 | 176.2 | -179.6 | -99.1 | 0 | 0 | 0 | 112.4 | R153 L154 L155 W159 L160 L161 | R153-F157 WeakPolarHBondContact O-CB 3.36Å; R153-F157 PolarHBondContact O-N 3.18Å; L154-F157 WeakPolarHBondContact O-CB 3.47Å; L154-F157 PolarHBondContact O-N 2.88Å; L155-F157 VanDerWaalsContact C-N 3.29Å; L155-F157 PolarHBondContact O-N 2.82Å; F157-W159 PolarHBondContact O-N 3.48Å; F157-L160 PolarHBondContact O-N 3.43Å; F157-L161 HydrophobicContact CE1-CD2 4.2Å; F157-L161 HydrophobicContact CZ-CD2 4.47Å; F157-L161 WeakPolarHBondContact O-CB 3.28Å; F157-L161 PolarHBondContact O-N 3.45Å |
| 158 | T | 95 | Very high | 92.5 | Very high | 11 Ų | 11 | 64.5 Ų | 64.5 | 7% | 0.067 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -61.6 | -42.4 | 178.4 | 52.9 | 0 | 0 | 0 | 0 | 112.5 | F123 L154 L155 A162 | F123-T158 HydrophobicContact CB-CG2 3.99Å; L154-T158 WeakPolarHBondContact O-CG2 3.3Å; L154-T158 PolarHBondContact O-N 3.34Å; L154-T158 PolarHBondContact O-OG1 3.37Å; L155-T158 WeakPolarHBondContact CA-OG1 3.41Å; L155-T158 PolarHBondContact O-N 3.24Å; L155-T158 PolarHBondContact O-OG1 2.88Å; T158-A162 PolarHBondContact O-N 2.82Å; T158-A162 VanDerWaalsContact O-N 3.15Å |
| 159 | W | 96.7 | Very high | 93.4 | Very high | 87 Ų | 87 | 61.8 Ų | 61.8 | 33% | 0.33 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -69.5 | -41.5 | 175.3 | -74.2 | -34.3 | 0 | 0 | 0 | 112.4 | T75 L155 G156 F157 L161 A162 A163 | T75-W159 PolarHBondContact OG1-NE1 3.4Å; L155-W159 HydrophobicContact CD1-CD2 4.11Å; L155-W159 HydrophobicContact CD1-CE3 4.22Å; L155-W159 HydrophobicContact CD1-CH2 3.95Å; L155-W159 HydrophobicContact CD1-CZ2 3.82Å; L155-W159 HydrophobicContact CD1-CZ3 4.15Å; L155-W159 HydrophobicContact CD2-CH2 3.87Å; L155-W159 HydrophobicContact CD2-CZ3 3.93Å; L155-W159 HydrophobicContact CG-CD2 4.42Å; L155-W159 HydrophobicContact CG-CE3 4.05Å; L155-W159 HydrophobicContact CG-CH2 4.01Å; L155-W159 HydrophobicContact CG-CZ2 4.38Å; L155-W159 HydrophobicContact CG-CZ3 3.83Å; L155-W159 PolarHBondContact O-N 2.87Å; L155-W159 VanDerWaalsContact O-N 3.16Å; G156-W159 PolarHBondContact O-N 2.74Å; F157-W159 PolarHBondContact O-N 3.48Å; W159-L161 VanDerWaalsContact C-N 3.34Å; W159-L161 PolarHBondContact O-N 3Å; W159-A162 PolarHBondContact O-N 2.86Å; W159-A163 VanDerWaalsContact O-CB 3.3Å; W159-A163 WeakPolarHBondContact O-CB 3.45Å; W159-A163 PolarHBondContact O-N 3.28Å |
| 160 | L | 97.3 | Very high | 94 | Very high | 117 Ų | 117 | 58.6 Ų | 58.6 | 61% | 0.613 | 29% | 0.294 | S | S | * | . | H | α-helix | trans | -61.5 | -43.9 | 178.1 | -179.3 | 62.9 | 0 | 0 | 0 | 111.3 | G156 F157 A163 L164 | G156-L160 VanDerWaalsContact O-CB 3.3Å; G156-L160 WeakPolarHBondContact O-CB 3.5Å; G156-L160 PolarHBondContact O-N 3.44Å; F157-L160 PolarHBondContact O-N 3.43Å; L160-A163 PolarHBondContact O-N 2.65Å; L160-L164 WeakPolarHBondContact O-CB 3.2Å; L160-L164 PolarHBondContact O-N 2.95Å |
| 161 | L | 97.1 | Very high | 94.5 | Very high | 50 Ų | 50 | 60.6 Ų | 60.6 | 26% | 0.262 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -63 | -44.9 | 177.9 | -177.1 | 61.5 | 0 | 0 | 0 | 111.4 | F123 F157 W159 L164 V165 | F123-L161 HydrophobicContact CD2-CD2 4.41Å; F123-L161 HydrophobicContact CE2-CB 4.26Å; F123-L161 HydrophobicContact CE2-CD2 3.84Å; F123-L161 HydrophobicContact CE2-CG 3.84Å; F123-L161 HydrophobicContact CZ-CD2 3.91Å; F123-L161 HydrophobicContact CZ-CG 4.22Å; F157-L161 HydrophobicContact CE1-CD2 4.2Å; F157-L161 HydrophobicContact CZ-CD2 4.47Å; F157-L161 WeakPolarHBondContact O-CB 3.28Å; F157-L161 PolarHBondContact O-N 3.45Å; W159-L161 VanDerWaalsContact C-N 3.34Å; W159-L161 PolarHBondContact O-N 3Å; L161-L164 PolarHBondContact O-N 3.38Å; L161-V165 WeakPolarHBondContact O-CG2 3.41Å; L161-V165 PolarHBondContact O-N 3.01Å; L161-V165 VanDerWaalsContact O-N 3.1Å |
| 162 | A | 97.6 | Very high | 94.9 | Very high | 0 Ų | 0 | 63.7 Ų | 63.7 | 0% | 0 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -63.1 | -42.4 | 175.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | F116 L119 S120 F123 T158 W159 V165 A166 | F116-A162 HydrophobicContact CD2-CB 3.96Å; F116-A162 HydrophobicContact CE2-CB 4.18Å; L119-A162 HydrophobicContact CB-CB 4.04Å; S120-A162 VanDerWaalsContact OG-CB 3.24Å; S120-A162 WeakPolarHBondContact OG-CB 3.26Å; F123-A162 HydrophobicContact CD2-CB 4.12Å; F123-A162 HydrophobicContact CE2-CB 4.18Å; T158-A162 PolarHBondContact O-N 2.82Å; T158-A162 VanDerWaalsContact O-N 3.15Å; W159-A162 PolarHBondContact O-N 2.86Å; A162-V165 PolarHBondContact O-N 3.41Å; A162-A166 WeakPolarHBondContact O-CB 3.16Å; A162-A166 PolarHBondContact O-N 2.79Å |
| 163 | A | 97.6 | Very high | 95.1 | Very high | 28 Ų | 28 | 68.9 Ų | 68.9 | 23% | 0.231 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -65.1 | -40.5 | 177.8 | 0 | 0 | 0 | 0 | 0 | 111.8 | F116 W159 L160 A166 L167 | F116-A163 HydrophobicContact CD2-CB 4.06Å; F116-A163 HydrophobicContact CE2-CB 4.06Å; W159-A163 VanDerWaalsContact O-CB 3.3Å; W159-A163 WeakPolarHBondContact O-CB 3.45Å; W159-A163 PolarHBondContact O-N 3.28Å; L160-A163 PolarHBondContact O-N 2.65Å; A163-A166 PolarHBondContact O-N 3.28Å; A163-L167 WeakPolarHBondContact O-CB 3.39Å; A163-L167 VanDerWaalsContact O-CG 3.31Å; A163-L167 WeakPolarHBondContact O-CG 3.28Å; A163-L167 PolarHBondContact O-N 2.84Å |
| 164 | L | 97.6 | Very high | 95.1 | Very high | 97 Ų | 97 | 64.4 Ų | 64.4 | 51% | 0.508 | 32% | 0.32 | S | S | . | . | H | α-helix | trans | -60 | -48.7 | 176.2 | 179.9 | 61.3 | 0 | 0 | 0 | 111 | L160 L161 A166 L167 L168 | L160-L164 WeakPolarHBondContact O-CB 3.2Å; L160-L164 PolarHBondContact O-N 2.95Å; L161-L164 PolarHBondContact O-N 3.38Å; L164-A166 VanDerWaalsContact C-N 3.33Å; L164-A166 PolarHBondContact O-N 2.96Å; L164-L167 PolarHBondContact O-N 3.32Å; L164-L168 WeakPolarHBondContact O-CB 3.28Å; L164-L168 PolarHBondContact O-N 3.31Å |
| 165 | V | 97.2 | Very high | 95 | Very high | 12 Ų | 12 | 64.5 Ų | 64.5 | 7% | 0.073 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -64 | -38.9 | 178.2 | 176.8 | 0 | 0 | 0 | 0 | 111.4 | V115 L119 L161 A162 P169 I203 L207 | V115-V165 HydrophobicContact CG1-CG1 4.35Å; L119-V165 HydrophobicContact CD1-CB 3.8Å; L119-V165 HydrophobicContact CD1-CG1 3.51Å; L119-V165 HydrophobicContact CD1-CG2 4.36Å; L161-V165 WeakPolarHBondContact O-CG2 3.41Å; L161-V165 PolarHBondContact O-N 3.01Å; L161-V165 VanDerWaalsContact O-N 3.1Å; A162-V165 PolarHBondContact O-N 3.41Å; V165-P169 WeakPolarHBondContact O-CD 3.33Å; V165-I203 HydrophobicContact CG1-CG2 4Å; V165-I203 HydrophobicContact CG2-CG2 4.22Å; V165-L207 HydrophobicContact CG2-CD1 3.65Å |
| 166 | A | 97.2 | Very high | 95.1 | Very high | 0 Ų | 0 | 64.2 Ų | 64.2 | 0% | 0 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -69 | -33.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.4 | V112 V115 F116 A162 A163 L164 P169 Y176 | V112-A166 HydrophobicContact CG1-CB 4.02Å; V112-A166 WeakPolarHBondContact O-CB 3.36Å; V115-A166 HydrophobicContact CB-CB 4.03Å; V115-A166 HydrophobicContact CG1-CB 3.83Å; F116-A166 HydrophobicContact CB-CB 3.96Å; A162-A166 WeakPolarHBondContact O-CB 3.16Å; A162-A166 PolarHBondContact O-N 2.79Å; A163-A166 PolarHBondContact O-N 3.28Å; L164-A166 VanDerWaalsContact C-N 3.33Å; L164-A166 PolarHBondContact O-N 2.96Å; A166-P169 WeakPolarHBondContact O-CD 3.21Å; A166-Y176 PolarHBondContact O-OH 3.2Å |
| 167 | L | 96.9 | Very high | 94.9 | Very high | 82 Ų | 82 | 67 Ų | 67 | 43% | 0.429 | 33% | 0.326 | S | S | . | . | H | α-helix | trans | -86.3 | -20.4 | 179.9 | -70.3 | 169.8 | 0 | 0 | 0 | 113.1 | V112 A163 L164 P169 V170 L171 | V112-L167 HydrophobicContact CG1-CD2 3.97Å; V112-L167 HydrophobicContact CG1-CG 4.48Å; V112-L167 HydrophobicContact CG2-CD2 4.32Å; A163-L167 WeakPolarHBondContact O-CB 3.39Å; A163-L167 VanDerWaalsContact O-CG 3.31Å; A163-L167 WeakPolarHBondContact O-CG 3.28Å; A163-L167 PolarHBondContact O-N 2.84Å; L164-L167 PolarHBondContact O-N 3.32Å; L167-P169 VanDerWaalsContact C-CD 3.44Å; L167-V170 PolarHBondContact O-N 2.95Å; L167-V170 VanDerWaalsContact O-N 3.1Å; L167-L171 HydrophobicContact CB-CD1 4.41Å; L167-L171 WeakPolarHBondContact O-CG 3.18Å; L167-L171 PolarHBondContact O-N 2.9Å |
| 168 | L | 95.8 | Very high | 94.7 | Very high | 45 Ų | 45 | 63.8 Ų | 63.8 | 24% | 0.236 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -51.2 | -44.4 | -177.1 | -172.5 | 65.3 | 0 | 0 | 0 | 113.9 | L164 V170 L171 L172 L200 I203 | L164-L168 WeakPolarHBondContact O-CB 3.28Å; L164-L168 PolarHBondContact O-N 3.31Å; L168-V170 VanDerWaalsContact C-N 3.34Å; L168-V170 PolarHBondContact O-N 2.99Å; L168-L171 PolarHBondContact O-N 2.71Å; L168-L172 HydrophobicContact CD1-CD1 3.86Å; L168-L172 HydrophobicContact CD1-CG 4.07Å; L168-L172 HydrophobicContact CG-CD1 3.87Å; L168-L172 HydrophobicContact CG-CG 4.37Å; L168-L172 WeakPolarHBondContact O-CB 3.04Å; L168-L172 WeakPolarHBondContact O-CG 3.29Å; L168-L172 PolarHBondContact O-N 2.96Å; L168-L200 HydrophobicContact CB-CD2 4.38Å; L168-L200 HydrophobicContact CD2-CD2 3.7Å; L168-L200 HydrophobicContact CG-CD2 3.81Å; L168-I203 HydrophobicContact CD2-CD1 4.17Å |
| 169 | P | 93.8 | Very high | 94.4 | Very high | 1 Ų | 1 | 64.1 Ų | 64.1 | 1% | 0.006 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -61.9 | -40.8 | 179.1 | -24.1 | 37 | 0 | 0 | 0 | 112.7 | V165 A166 L167 L172 R173 R174 Y176 F187 L200 | V165-P169 WeakPolarHBondContact O-CD 3.33Å; A166-P169 WeakPolarHBondContact O-CD 3.21Å; L167-P169 VanDerWaalsContact C-CD 3.44Å; P169-L172 PolarHBondContact O-N 3.23Å; P169-R173 PolarHBondContact O-N 3.49Å; P169-R174 CarbonylContact C-O 3.33Å; P169-R174 WeakPolarHBondContact CB-O 3.17Å; P169-R174 CarbonylContact O-C 3.43Å; P169-R174 VanDerWaalsContact O-C 3.27Å; P169-R174 WeakPolarHBondContact O-CA 3.19Å; P169-R174 PolarHBondContact O-N 3.2Å; P169-R174 VanDerWaalsContact O-O 3.12Å; P169-Y176 HydrophobicContact CB-CE2 4.23Å; P169-Y176 HydrophobicContact CG-CE1 4.22Å; P169-Y176 HydrophobicContact CG-CE2 4.14Å; P169-F187 HydrophobicContact CG-CD1 4.16Å; P169-F187 HydrophobicContact CG-CE1 3.61Å; P169-L200 HydrophobicContact CB-CD1 3.99Å; P169-L200 HydrophobicContact CG-CD1 4.18Å; P169-L200 HydrophobicContact CG-CD2 4.2Å |
| 170 | V | 93.6 | Very high | 93.7 | Very high | 65 Ų | 65 | 65.5 Ų | 65.5 | 39% | 0.394 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -66.9 | -42.7 | 178.3 | -177.8 | 0 | 0 | 0 | 0 | 110.7 | V112 L167 L168 L172 R173 Y176 | V112-V170 HydrophobicContact CG2-CG2 3.88Å; L167-V170 PolarHBondContact O-N 2.95Å; L167-V170 VanDerWaalsContact O-N 3.1Å; L168-V170 VanDerWaalsContact C-N 3.34Å; L168-V170 PolarHBondContact O-N 2.99Å; V170-L172 VanDerWaalsContact C-N 3.3Å; V170-L172 PolarHBondContact O-N 2.98Å; V170-R173 PolarHBondContact O-N 2.81Å; V170-Y176 HydrophobicContact CG2-CE2 4.45Å |
| 171 | L | 93.9 | Very high | 92.9 | Very high | 125 Ų | 125 | 61.4 Ų | 61.4 | 65% | 0.654 | 30% | 0.304 | S | S | * | . | H | α-helix | trans | -64.2 | -34.7 | 177.7 | -66.9 | 174.5 | 0 | 0 | 0 | 112.6 | L167 L168 R173 | L167-L171 HydrophobicContact CB-CD1 4.41Å; L167-L171 WeakPolarHBondContact O-CG 3.18Å; L167-L171 PolarHBondContact O-N 2.9Å; L168-L171 PolarHBondContact O-N 2.71Å; L171-R173 VanDerWaalsContact C-N 3.27Å; L171-R173 PolarHBondContact O-N 3.01Å |
| 172 | L | 93.2 | Very high | 92.4 | Very high | 77 Ų | 77 | 66 Ų | 66 | 40% | 0.403 | 32% | 0.317 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -87.2 | 10.4 | 178.4 | -62.3 | 179.9 | 0 | 0 | 0 | 113.7 | L168 P169 V170 R174 L196 L200 | L168-L172 HydrophobicContact CD1-CD1 3.86Å; L168-L172 HydrophobicContact CD1-CG 4.07Å; L168-L172 HydrophobicContact CG-CD1 3.87Å; L168-L172 HydrophobicContact CG-CG 4.37Å; L168-L172 WeakPolarHBondContact O-CB 3.04Å; L168-L172 WeakPolarHBondContact O-CG 3.29Å; L168-L172 PolarHBondContact O-N 2.96Å; P169-L172 PolarHBondContact O-N 3.23Å; V170-L172 VanDerWaalsContact C-N 3.3Å; V170-L172 PolarHBondContact O-N 2.98Å; L172-R174 PolarHBondContact O-N 3.08Å; L172-L196 HydrophobicContact CB-CD2 3.92Å; L172-L196 HydrophobicContact CD1-CD1 3.74Å; L172-L196 HydrophobicContact CD1-CD2 3.89Å; L172-L196 HydrophobicContact CD1-CG 4.38Å; L172-L200 HydrophobicContact CD1-CD2 4.19Å |
| 173 | R | 91.4 | Very high | 91.8 | Very high | 222 Ų | 222 | 66.3 Ų | 66.3 | 84% | 0.838 | 32% | 0.319 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 56.3 | 34.3 | -177.9 | -55.2 | -172.2 | 178.2 | 113.3 | -1.6 | 113.5 | P169 V170 L171 P175 | P169-R173 PolarHBondContact O-N 3.49Å; V170-R173 PolarHBondContact O-N 2.81Å; L171-R173 VanDerWaalsContact C-N 3.27Å; L171-R173 PolarHBondContact O-N 3.01Å; R173-P175 VanDerWaalsContact C-CD 3.46Å; R173-P175 WeakPolarHBondContact O-CD 3.45Å |
| 174 | R | 91.5 | Very high | 91.5 | Very high | 98 Ų | 98 | 65.5 Ų | 65.5 | 37% | 0.37 | 31% | 0.31 | S | S | . | . | trans | -118.7 | 70.4 | 170.2 | -61.4 | -59.3 | 178 | -178.9 | 4.6 | 108.7 | P169 L172 D194 L196 L200 | P169-R174 CarbonylContact C-O 3.33Å; P169-R174 WeakPolarHBondContact CB-O 3.17Å; P169-R174 CarbonylContact O-C 3.43Å; P169-R174 VanDerWaalsContact O-C 3.27Å; P169-R174 WeakPolarHBondContact O-CA 3.19Å; P169-R174 PolarHBondContact O-N 3.2Å; P169-R174 VanDerWaalsContact O-O 3.12Å; L172-R174 PolarHBondContact O-N 3.08Å; R174-D194 IonicContact CZ-OD2 3.36Å; R174-D194 IonicContact NH1-OD2 3.62Å; R174-D194 IonicContact NH2-OD2 2.64Å; R174-D194 PolarHBondContact NH2-OD2 2.94Å; R174-L196 HydrophobicContact CG-CD2 3.65Å; R174-L196 HydrophobicContact CG-CG 4.25Å; R174-L200 HydrophobicContact CB-CD1 3.9Å; R174-L200 HydrophobicContact CG-CD1 4.41Å | ||
| 175 | P | 89.7 | Confident | 91.3 | Very high | 67 Ų | 67 | 60.9 Ų | 60.9 | 44% | 0.435 | 29% | 0.286 | S | S | . | . | trans | -61.6 | 161 | -177 | 28.3 | -35 | 0 | 0 | 0 | 111.6 | S108 R173 | S108-P175 WeakPolarHBondContact OG-CB 3.42Å; R173-P175 VanDerWaalsContact C-CD 3.46Å; R173-P175 WeakPolarHBondContact O-CD 3.45Å | ||
| 176 | Y | 93.6 | Very high | 91.1 | Very high | 8 Ų | 8 | 60.5 Ų | 60.5 | 3% | 0.031 | 28% | 0.284 | C | S | . | . | trans | -66.8 | 148.3 | 175 | -64.7 | -82.2 | 0 | 0 | 0 | 111.2 | S108 V112 V115 A166 P169 V170 F187 | S108-Y176 WeakPolarHBondContact O-CD2 3.42Å; V112-Y176 HydrophobicContact CB-CE2 4.28Å; V112-Y176 HydrophobicContact CG2-CD2 4.15Å; V112-Y176 HydrophobicContact CG2-CE2 3.61Å; V112-Y176 VanDerWaalsContact N-CE2 3.31Å; V115-Y176 HydrophobicContact CG2-CE1 3.73Å; V115-Y176 WeakPolarHBondContact CG2-OH 3.41Å; A166-Y176 PolarHBondContact O-OH 3.2Å; P169-Y176 HydrophobicContact CB-CE2 4.23Å; P169-Y176 HydrophobicContact CG-CE1 4.22Å; P169-Y176 HydrophobicContact CG-CE2 4.14Å; V170-Y176 HydrophobicContact CG2-CE2 4.45Å; Y176-F187 HydrophobicContact CD1-CD1 4.28Å; Y176-F187 HydrophobicContact CD1-CG 4.43Å; Y176-F187 AromaticContact CE1-CD1 3.73Å; Y176-F187 HydrophobicContact CE1-CD1 3.73Å; Y176-F187 HydrophobicContact CE1-CD2 4.36Å; Y176-F187 AromaticContact CE1-CE1 3.68Å; Y176-F187 HydrophobicContact CE1-CE1 3.68Å; Y176-F187 HydrophobicContact CE1-CE2 4.31Å; Y176-F187 HydrophobicContact CE1-CG 4.08Å; Y176-F187 AromaticContact CE1-CZ 3.98Å; Y176-F187 HydrophobicContact CE1-CZ 3.98Å | ||
| 177 | E | 91.1 | Very high | 90.8 | Very high | 93 Ų | 93 | 60.9 Ų | 60.9 | 44% | 0.435 | 29% | 0.285 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -118.7 | 154.7 | -177.8 | -69 | -165 | 178 | 0 | 0 | 112.9 | C107 Q179 C185 F186 H188 | C107-E177 VanDerWaalsContact SG-C 3.56Å; E177-Q179 PolarHBondContact O-N 2.93Å; E177-C185 WeakPolarHBondContact O-CA 3.5Å; E177-F186 PolarHBondContact N-O 3.21Å; E177-F186 PolarHBondContact O-N 3.32Å; E177-F186 VanDerWaalsContact O-O 3.13Å; E177-H188 HydrophobicContact CG-CB 4.36Å; E177-H188 IonicContact OE1-ND1 3.47Å; E177-H188 IonicContact OE2-CE1 3.73Å; E177-H188 PolarHBondContact OE2-CE1 2.94Å; E177-H188 IonicContact OE2-CG 3.61Å; E177-H188 IonicContact OE2-ND1 3.57Å; E177-H188 PolarHBondContact OE2-ND1 3.36Å |
| 178 | V | 91.1 | Very high | 90.3 | Very high | 54 Ų | 54 | 58.6 Ų | 58.6 | 33% | 0.327 | 27% | 0.272 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -70.4 | 121.6 | 177.4 | -179.3 | 0 | 0 | 0 | 0 | 109.1 | W97 C107 R182 | W97-V178 HydrophobicContact CB-CG2 4.32Å; W97-V178 HydrophobicContact CD2-CG1 4.18Å; W97-V178 HydrophobicContact CD2-CG2 3.48Å; W97-V178 VanDerWaalsContact CD2-CG2 3.48Å; W97-V178 HydrophobicContact CE3-CG2 3.78Å; W97-V178 HydrophobicContact CG-CG1 4.08Å; W97-V178 HydrophobicContact CG-CG2 3.73Å; W97-V178 HydrophobicContact CZ2-CG1 4.43Å; W97-V178 HydrophobicContact CZ2-CG2 4.33Å; W97-V178 HydrophobicContact CZ3-CG2 4.32Å; C107-V178 HydrophobicContact CB-CG2 4.39Å; C107-V178 VanDerWaalsContact SG-CG2 3.58Å; V178-R182 HydrophobicContact CG1-CB 4.3Å; V178-R182 HydrophobicContact CG1-CG 4.26Å |
| 179 | Q | 89.1 | Confident | 89.4 | Confident | 18 Ų | 18 | 57.3 Ų | 57.3 | 8% | 0.084 | 27% | 0.266 | C | S | . | . | trans | -74 | 159 | 179.6 | -63 | -63.7 | -41.9 | 0 | 0 | 111.6 | E177 S181 R182 W184 F186 F187 | E177-Q179 PolarHBondContact O-N 2.93Å; Q179-S181 PolarHBondContact O-N 3.27Å; Q179-R182 WeakPolarHBondContact O-CA 3.17Å; Q179-R182 PolarHBondContact O-N 3.26Å; Q179-W184 HydrophobicContact CB-CD2 4.31Å; Q179-W184 HydrophobicContact CB-CZ2 3.99Å; Q179-W184 HydrophobicContact CG-CD2 4.01Å; Q179-W184 HydrophobicContact CG-CE3 4.25Å; Q179-W184 HydrophobicContact CG-CH2 3.95Å; Q179-W184 HydrophobicContact CG-CZ2 3.69Å; Q179-W184 HydrophobicContact CG-CZ3 4.25Å; Q179-W184 PolarHBondContact N-O 3.31Å; Q179-W184 VanDerWaalsContact N-O 3.17Å; Q179-F186 HydrophobicContact CG-CB 4.01Å; Q179-F187 PolarHBondContact NE2-O 3.48Å | ||
| 180 | R | 81.1 | Confident | 88.2 | Confident | 117 Ų | 117 | 60.8 Ų | 60.8 | 44% | 0.442 | 28% | 0.282 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -47.3 | -33.6 | -176.9 | -163.5 | 177.9 | -69.7 | -170.7 | -29.3 | 115.4 | R182 E190 E278 P279 S281 | R180-R182 PolarHBondContact O-N 3.37Å; R180-E190 IonicContact CZ-OE1 3.76Å; R180-E190 IonicContact NE-OE1 3.07Å; R180-E190 PolarHBondContact NE-OE1 3.42Å; R180-E190 IonicContact NH2-OE1 3.05Å; R180-E278 IonicContact NH1-OE2 2.69Å; R180-E278 PolarHBondContact NH1-OE2 2.94Å; R180-P279 PolarHBondContact NH1-O 3.4Å; R180-S281 WeakPolarHBondContact CB-OG 3.19Å; R180-S281 WeakPolarHBondContact CD-OG 3.17Å; R180-S281 PolarHBondContact NE-OG 3.3Å |
| 181 | S | 80.2 | Confident | 87.1 | Confident | 31 Ų | 31 | 65.5 Ų | 65.5 | 22% | 0.217 | 30% | 0.299 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.8 | -15 | 175.9 | 65.7 | 0 | 0 | 0 | 0 | 115.3 | R95 Q179 S183 W184 | R95-S181 PolarHBondContact NH1-O 3.48Å; Q179-S181 PolarHBondContact O-N 3.27Å; S181-S183 PolarHBondContact O-N 2.91Å; S181-S183 VanDerWaalsContact O-N 3.1Å; S181-S183 PolarHBondContact OG-OG 3.46Å; S181-W184 PolarHBondContact OG-NE1 2.89Å |
| 182 | R | 86.3 | Confident | 86.1 | Confident | 145 Ų | 145 | 62.2 Ų | 62.2 | 55% | 0.547 | 29% | 0.286 | S | S | . | . | S | Bend | trans | 54.2 | 17.9 | -174.4 | -59 | -174.3 | 175.4 | -170.7 | -3.1 | 115.1 | V90 R95 W97 V178 Q179 R180 | V90-R182 WeakPolarHBondContact CG1-O 3.36Å; R95-R182 HydrophobicContact CB-CB 4.01Å; R95-R182 WeakPolarHBondContact CB-O 3.31Å; W97-R182 PolarHBondContact NE1-O 2.94Å; V178-R182 HydrophobicContact CG1-CB 4.3Å; V178-R182 HydrophobicContact CG1-CG 4.26Å; Q179-R182 WeakPolarHBondContact O-CA 3.17Å; Q179-R182 PolarHBondContact O-N 3.26Å; R180-R182 PolarHBondContact O-N 3.37Å |
| 183 | S | 86.8 | Confident | 85.2 | Confident | 7 Ų | 7 | 69 Ų | 69 | 5% | 0.049 | 31% | 0.306 | C | S | . | . | S | Bend | trans | -106.3 | -5.4 | -179.3 | 64.8 | 0 | 0 | 0 | 0 | 114.2 | S181 | S181-S183 PolarHBondContact O-N 2.91Å; S181-S183 VanDerWaalsContact O-N 3.1Å; S181-S183 PolarHBondContact OG-OG 3.46Å |
| 184 | W | 90.4 | Very high | 84.9 | Confident | 11 Ų | 11 | 61.6 Ų | 61.6 | 4% | 0.042 | 28% | 0.283 | C | S | . | . | trans | -160.4 | 161.1 | -175.6 | 64.1 | -65.2 | 0 | 0 | 0 | 111.6 | F110 M114 Q179 S181 F186 L284 V288 | F110-W184 HydrophobicContact CE1-CB 4.08Å; F110-W184 HydrophobicContact CZ-CB 4.03Å; M114-W184 HydrophobicContact CE-CE3 4.09Å; Q179-W184 HydrophobicContact CB-CD2 4.31Å; Q179-W184 HydrophobicContact CB-CZ2 3.99Å; Q179-W184 HydrophobicContact CG-CD2 4.01Å; Q179-W184 HydrophobicContact CG-CE3 4.25Å; Q179-W184 HydrophobicContact CG-CH2 3.95Å; Q179-W184 HydrophobicContact CG-CZ2 3.69Å; Q179-W184 HydrophobicContact CG-CZ3 4.25Å; Q179-W184 PolarHBondContact N-O 3.31Å; Q179-W184 VanDerWaalsContact N-O 3.17Å; S181-W184 PolarHBondContact OG-NE1 2.89Å; W184-F186 HydrophobicContact CE3-CB 3.73Å; W184-F186 HydrophobicContact CE3-CG 4.28Å; W184-F186 HydrophobicContact CH2-CB 3.91Å; W184-F186 HydrophobicContact CH2-CD1 4.18Å; W184-F186 HydrophobicContact CH2-CG 4.12Å; W184-F186 HydrophobicContact CZ3-CB 3.24Å; W184-F186 AromaticContact CZ3-CD1 3.95Å; W184-F186 HydrophobicContact CZ3-CD1 3.95Å; W184-F186 AromaticContact CZ3-CD2 3.94Å; W184-F186 HydrophobicContact CZ3-CD2 3.94Å; W184-F186 AromaticContact CZ3-CG 3.45Å; W184-F186 HydrophobicContact CZ3-CG 3.45Å; W184-F186 VanDerWaalsContact CZ3-CG 3.45Å; W184-L284 HydrophobicContact CH2-CD2 3.59Å; W184-L284 HydrophobicContact CH2-CG 3.7Å; W184-L284 HydrophobicContact CZ2-CD2 3.83Å; W184-L284 HydrophobicContact CZ2-CG 3.88Å; W184-V288 HydrophobicContact CH2-CG2 3.78Å; W184-V288 HydrophobicContact CZ2-CG2 4.41Å; W184-V288 HydrophobicContact CZ3-CG2 3.8Å | ||
| 185 | C | 93.1 | Very high | 84.7 | Confident | 0 Ų | 0 | 66.1 Ų | 66.1 | 0% | 0 | 30% | 0.3 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.1 | 139.3 | 178.9 | -71.8 | 0 | 0 | 0 | 0 | 111.3 | W97 C107 F110 E177 | W97-C185 WeakPolarHBondContact CH2-SG 3.38Å; C107-C185 WeakPolarHBondContact CA-SG 3.4Å; C107-C185 HydrophobicContact CB-CB 4.12Å; C107-C185 WeakPolarHBondContact CB-SG 3.37Å; C107-C185 VanDerWaalsContact O-CB 3.32Å; C107-C185 WeakPolarHBondContact O-CB 3.22Å; C107-C185 WeakPolarHBondContact SG-CB 3.14Å; C107-C185 CovalentContact SG-SG 2.04Å; C107-C185 PolarHBondContact SG-SG 2.99Å; F110-C185 HydrophobicContact CB-CB 4.28Å; F110-C185 HydrophobicContact CD1-CB 4.37Å; F110-C185 HydrophobicContact CG-CB 4.49Å; E177-C185 WeakPolarHBondContact O-CA 3.5Å |
| 186 | F | 92.5 | Very high | 84.7 | Confident | 5 Ų | 5 | 64 Ų | 64 | 2% | 0.022 | 29% | 0.285 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -157.3 | -177.4 | -179.6 | -156.4 | -122.2 | 0 | 0 | 0 | 110.8 | V115 E177 Q179 W184 M189 F204 V268 | V115-F186 HydrophobicContact CG2-CD2 4.38Å; V115-F186 HydrophobicContact CG2-CE2 3.86Å; E177-F186 PolarHBondContact N-O 3.21Å; E177-F186 PolarHBondContact O-N 3.32Å; E177-F186 VanDerWaalsContact O-O 3.13Å; Q179-F186 HydrophobicContact CG-CB 4.01Å; W184-F186 HydrophobicContact CE3-CB 3.73Å; W184-F186 HydrophobicContact CE3-CG 4.28Å; W184-F186 HydrophobicContact CH2-CB 3.91Å; W184-F186 HydrophobicContact CH2-CD1 4.18Å; W184-F186 HydrophobicContact CH2-CG 4.12Å; W184-F186 HydrophobicContact CZ3-CB 3.24Å; W184-F186 AromaticContact CZ3-CD1 3.95Å; W184-F186 HydrophobicContact CZ3-CD1 3.95Å; W184-F186 AromaticContact CZ3-CD2 3.94Å; W184-F186 HydrophobicContact CZ3-CD2 3.94Å; W184-F186 AromaticContact CZ3-CG 3.45Å; W184-F186 HydrophobicContact CZ3-CG 3.45Å; W184-F186 VanDerWaalsContact CZ3-CG 3.45Å; F186-M189 HydrophobicContact CD1-CE 3.7Å; F186-M189 HydrophobicContact CE1-CE 3.53Å; F186-F204 HydrophobicContact CZ-CD1 4.12Å; F186-F204 AromaticContact CZ-CE1 3.84Å; F186-F204 HydrophobicContact CZ-CE1 3.84Å; F186-F204 HydrophobicContact CZ-CZ 4.23Å; F186-V268 HydrophobicContact CE1-CG2 3.93Å; F186-V268 HydrophobicContact CZ-CG2 4.48Å |
| 187 | F | 91.8 | Very high | 84.5 | Confident | 7 Ų | 7 | 64.4 Ų | 64.4 | 3% | 0.031 | 29% | 0.288 | C | S | . | . | trans | -56 | 151.1 | -179.5 | -58.7 | -84.2 | 0 | 0 | 0 | 111.3 | V115 P169 Y176 Q179 M189 L200 P201 F204 | V115-F187 HydrophobicContact CG1-CZ 4.25Å; V115-F187 HydrophobicContact CG2-CD2 4.45Å; V115-F187 HydrophobicContact CG2-CE2 3.54Å; V115-F187 HydrophobicContact CG2-CZ 3.62Å; P169-F187 HydrophobicContact CG-CD1 4.16Å; P169-F187 HydrophobicContact CG-CE1 3.61Å; Y176-F187 HydrophobicContact CD1-CD1 4.28Å; Y176-F187 HydrophobicContact CD1-CG 4.43Å; Y176-F187 AromaticContact CE1-CD1 3.73Å; Y176-F187 HydrophobicContact CE1-CD1 3.73Å; Y176-F187 HydrophobicContact CE1-CD2 4.36Å; Y176-F187 AromaticContact CE1-CE1 3.68Å; Y176-F187 HydrophobicContact CE1-CE1 3.68Å; Y176-F187 HydrophobicContact CE1-CE2 4.31Å; Y176-F187 HydrophobicContact CE1-CG 4.08Å; Y176-F187 AromaticContact CE1-CZ 3.98Å; Y176-F187 HydrophobicContact CE1-CZ 3.98Å; Q179-F187 PolarHBondContact NE2-O 3.48Å; F187-M189 HydrophobicContact CB-CE 3.69Å; F187-M189 HydrophobicContact CB-SD 4.06Å; F187-M189 HydrophobicContact CD2-CE 4.07Å; F187-M189 HydrophobicContact CG-CE 4.32Å; F187-M189 WeakPolarHBondContact O-CG 3.35Å; F187-M189 PolarHBondContact O-N 2.9Å; F187-M189 VanDerWaalsContact O-N 3.15Å; F187-L200 HydrophobicContact CD1-CB 4Å; F187-L200 HydrophobicContact CE1-CB 3.98Å; F187-P201 HydrophobicContact CB-CB 3.96Å; F187-P201 HydrophobicContact CB-CG 4.38Å; F187-P201 HydrophobicContact CD1-CB 4.45Å; F187-P201 HydrophobicContact CD2-CB 3.9Å; F187-P201 HydrophobicContact CG-CB 3.88Å; F187-F204 HydrophobicContact CE2-CB 3.76Å; F187-F204 HydrophobicContact CE2-CD1 4.3Å; F187-F204 HydrophobicContact CE2-CD2 4.45Å; F187-F204 AromaticContact CE2-CG 3.92Å; F187-F204 HydrophobicContact CE2-CG 3.92Å; F187-F204 HydrophobicContact CZ-CB 3.88Å; F187-F204 HydrophobicContact CZ-CG 4.42Å | ||
| 188 | H | 86 | Confident | 84.5 | Confident | 34 Ų | 34 | 61.9 Ų | 61.9 | 16% | 0.157 | 28% | 0.278 | C | S | . | . | trans | -69.5 | 107 | 172.7 | -178.7 | 74.1 | 0 | 0 | 0 | 109.5 | E177 E190 | E177-H188 HydrophobicContact CG-CB 4.36Å; E177-H188 IonicContact OE1-ND1 3.47Å; E177-H188 IonicContact OE2-CE1 3.73Å; E177-H188 PolarHBondContact OE2-CE1 2.94Å; E177-H188 IonicContact OE2-CG 3.61Å; E177-H188 IonicContact OE2-ND1 3.57Å; E177-H188 PolarHBondContact OE2-ND1 3.36Å; H188-E190 PolarHBondContact CE1-O 3.49Å; H188-E190 PolarHBondContact NE2-O 3.3Å; H188-E190 VanDerWaalsContact NE2-O 3.16Å | ||
| 189 | M | 77.2 | Confident | 84.6 | Confident | 19 Ų | 19 | 62.4 Ų | 62.4 | 9% | 0.094 | 28% | 0.279 | C | S | . | . | trans | -114.5 | -12.6 | 179.9 | -48.9 | -67.3 | -164.9 | 0 | 0 | 112.7 | F186 F187 Q191 P201 V268 | F186-M189 HydrophobicContact CD1-CE 3.7Å; F186-M189 HydrophobicContact CE1-CE 3.53Å; F187-M189 HydrophobicContact CB-CE 3.69Å; F187-M189 HydrophobicContact CB-SD 4.06Å; F187-M189 HydrophobicContact CD2-CE 4.07Å; F187-M189 HydrophobicContact CG-CE 4.32Å; F187-M189 WeakPolarHBondContact O-CG 3.35Å; F187-M189 PolarHBondContact O-N 2.9Å; F187-M189 VanDerWaalsContact O-N 3.15Å; M189-Q191 PolarHBondContact O-N 2.91Å; M189-P201 HydrophobicContact CE-CB 3.37Å; M189-P201 HydrophobicContact CE-CG 4.21Å; M189-P201 HydrophobicContact SD-CB 3.5Å; M189-P201 WeakPolarHBondContact SD-CB 3.48Å; M189-P201 HydrophobicContact SD-CG 3.65Å; M189-V268 HydrophobicContact CE-CB 4.41Å; M189-V268 HydrophobicContact CE-CG1 3.48Å; M189-V268 VanDerWaalsContact CE-CG1 3.48Å; M189-V268 HydrophobicContact CE-CG2 4.23Å; M189-V268 HydrophobicContact SD-CG1 4.48Å | ||
| 190 | E | 69.3 | Low | 84.8 | Confident | 74 Ų | 74 | 61.9 Ų | 61.9 | 35% | 0.346 | 28% | 0.277 | S | S | . | . | S | Bend | trans | -87.5 | 101.4 | -176.8 | -67.5 | -165.5 | 164.2 | 0 | 0 | 108.6 | R180 H188 | R180-E190 IonicContact CZ-OE1 3.76Å; R180-E190 IonicContact NE-OE1 3.07Å; R180-E190 PolarHBondContact NE-OE1 3.42Å; R180-E190 IonicContact NH2-OE1 3.05Å; H188-E190 PolarHBondContact CE1-O 3.49Å; H188-E190 PolarHBondContact NE2-O 3.3Å; H188-E190 VanDerWaalsContact NE2-O 3.16Å |
| 191 | Q | 70.3 | Confident | 85.4 | Confident | 163 Ų | 163 | 56.4 Ų | 56.4 | 76% | 0.762 | 26% | 0.256 | S | S | * | . | S | Bend | trans | 62.7 | 73.7 | -179.8 | -60.2 | 178.7 | -16.2 | 0 | 0 | 114.1 | M189 R193 | M189-Q191 PolarHBondContact O-N 2.91Å; Q191-R193 PolarHBondContact O-N 3.45Å |
| 192 | P | 73.5 | Confident | 86.1 | Confident | 57 Ų | 57 | 57.3 Ų | 57.3 | 37% | 0.37 | 26% | 0.259 | S | S | . | . | trans | -58.3 | 124.5 | 178.2 | 24.3 | -32.5 | 0 | 0 | 0 | 110.6 | D197 V198 | P192-D197 HydrophobicContact CB-CB 4.02Å; P192-V198 HydrophobicContact CB-CG2 3.7Å; P192-V198 HydrophobicContact CG-CG2 3.99Å | ||
| 193 | R | 73.4 | Confident | 86.6 | Confident | 219 Ų | 219 | 52.6 Ų | 52.6 | 83% | 0.826 | 24% | 0.244 | S | C | * | . | trans | -88.5 | -36.7 | 179.6 | -62.9 | -179.6 | -174 | 176.7 | 2.5 | 111.1 | Q191 D197 | Q191-R193 PolarHBondContact O-N 3.45Å; R193-D197 PolarHBondContact N-OD2 3.36Å | ||
| 194 | D | 84.3 | Confident | 87.1 | Confident | 67 Ų | 67 | 52.4 Ų | 52.4 | 36% | 0.358 | 24% | 0.242 | S | C | . | . | S | Bend | trans | -122 | 157.7 | -176.1 | -66.6 | -44.8 | 0 | 0 | 0 | 112.1 | R174 L196 D197 | R174-D194 IonicContact CZ-OD2 3.36Å; R174-D194 IonicContact NH1-OD2 3.62Å; R174-D194 IonicContact NH2-OD2 2.64Å; R174-D194 PolarHBondContact NH2-OD2 2.94Å; D194-L196 PolarHBondContact O-N 2.88Å; D194-L196 VanDerWaalsContact O-N 3.14Å; D194-D197 PolarHBondContact N-OD2 3.22Å; D194-D197 PolarHBondContact O-N 3.1Å; D194-D197 VanDerWaalsContact O-N 3.13Å |
| 195 | W | 88.1 | Confident | 87.3 | Confident | 193 Ų | 193 | 51.9 Ų | 51.9 | 73% | 0.731 | 24% | 0.24 | S | C | * | . | H | α-helix | trans | -59.1 | -26.1 | 175.7 | 63.2 | -91.1 | 0 | 0 | 0 | 113.1 | V198 L199 | W195-V198 PolarHBondContact O-N 2.89Å; W195-L199 HydrophobicContact CE3-CB 4.32Å; W195-L199 HydrophobicContact CE3-CD2 4.09Å; W195-L199 HydrophobicContact CZ3-CD2 3.56Å; W195-L199 WeakPolarHBondContact O-CB 3.44Å; W195-L199 PolarHBondContact O-N 3.36Å |
| 196 | L | 90.7 | Very high | 87.5 | Confident | 21 Ų | 21 | 54.9 Ų | 54.9 | 11% | 0.11 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -71.3 | -33.5 | 179.8 | -172.8 | 60.8 | 0 | 0 | 0 | 112.2 | L172 R174 D194 V198 L199 L200 | L172-L196 HydrophobicContact CB-CD2 3.92Å; L172-L196 HydrophobicContact CD1-CD1 3.74Å; L172-L196 HydrophobicContact CD1-CD2 3.89Å; L172-L196 HydrophobicContact CD1-CG 4.38Å; R174-L196 HydrophobicContact CG-CD2 3.65Å; R174-L196 HydrophobicContact CG-CG 4.25Å; D194-L196 PolarHBondContact O-N 2.88Å; D194-L196 VanDerWaalsContact O-N 3.14Å; L196-V198 PolarHBondContact O-N 3.35Å; L196-L199 HydrophobicContact CD1-CD2 4.41Å; L196-L199 PolarHBondContact O-N 2.9Å; L196-L200 HydrophobicContact CD1-CD1 4.25Å; L196-L200 HydrophobicContact CD1-CD2 4.23Å; L196-L200 HydrophobicContact CD1-CG 3.9Å; L196-L200 HydrophobicContact CG-CD1 3.95Å; L196-L200 HydrophobicContact CG-CG 4.11Å; L196-L200 WeakPolarHBondContact O-CG 3.36Å; L196-L200 PolarHBondContact O-N 2.98Å |
| 197 | D | 88.3 | Confident | 87.8 | Confident | 17 Ų | 17 | 57 Ų | 57 | 9% | 0.091 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -66.3 | -25.5 | 176.5 | -59.2 | -28.1 | 0 | 0 | 0 | 111.2 | P192 R193 D194 P201 | P192-D197 HydrophobicContact CB-CB 4.02Å; R193-D197 PolarHBondContact N-OD2 3.36Å; D194-D197 PolarHBondContact N-OD2 3.22Å; D194-D197 PolarHBondContact O-N 3.1Å; D194-D197 VanDerWaalsContact O-N 3.13Å; D197-P201 WeakPolarHBondContact O-CD 3.4Å; D197-P201 WeakPolarHBondContact O-CG 3.33Å |
| 198 | V | 90.6 | Very high | 88.1 | Confident | 40 Ų | 40 | 56.6 Ų | 56.6 | 24% | 0.242 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -83.8 | -42.2 | 171.6 | 180 | 0 | 0 | 0 | 0 | 111.4 | P192 W195 L196 P201 L202 S272 | P192-V198 HydrophobicContact CB-CG2 3.7Å; P192-V198 HydrophobicContact CG-CG2 3.99Å; W195-V198 PolarHBondContact O-N 2.89Å; L196-V198 PolarHBondContact O-N 3.35Å; V198-P201 WeakPolarHBondContact O-CD 3.42Å; V198-P201 WeakPolarHBondContact O-CG 3.48Å; V198-L202 WeakPolarHBondContact O-CB 3.36Å; V198-L202 PolarHBondContact O-N 2.97Å; V198-S272 WeakPolarHBondContact CG1-O 3.04Å |
| 199 | L | 93 | Very high | 88.6 | Confident | 66 Ų | 66 | 57.5 Ų | 57.5 | 35% | 0.346 | 27% | 0.273 | S | S | . | . | H | α-helix | trans | -66.9 | -43.7 | -174.2 | 179.9 | 64.8 | 0 | 0 | 0 | 112.8 | W195 L196 L202 I203 | W195-L199 HydrophobicContact CE3-CB 4.32Å; W195-L199 HydrophobicContact CE3-CD2 4.09Å; W195-L199 HydrophobicContact CZ3-CD2 3.56Å; W195-L199 WeakPolarHBondContact O-CB 3.44Å; W195-L199 PolarHBondContact O-N 3.36Å; L196-L199 HydrophobicContact CD1-CD2 4.41Å; L196-L199 PolarHBondContact O-N 2.9Å; L199-L202 WeakPolarHBondContact O-CB 3.49Å; L199-L202 PolarHBondContact O-N 3.36Å; L199-I203 HydrophobicContact CD1-CD1 4.1Å; L199-I203 HydrophobicContact CD1-CG1 4.04Å; L199-I203 HydrophobicContact CD2-CD1 4.24Å; L199-I203 HydrophobicContact CG-CD1 3.77Å; L199-I203 HydrophobicContact CG-CG1 4.17Å; L199-I203 VanDerWaalsContact O-CG1 3.32Å; L199-I203 WeakPolarHBondContact O-CG1 3.11Å; L199-I203 PolarHBondContact O-N 3.5Å |
| 200 | L | 94.2 | Very high | 89.6 | Confident | 7 Ų | 7 | 61.4 Ų | 61.4 | 4% | 0.037 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -58 | -54.2 | -177.4 | -70 | 171.7 | 0 | 0 | 0 | 113.7 | L168 P169 L172 R174 F187 L196 L202 I203 F204 | L168-L200 HydrophobicContact CB-CD2 4.38Å; L168-L200 HydrophobicContact CD2-CD2 3.7Å; L168-L200 HydrophobicContact CG-CD2 3.81Å; P169-L200 HydrophobicContact CB-CD1 3.99Å; P169-L200 HydrophobicContact CG-CD1 4.18Å; P169-L200 HydrophobicContact CG-CD2 4.2Å; L172-L200 HydrophobicContact CD1-CD2 4.19Å; R174-L200 HydrophobicContact CB-CD1 3.9Å; R174-L200 HydrophobicContact CG-CD1 4.41Å; F187-L200 HydrophobicContact CD1-CB 4Å; F187-L200 HydrophobicContact CE1-CB 3.98Å; L196-L200 HydrophobicContact CD1-CD1 4.25Å; L196-L200 HydrophobicContact CD1-CD2 4.23Å; L196-L200 HydrophobicContact CD1-CG 3.9Å; L196-L200 HydrophobicContact CG-CD1 3.95Å; L196-L200 HydrophobicContact CG-CG 4.11Å; L196-L200 WeakPolarHBondContact O-CG 3.36Å; L196-L200 PolarHBondContact O-N 2.98Å; L200-L202 VanDerWaalsContact C-N 3.27Å; L200-L202 PolarHBondContact O-N 3.32Å; L200-I203 PolarHBondContact O-N 2.93Å; L200-F204 PolarHBondContact O-N 2.89Å |
| 201 | P | 93.8 | Very high | 90.9 | Very high | 1 Ų | 1 | 58.1 Ų | 58.1 | 1% | 0.006 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -67.6 | -27.1 | 175.6 | 27.9 | -36.7 | 0 | 0 | 0 | 113.3 | F187 M189 D197 V198 S205 V268 S272 | F187-P201 HydrophobicContact CB-CB 3.96Å; F187-P201 HydrophobicContact CB-CG 4.38Å; F187-P201 HydrophobicContact CD1-CB 4.45Å; F187-P201 HydrophobicContact CD2-CB 3.9Å; F187-P201 HydrophobicContact CG-CB 3.88Å; M189-P201 HydrophobicContact CE-CB 3.37Å; M189-P201 HydrophobicContact CE-CG 4.21Å; M189-P201 HydrophobicContact SD-CB 3.5Å; M189-P201 WeakPolarHBondContact SD-CB 3.48Å; M189-P201 HydrophobicContact SD-CG 3.65Å; D197-P201 WeakPolarHBondContact O-CD 3.4Å; D197-P201 WeakPolarHBondContact O-CG 3.33Å; V198-P201 WeakPolarHBondContact O-CD 3.42Å; V198-P201 WeakPolarHBondContact O-CG 3.48Å; P201-S205 WeakPolarHBondContact O-CB 3.26Å; P201-S205 PolarHBondContact O-N 3Å; P201-S205 PolarHBondContact O-OG 3.37Å; P201-V268 HydrophobicContact CB-CG1 3.79Å; P201-S272 WeakPolarHBondContact CG-OG 3.24Å |
| 202 | L | 94.6 | Very high | 92.2 | Very high | 51 Ų | 51 | 50.7 Ų | 50.7 | 27% | 0.267 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -67.2 | -42.7 | 173.4 | -171.1 | 69.9 | 0 | 0 | 0 | 111.2 | V198 L199 L200 F204 S205 V206 I269 | V198-L202 WeakPolarHBondContact O-CB 3.36Å; V198-L202 PolarHBondContact O-N 2.97Å; L199-L202 WeakPolarHBondContact O-CB 3.49Å; L199-L202 PolarHBondContact O-N 3.36Å; L200-L202 VanDerWaalsContact C-N 3.27Å; L200-L202 PolarHBondContact O-N 3.32Å; L202-F204 VanDerWaalsContact C-N 3.34Å; L202-F204 PolarHBondContact O-N 2.98Å; L202-S205 PolarHBondContact O-N 2.99Å; L202-V206 HydrophobicContact CD1-CG2 3.93Å; L202-V206 HydrophobicContact CG-CG2 3.96Å; L202-V206 VanDerWaalsContact O-CB 3.31Å; L202-V206 WeakPolarHBondContact O-CB 3.46Å; L202-V206 VanDerWaalsContact O-CG2 3.29Å; L202-V206 WeakPolarHBondContact O-CG2 3.33Å; L202-V206 PolarHBondContact O-N 2.96Å; L202-I269 HydrophobicContact CD1-CG1 4.2Å; L202-I269 HydrophobicContact CD1-CG2 4.4Å |
| 203 | I | 96.5 | Very high | 93.3 | Very high | 46 Ų | 46 | 52.2 Ų | 52.2 | 24% | 0.236 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -57.5 | -48.5 | 175 | -72.4 | 167.1 | 0 | 0 | 0 | 110.2 | V165 L168 L199 L200 S205 L207 | V165-I203 HydrophobicContact CG1-CG2 4Å; V165-I203 HydrophobicContact CG2-CG2 4.22Å; L168-I203 HydrophobicContact CD2-CD1 4.17Å; L199-I203 HydrophobicContact CD1-CD1 4.1Å; L199-I203 HydrophobicContact CD1-CG1 4.04Å; L199-I203 HydrophobicContact CD2-CD1 4.24Å; L199-I203 HydrophobicContact CG-CD1 3.77Å; L199-I203 HydrophobicContact CG-CG1 4.17Å; L199-I203 VanDerWaalsContact O-CG1 3.32Å; L199-I203 WeakPolarHBondContact O-CG1 3.11Å; L199-I203 PolarHBondContact O-N 3.5Å; L200-I203 PolarHBondContact O-N 2.93Å; I203-S205 VanDerWaalsContact C-N 3.33Å; I203-S205 PolarHBondContact O-N 3.44Å; I203-L207 HydrophobicContact CG2-CD1 3.66Å; I203-L207 HydrophobicContact CG2-CG 4.33Å; I203-L207 VanDerWaalsContact O-CB 3.26Å; I203-L207 WeakPolarHBondContact O-CB 3.37Å; I203-L207 VanDerWaalsContact O-CG 3.24Å; I203-L207 WeakPolarHBondContact O-CG 3.47Å; I203-L207 PolarHBondContact O-N 2.94Å |
| 204 | F | 96.7 | Very high | 94.4 | Very high | 3 Ų | 3 | 45.7 Ų | 45.7 | 1% | 0.013 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -54.2 | -50.4 | 175 | 167.1 | -99 | 0 | 0 | 0 | 111.5 | V115 L119 F186 F187 L200 L202 G208 L265 | V115-F204 HydrophobicContact CG1-CD2 3.85Å; V115-F204 HydrophobicContact CG1-CE2 4.36Å; V115-F204 HydrophobicContact CG2-CD2 4.47Å; L119-F204 HydrophobicContact CD1-CD2 3.81Å; L119-F204 HydrophobicContact CD1-CE2 4.44Å; L119-F204 HydrophobicContact CD2-CD2 3.66Å; L119-F204 HydrophobicContact CD2-CE2 3.85Å; L119-F204 HydrophobicContact CD2-CG 4.49Å; L119-F204 HydrophobicContact CG-CD2 3.54Å; L119-F204 HydrophobicContact CG-CE2 3.71Å; F186-F204 HydrophobicContact CZ-CD1 4.12Å; F186-F204 AromaticContact CZ-CE1 3.84Å; F186-F204 HydrophobicContact CZ-CE1 3.84Å; F186-F204 HydrophobicContact CZ-CZ 4.23Å; F187-F204 HydrophobicContact CE2-CB 3.76Å; F187-F204 HydrophobicContact CE2-CD1 4.3Å; F187-F204 HydrophobicContact CE2-CD2 4.45Å; F187-F204 AromaticContact CE2-CG 3.92Å; F187-F204 HydrophobicContact CE2-CG 3.92Å; F187-F204 HydrophobicContact CZ-CB 3.88Å; F187-F204 HydrophobicContact CZ-CG 4.42Å; L200-F204 PolarHBondContact O-N 2.89Å; L202-F204 VanDerWaalsContact C-N 3.34Å; L202-F204 PolarHBondContact O-N 2.98Å; F204-G208 PolarHBondContact O-N 2.9Å; F204-L265 HydrophobicContact CE1-CD2 4.09Å; F204-L265 HydrophobicContact CZ-CD2 4.48Å |
| 205 | S | 96.4 | Very high | 94.9 | Very high | 0 Ų | 0 | 42.6 Ų | 42.6 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -72.4 | -42.1 | -173 | -54.2 | 0 | 0 | 0 | 0 | 113.2 | P201 L202 I203 G208 L209 V268 | P201-S205 WeakPolarHBondContact O-CB 3.26Å; P201-S205 PolarHBondContact O-N 3Å; P201-S205 PolarHBondContact O-OG 3.37Å; L202-S205 PolarHBondContact O-N 2.99Å; I203-S205 VanDerWaalsContact C-N 3.33Å; I203-S205 PolarHBondContact O-N 3.44Å; S205-G208 PolarHBondContact O-N 2.96Å; S205-L209 WeakPolarHBondContact O-CB 3.37Å; S205-L209 PolarHBondContact O-N 3.37Å; S205-V268 WeakPolarHBondContact OG-CB 3.37Å; S205-V268 WeakPolarHBondContact OG-CG1 3.3Å |
| 206 | V | 97 | Very high | 95.3 | Very high | 62 Ų | 62 | 35.4 Ų | 35.4 | 38% | 0.376 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -67.3 | -46.4 | 179.4 | 170.9 | 0 | 0 | 0 | 0 | 110.2 | L202 G208 L209 L210 | L202-V206 HydrophobicContact CD1-CG2 3.93Å; L202-V206 HydrophobicContact CG-CG2 3.96Å; L202-V206 VanDerWaalsContact O-CB 3.31Å; L202-V206 WeakPolarHBondContact O-CB 3.46Å; L202-V206 VanDerWaalsContact O-CG2 3.29Å; L202-V206 WeakPolarHBondContact O-CG2 3.33Å; L202-V206 PolarHBondContact O-N 2.96Å; V206-G208 VanDerWaalsContact C-N 3.34Å; V206-G208 PolarHBondContact O-N 3.19Å; V206-L209 PolarHBondContact O-N 2.98Å; V206-L210 HydrophobicContact CG1-CD1 3.89Å; V206-L210 HydrophobicContact CG1-CG 4.28Å; V206-L210 WeakPolarHBondContact O-CB 3.39Å; V206-L210 VanDerWaalsContact O-CG 3.23Å; V206-L210 WeakPolarHBondContact O-CG 3.28Å; V206-L210 PolarHBondContact O-N 3.4Å |
| 207 | L | 97.9 | Very high | 95.5 | Very high | 49 Ų | 49 | 38.1 Ų | 38.1 | 26% | 0.257 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -62.7 | -42.6 | 176.5 | -70.5 | 176.4 | 0 | 0 | 0 | 111.7 | F123 V165 I203 L210 A211 | F123-L207 HydrophobicContact CE1-CB 4.26Å; F123-L207 HydrophobicContact CZ-CB 4.03Å; F123-L207 HydrophobicContact CZ-CD1 4.48Å; V165-L207 HydrophobicContact CG2-CD1 3.65Å; I203-L207 HydrophobicContact CG2-CD1 3.66Å; I203-L207 HydrophobicContact CG2-CG 4.33Å; I203-L207 VanDerWaalsContact O-CB 3.26Å; I203-L207 WeakPolarHBondContact O-CB 3.37Å; I203-L207 VanDerWaalsContact O-CG 3.24Å; I203-L207 WeakPolarHBondContact O-CG 3.47Å; I203-L207 PolarHBondContact O-N 2.94Å; L207-L210 PolarHBondContact O-N 3.38Å; L207-A211 WeakPolarHBondContact O-CB 3.49Å; L207-A211 PolarHBondContact O-N 2.93Å |
| 208 | G | 97.5 | Very high | 95.8 | Very high | 0 Ų | 0 | 37.8 Ų | 37.8 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -61.8 | -42.4 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | F204 S205 V206 A211 L212 | F204-G208 PolarHBondContact O-N 2.9Å; S205-G208 PolarHBondContact O-N 2.96Å; V206-G208 VanDerWaalsContact C-N 3.34Å; V206-G208 PolarHBondContact O-N 3.19Å; G208-A211 PolarHBondContact O-N 3.29Å; G208-L212 WeakPolarHBondContact O-CB 3.43Å; G208-L212 PolarHBondContact O-N 3.42Å |
| 209 | L | 97.3 | Very high | 95.9 | Very high | 52 Ų | 52 | 36 Ų | 36 | 27% | 0.272 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -69.8 | -40.9 | 179.7 | -170.7 | 65.6 | 0 | 0 | 0 | 111.5 | S205 V206 A211 L212 L213 L265 I269 | S205-L209 WeakPolarHBondContact O-CB 3.37Å; S205-L209 PolarHBondContact O-N 3.37Å; V206-L209 PolarHBondContact O-N 2.98Å; L209-A211 VanDerWaalsContact C-N 3.33Å; L209-A211 PolarHBondContact O-N 2.83Å; L209-L212 PolarHBondContact O-N 2.83Å; L209-L213 HydrophobicContact CG-CD1 4.22Å; L209-L213 HydrophobicContact CG-CG 4.43Å; L209-L213 WeakPolarHBondContact O-CB 3.45Å; L209-L213 VanDerWaalsContact O-CG 3.25Å; L209-L213 WeakPolarHBondContact O-CG 3.33Å; L209-L213 PolarHBondContact O-N 3.4Å; L209-L265 HydrophobicContact CB-CD1 4.45Å; L209-I269 HydrophobicContact CD2-CD1 4.37Å |
| 210 | L | 97.9 | Very high | 95.9 | Very high | 101 Ų | 101 | 35.6 Ų | 35.6 | 53% | 0.529 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -60.8 | -42.9 | 173.7 | -72.7 | 173.3 | 0 | 0 | 0 | 111.3 | V206 L207 L213 L214 | V206-L210 HydrophobicContact CG1-CD1 3.89Å; V206-L210 HydrophobicContact CG1-CG 4.28Å; V206-L210 WeakPolarHBondContact O-CB 3.39Å; V206-L210 VanDerWaalsContact O-CG 3.23Å; V206-L210 WeakPolarHBondContact O-CG 3.28Å; V206-L210 PolarHBondContact O-N 3.4Å; L207-L210 PolarHBondContact O-N 3.38Å; L210-L213 PolarHBondContact O-N 2.92Å; L210-L214 VanDerWaalsContact O-CB 3.28Å; L210-L214 WeakPolarHBondContact O-CB 3.48Å; L210-L214 PolarHBondContact O-N 3.47Å |
| 211 | A | 97.6 | Very high | 95.9 | Very high | 6 Ų | 6 | 39.2 Ų | 39.2 | 5% | 0.05 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -63.8 | -43.9 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | L122 F123 S126 L207 G208 L209 L214 S215 | L122-A211 HydrophobicContact CB-CB 4.21Å; F123-A211 HydrophobicContact CD1-CB 3.75Å; F123-A211 HydrophobicContact CE1-CB 4.03Å; S126-A211 VanDerWaalsContact CB-O 3.29Å; S126-A211 WeakPolarHBondContact CB-O 3.39Å; L207-A211 WeakPolarHBondContact O-CB 3.49Å; L207-A211 PolarHBondContact O-N 2.93Å; G208-A211 PolarHBondContact O-N 3.29Å; L209-A211 VanDerWaalsContact C-N 3.33Å; L209-A211 PolarHBondContact O-N 2.83Å; A211-L214 PolarHBondContact O-N 2.98Å; A211-S215 WeakPolarHBondContact O-CB 3.46Å; A211-S215 PolarHBondContact O-N 2.81Å |
| 212 | L | 96.8 | Very high | 95.7 | Very high | 7 Ų | 7 | 39.1 Ų | 39.1 | 4% | 0.037 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -61.8 | -47.5 | 176.2 | -177.7 | 63 | 0 | 0 | 0 | 111.5 | L122 G208 L209 S215 I216 W261 L265 | L122-L212 HydrophobicContact CD2-CB 4.48Å; G208-L212 WeakPolarHBondContact O-CB 3.43Å; G208-L212 PolarHBondContact O-N 3.42Å; L209-L212 PolarHBondContact O-N 2.83Å; L212-S215 WeakPolarHBondContact O-CB 3.08Å; L212-S215 PolarHBondContact O-N 2.95Å; L212-I216 HydrophobicContact CD1-CD1 4.48Å; L212-I216 HydrophobicContact CG-CD1 4.1Å; L212-I216 VanDerWaalsContact O-CG1 3.28Å; L212-I216 WeakPolarHBondContact O-CG1 3.37Å; L212-I216 PolarHBondContact O-N 3.27Å; L212-W261 HydrophobicContact CD2-CB 4.36Å; L212-L265 HydrophobicContact CD2-CD1 4.29Å |
| 213 | L | 97.3 | Very high | 95.5 | Very high | 88 Ų | 88 | 37.2 Ų | 37.2 | 46% | 0.461 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -61.5 | -44.7 | 176.8 | -73.4 | 174.9 | 0 | 0 | 0 | 111.8 | L209 L210 S215 I216 V217 | L209-L213 HydrophobicContact CG-CD1 4.22Å; L209-L213 HydrophobicContact CG-CG 4.43Å; L209-L213 WeakPolarHBondContact O-CB 3.45Å; L209-L213 VanDerWaalsContact O-CG 3.25Å; L209-L213 WeakPolarHBondContact O-CG 3.33Å; L209-L213 PolarHBondContact O-N 3.4Å; L210-L213 PolarHBondContact O-N 2.92Å; L213-S215 VanDerWaalsContact C-N 3.29Å; L213-S215 PolarHBondContact O-N 3.3Å; L213-I216 PolarHBondContact O-N 3.27Å; L213-V217 WeakPolarHBondContact O-CG2 3.37Å; L213-V217 PolarHBondContact O-N 3.45Å |
| 214 | L | 96.7 | Very high | 95.2 | Very high | 82 Ų | 82 | 38.4 Ų | 38.4 | 43% | 0.429 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -58 | -44.4 | 175.4 | 178.6 | 61.4 | 0 | 0 | 0 | 111 | V130 L210 A211 I216 V217 C218 | V130-L214 HydrophobicContact CG2-CD1 4.46Å; V130-L214 HydrophobicContact CG2-CD2 4.24Å; V130-L214 HydrophobicContact CG2-CG 4.31Å; L210-L214 VanDerWaalsContact O-CB 3.28Å; L210-L214 WeakPolarHBondContact O-CB 3.48Å; L210-L214 PolarHBondContact O-N 3.47Å; A211-L214 PolarHBondContact O-N 2.98Å; L214-I216 PolarHBondContact O-N 3.46Å; L214-V217 PolarHBondContact O-N 2.98Å; L214-C218 WeakPolarHBondContact O-CB 3.26Å; L214-C218 PolarHBondContact O-N 3.49Å; L214-C218 PolarHBondContact O-SG 3.48Å; L214-C218 VanDerWaalsContact O-SG 3.35Å |
| 215 | S | 95.1 | Very high | 94.7 | Very high | 3 Ų | 3 | 40 Ų | 40 | 2% | 0.021 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -60 | -46 | 175.8 | -170.2 | 0 | 0 | 0 | 0 | 111.9 | A211 L212 L213 C218 N219 | A211-S215 WeakPolarHBondContact O-CB 3.46Å; A211-S215 PolarHBondContact O-N 2.81Å; L212-S215 WeakPolarHBondContact O-CB 3.08Å; L212-S215 PolarHBondContact O-N 2.95Å; L213-S215 VanDerWaalsContact C-N 3.29Å; L213-S215 PolarHBondContact O-N 3.3Å; S215-C218 PolarHBondContact O-N 3.19Å; S215-N219 VanDerWaalsContact O-CB 3.25Å; S215-N219 WeakPolarHBondContact O-CB 3.38Å; S215-N219 PolarHBondContact O-N 2.71Å; S215-N219 PolarHBondContact O-ND2 2.78Å; S215-N219 PolarHBondContact OG-ND2 3.23Å |
| 216 | I | 94.9 | Very high | 94.2 | Very high | 41 Ų | 41 | 40.8 Ų | 40.8 | 21% | 0.21 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -61.4 | -48.7 | 178 | -66.2 | 161.1 | 0 | 0 | 0 | 110.9 | L212 L213 L214 N219 T220 C258 | L212-I216 HydrophobicContact CD1-CD1 4.48Å; L212-I216 HydrophobicContact CG-CD1 4.1Å; L212-I216 VanDerWaalsContact O-CG1 3.28Å; L212-I216 WeakPolarHBondContact O-CG1 3.37Å; L212-I216 PolarHBondContact O-N 3.27Å; L213-I216 PolarHBondContact O-N 3.27Å; L214-I216 PolarHBondContact O-N 3.46Å; I216-N219 PolarHBondContact O-N 3.48Å; I216-T220 VanDerWaalsContact O-CB 3.26Å; I216-T220 WeakPolarHBondContact O-CB 3.31Å; I216-T220 PolarHBondContact O-N 2.8Å; I216-T220 PolarHBondContact O-OG1 2.8Å; I216-C258 WeakPolarHBondContact CD1-SG 3.28Å |
| 217 | V | 96.4 | Very high | 93.7 | Very high | 78 Ų | 78 | 42.1 Ų | 42.1 | 47% | 0.473 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -61.4 | -49.4 | -179.8 | 171.3 | 0 | 0 | 0 | 0 | 110.1 | L213 L214 N219 T220 L221 | L213-V217 WeakPolarHBondContact O-CG2 3.37Å; L213-V217 PolarHBondContact O-N 3.45Å; L214-V217 PolarHBondContact O-N 2.98Å; V217-N219 PolarHBondContact O-N 2.84Å; V217-T220 PolarHBondContact O-N 3.31Å; V217-L221 HydrophobicContact CG1-CD1 3.84Å; V217-L221 HydrophobicContact CG1-CG 4.31Å; V217-L221 WeakPolarHBondContact O-CB 3.37Å; V217-L221 VanDerWaalsContact O-CG 3.26Å; V217-L221 WeakPolarHBondContact O-CG 3.25Å; V217-L221 PolarHBondContact O-N 3.45Å |
| 218 | C | 94.5 | Very high | 93.2 | Very high | 11 Ų | 11 | 44.8 Ų | 44.8 | 7% | 0.074 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -62.2 | -44.8 | 179.4 | -73.1 | 0 | 0 | 0 | 0 | 112.6 | A129 F133 L214 S215 T220 L221 A222 | A129-C218 HydrophobicContact CB-CB 3.92Å; F133-C218 HydrophobicContact CB-CB 4.19Å; L214-C218 WeakPolarHBondContact O-CB 3.26Å; L214-C218 PolarHBondContact O-N 3.49Å; L214-C218 PolarHBondContact O-SG 3.48Å; L214-C218 VanDerWaalsContact O-SG 3.35Å; S215-C218 PolarHBondContact O-N 3.19Å; C218-T220 VanDerWaalsContact C-N 3.34Å; C218-T220 PolarHBondContact O-N 3.35Å; C218-L221 PolarHBondContact O-N 3.01Å; C218-A222 VanDerWaalsContact O-CB 3.27Å; C218-A222 WeakPolarHBondContact O-CB 3.35Å; C218-A222 PolarHBondContact O-N 2.82Å |
| 219 | N | 92.6 | Very high | 92.4 | Very high | 3 Ų | 3 | 46 Ų | 46 | 2% | 0.016 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -67.4 | -34.5 | 178.2 | -71.4 | -33.8 | 0 | 0 | 0 | 112.1 | A129 S215 I216 V217 S223 M254 | A129-N219 WeakPolarHBondContact CB-OD1 3.26Å; S215-N219 VanDerWaalsContact O-CB 3.25Å; S215-N219 WeakPolarHBondContact O-CB 3.38Å; S215-N219 PolarHBondContact O-N 2.71Å; S215-N219 PolarHBondContact O-ND2 2.78Å; S215-N219 PolarHBondContact OG-ND2 3.23Å; I216-N219 PolarHBondContact O-N 3.48Å; V217-N219 PolarHBondContact O-N 2.84Å; N219-S223 WeakPolarHBondContact O-CB 3.24Å; N219-S223 PolarHBondContact O-N 2.87Å; N219-S223 PolarHBondContact O-OG 3.28Å; N219-M254 HydrophobicContact CB-CG 3.48Å; N219-M254 VanDerWaalsContact CB-CG 3.48Å; N219-M254 HydrophobicContact CB-SD 3.3Å; N219-M254 WeakPolarHBondContact CB-SD 3.32Å |
| 220 | T | 93.3 | Very high | 91.6 | Very high | 56 Ų | 56 | 45.5 Ų | 45.5 | 34% | 0.344 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -66.6 | -49.4 | 174 | -58.4 | 0 | 0 | 0 | 0 | 110.7 | I216 V217 C218 A222 S223 C224 | I216-T220 VanDerWaalsContact O-CB 3.26Å; I216-T220 WeakPolarHBondContact O-CB 3.31Å; I216-T220 PolarHBondContact O-N 2.8Å; I216-T220 PolarHBondContact O-OG1 2.8Å; V217-T220 PolarHBondContact O-N 3.31Å; C218-T220 VanDerWaalsContact C-N 3.34Å; C218-T220 PolarHBondContact O-N 3.35Å; T220-A222 VanDerWaalsContact C-N 3.33Å; T220-A222 PolarHBondContact O-N 2.95Å; T220-S223 WeakPolarHBondContact O-CB 3.35Å; T220-S223 PolarHBondContact O-N 3.46Å; T220-S223 VanDerWaalsContact O-N 3.14Å; T220-C224 WeakPolarHBondContact O-CB 3.23Å; T220-C224 PolarHBondContact O-N 2.93Å; T220-C224 PolarHBondContact O-SG 3.1Å; T220-C224 VanDerWaalsContact O-SG 3.34Å |
| 221 | L | 93.6 | Very high | 90.8 | Very high | 83 Ų | 83 | 47.2 Ų | 47.2 | 44% | 0.435 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -61.9 | -40.4 | 177.7 | -68 | 174.3 | 0 | 0 | 0 | 111.9 | F133 V217 C218 S223 C224 A225 | F133-L221 HydrophobicContact CD2-CB 3.75Å; F133-L221 HydrophobicContact CE2-CB 3.47Å; F133-L221 VanDerWaalsContact CE2-CB 3.47Å; F133-L221 HydrophobicContact CE2-CD1 4.2Å; F133-L221 HydrophobicContact CE2-CG 4.46Å; F133-L221 HydrophobicContact CZ-CB 4.3Å; F133-L221 HydrophobicContact CZ-CD1 4.21Å; V217-L221 HydrophobicContact CG1-CD1 3.84Å; V217-L221 HydrophobicContact CG1-CG 4.31Å; V217-L221 WeakPolarHBondContact O-CB 3.37Å; V217-L221 VanDerWaalsContact O-CG 3.26Å; V217-L221 WeakPolarHBondContact O-CG 3.25Å; V217-L221 PolarHBondContact O-N 3.45Å; C218-L221 PolarHBondContact O-N 3.01Å; L221-S223 VanDerWaalsContact C-N 3.35Å; L221-C224 PolarHBondContact O-N 2.95Å; L221-A225 WeakPolarHBondContact O-CB 3.46Å; L221-A225 PolarHBondContact O-N 3.37Å |
| 222 | A | 89.9 | Confident | 89.9 | Confident | 0 Ų | 0 | 56.4 Ų | 56.4 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -62.5 | -42.5 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.5 | F133 C218 T220 A225 L226 L250 | F133-A222 HydrophobicContact CB-CB 4.38Å; F133-A222 HydrophobicContact CD2-CB 4.31Å; C218-A222 VanDerWaalsContact O-CB 3.27Å; C218-A222 WeakPolarHBondContact O-CB 3.35Å; C218-A222 PolarHBondContact O-N 2.82Å; T220-A222 VanDerWaalsContact C-N 3.33Å; T220-A222 PolarHBondContact O-N 2.95Å; A222-A225 PolarHBondContact O-N 3.23Å; A222-L226 WeakPolarHBondContact O-CB 3.17Å; A222-L226 VanDerWaalsContact O-CG 3.27Å; A222-L226 WeakPolarHBondContact O-CG 3.32Å; A222-L226 PolarHBondContact O-N 3.33Å; A222-L250 HydrophobicContact CB-CD1 3.93Å |
| 223 | S | 89.4 | Confident | 88.7 | Confident | 10 Ų | 10 | 62.8 Ų | 62.8 | 7% | 0.07 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -64.6 | -43.9 | 176.4 | -60.8 | 0 | 0 | 0 | 0 | 112 | N219 T220 L221 L226 L227 | N219-S223 WeakPolarHBondContact O-CB 3.24Å; N219-S223 PolarHBondContact O-N 2.87Å; N219-S223 PolarHBondContact O-OG 3.28Å; T220-S223 WeakPolarHBondContact O-CB 3.35Å; T220-S223 PolarHBondContact O-N 3.46Å; T220-S223 VanDerWaalsContact O-N 3.14Å; L221-S223 VanDerWaalsContact C-N 3.35Å; S223-L226 PolarHBondContact O-N 2.92Å; S223-L227 WeakPolarHBondContact O-CB 3.49Å; S223-L227 PolarHBondContact O-N 2.88Å |
| 224 | C | 89.9 | Confident | 86.8 | Confident | 71 Ų | 71 | 67.8 Ų | 67.8 | 48% | 0.48 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -62.9 | -43.1 | 175.4 | -70.8 | 0 | 0 | 0 | 0 | 112 | T220 L221 L226 L227 H228 | T220-C224 WeakPolarHBondContact O-CB 3.23Å; T220-C224 PolarHBondContact O-N 2.93Å; T220-C224 PolarHBondContact O-SG 3.1Å; T220-C224 VanDerWaalsContact O-SG 3.34Å; L221-C224 PolarHBondContact O-N 2.95Å; C224-L226 VanDerWaalsContact C-N 3.35Å; C224-L226 PolarHBondContact O-N 3.41Å; C224-L227 PolarHBondContact O-N 3.36Å; C224-H228 WeakPolarHBondContact O-CB 3.02Å; C224-H228 PolarHBondContact O-N 2.92Å |
| 225 | A | 87.6 | Confident | 84.8 | Confident | 38 Ų | 38 | 70.3 Ų | 70.3 | 31% | 0.314 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -62.4 | -42.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | V136 T137 L221 A222 G229 | V136-A225 HydrophobicContact CG1-CB 3.83Å; T137-A225 HydrophobicContact CG2-CB 4.21Å; L221-A225 WeakPolarHBondContact O-CB 3.46Å; L221-A225 PolarHBondContact O-N 3.37Å; A222-A225 PolarHBondContact O-N 3.23Å; A225-G229 PolarHBondContact O-N 2.88Å |
| 226 | L | 86 | Confident | 82.9 | Confident | 15 Ų | 15 | 73.8 Ų | 73.8 | 8% | 0.079 | 41% | 0.405 | C | S | . | . | H | α-helix | trans | -62.5 | -44 | 173.5 | -72.1 | 169.6 | 0 | 0 | 0 | 111.3 | V136 A222 S223 C224 R230 M246 I247 L250 | V136-L226 HydrophobicContact CG1-CD2 4.03Å; V136-L226 HydrophobicContact CG1-CG 3.92Å; V136-L226 HydrophobicContact CG2-CD1 4.42Å; V136-L226 HydrophobicContact CG2-CD2 4.28Å; V136-L226 HydrophobicContact CG2-CG 4.3Å; A222-L226 WeakPolarHBondContact O-CB 3.17Å; A222-L226 VanDerWaalsContact O-CG 3.27Å; A222-L226 WeakPolarHBondContact O-CG 3.32Å; A222-L226 PolarHBondContact O-N 3.33Å; S223-L226 PolarHBondContact O-N 2.92Å; C224-L226 VanDerWaalsContact C-N 3.35Å; C224-L226 PolarHBondContact O-N 3.41Å; L226-R230 WeakPolarHBondContact O-CG 3.37Å; L226-R230 PolarHBondContact O-N 3.47Å; L226-M246 HydrophobicContact CD1-CB 4Å; L226-M246 HydrophobicContact CD1-CE 4.42Å; L226-I247 HydrophobicContact CB-CD1 3.92Å; L226-I247 HydrophobicContact CB-CG1 3.83Å; L226-I247 HydrophobicContact CD1-CG1 4.06Å; L226-L250 HydrophobicContact CD1-CD1 4.2Å |
| 227 | L | 86.2 | Confident | 81.1 | Confident | 90 Ų | 90 | 75.1 Ų | 75.1 | 47% | 0.471 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -66.1 | -42.9 | 179.3 | -176.4 | 62.4 | 0 | 0 | 0 | 112.2 | S223 C224 R230 L231 I247 | S223-L227 WeakPolarHBondContact O-CB 3.49Å; S223-L227 PolarHBondContact O-N 2.88Å; C224-L227 PolarHBondContact O-N 3.36Å; L227-R230 WeakPolarHBondContact O-CA 3.46Å; L227-R230 VanDerWaalsContact O-CB 3.3Å; L227-R230 WeakPolarHBondContact O-CB 3.47Å; L227-R230 PolarHBondContact O-N 2.97Å; L227-R230 VanDerWaalsContact O-N 3.09Å; L227-L231 HydrophobicContact CG-CD1 4.26Å; L227-L231 WeakPolarHBondContact O-CG 3.49Å; L227-L231 PolarHBondContact O-N 2.79Å; L227-I247 HydrophobicContact CB-CD1 4.27Å |
| 228 | H | 86 | Confident | 79.1 | Confident | 105 Ų | 105 | 83.9 Ų | 83.9 | 49% | 0.486 | 44% | 0.442 | S | S | . | . | H | α-helix | trans | -65.4 | -43.9 | 178.3 | 179.2 | -100.1 | 0 | 0 | 0 | 111.9 | C224 R230 L231 R232 | C224-H228 WeakPolarHBondContact O-CB 3.02Å; C224-H228 PolarHBondContact O-N 2.92Å; H228-R230 PolarHBondContact O-N 3.37Å; H228-L231 PolarHBondContact O-N 3.17Å; H228-R232 PolarHBondContact O-N 2.99Å; H228-R232 VanDerWaalsContact O-N 3.12Å |
| 229 | G | 81.6 | Confident | 77.4 | Confident | 27 Ų | 27 | 84.7 Ų | 84.7 | 28% | 0.278 | 45% | 0.453 | S | S | . | . | H | α-helix | trans | -56.7 | -32.2 | 172.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | A225 H233 | A225-G229 PolarHBondContact O-N 2.88Å; G229-H233 PolarHBondContact O-CD2 2.9Å; G229-H233 PolarHBondContact O-N 3.36Å |
| 230 | R | 80.1 | Confident | 76 | Confident | 41 Ų | 41 | 87.2 Ų | 87.2 | 16% | 0.155 | 47% | 0.468 | C | S | . | . | H | α-helix | trans | -75.7 | -43.3 | 178.2 | -70 | -67.8 | -62.8 | -89.4 | -31.2 | 114.2 | L226 L227 H228 R232 H233 G239 T240 H243 | L226-R230 WeakPolarHBondContact O-CG 3.37Å; L226-R230 PolarHBondContact O-N 3.47Å; L227-R230 WeakPolarHBondContact O-CA 3.46Å; L227-R230 VanDerWaalsContact O-CB 3.3Å; L227-R230 WeakPolarHBondContact O-CB 3.47Å; L227-R230 PolarHBondContact O-N 2.97Å; L227-R230 VanDerWaalsContact O-N 3.09Å; H228-R230 PolarHBondContact O-N 3.37Å; R230-R232 PolarHBondContact O-N 3.39Å; R230-H233 PolarHBondContact O-N 2.97Å; R230-H233 VanDerWaalsContact O-O 3.11Å; R230-G239 PolarHBondContact NH1-O 2.62Å; R230-G239 VanDerWaalsContact NH1-O 3.12Å; R230-T240 PolarHBondContact NH1-O 2.77Å; R230-T240 VanDerWaalsContact NH2-CA 3.31Å; R230-T240 PolarHBondContact NH2-O 3.04Å; R230-H243 HydrophobicContact CG-CB 3.89Å; R230-H243 PolarHBondContact NH1-CD2 3.19Å |
| 231 | L | 80.7 | Confident | 74.7 | Confident | 137 Ų | 137 | 87 Ų | 87 | 72% | 0.717 | 47% | 0.469 | S | S | * | . | H | α-helix | trans | -62.8 | -29.4 | 175.7 | -69.8 | 167.5 | 0 | 0 | 0 | 112 | L227 H228 | L227-L231 HydrophobicContact CG-CD1 4.26Å; L227-L231 WeakPolarHBondContact O-CG 3.49Å; L227-L231 PolarHBondContact O-N 2.79Å; H228-L231 PolarHBondContact O-N 3.17Å |
| 232 | R | 80.3 | Confident | 73.6 | Confident | 199 Ų | 199 | 89.3 Ų | 89.3 | 75% | 0.751 | 47% | 0.473 | S | S | * | . | H | α-helix | trans | -75.7 | -21.6 | 175.4 | -83.8 | -172.1 | 153.6 | -144.8 | -6.7 | 115 | H228 R230 | H228-R232 PolarHBondContact O-N 2.99Å; H228-R232 VanDerWaalsContact O-N 3.12Å; R230-R232 PolarHBondContact O-N 3.39Å |
| 233 | H | 70.7 | Confident | 72.8 | Confident | 140 Ų | 140 | 92.1 Ų | 92.1 | 65% | 0.648 | 49% | 0.486 | S | S | * | . | S | Bend | trans | -96.7 | 133.8 | 178.9 | -76.3 | -64.7 | 0 | 0 | 0 | 111 | G229 R230 | G229-H233 PolarHBondContact O-CD2 2.9Å; G229-H233 PolarHBondContact O-N 3.36Å; R230-H233 PolarHBondContact O-N 2.97Å; R230-H233 VanDerWaalsContact O-O 3.11Å |
| 234 | K | 58.1 | Low | 72.2 | Confident | 193 Ų | 193 | 96 Ų | 96 | 84% | 0.839 | 51% | 0.505 | S | S | * | . | trans | -54 | 141.2 | -176.8 | -77 | -174.9 | 175.3 | -178 | 0 | 112.6 | G236 | K234-G236 PolarHBondContact O-N 3.19Å; K234-G236 VanDerWaalsContact O-N 3.15Å | ||
| 235 | P | 53.8 | Low | 71.6 | Confident | 136 Ų | 136 | 94.4 Ų | 94.4 | 88% | 0.883 | 49% | 0.491 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -64.3 | 115.3 | 176.8 | -4.3 | 16.9 | 0 | 0 | 0 | 109.3 | ||
| 236 | G | 55.6 | Low | 71.3 | Confident | 75 Ų | 75 | 94.6 Ų | 94.6 | 77% | 0.773 | 49% | 0.486 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 148.6 | -12.3 | 179.8 | 0 | 0 | 0 | 0 | 0 | 115.7 | K234 | K234-G236 PolarHBondContact O-N 3.19Å; K234-G236 VanDerWaalsContact O-N 3.15Å |
| 237 | S | 56.3 | Low | 71.2 | Confident | 70 Ų | 70 | 95 Ų | 95 | 49% | 0.49 | 49% | 0.487 | S | S | . | . | trans | -76.7 | 136.6 | 178.8 | 125 | 0 | 0 | 0 | 0 | 112.3 | G239 T240 | S237-G239 PolarHBondContact O-N 3.33Å; S237-G239 PolarHBondContact OG-N 3.11Å; S237-T240 WeakPolarHBondContact O-CB 3.24Å; S237-T240 PolarHBondContact O-N 3.27Å; S237-T240 PolarHBondContact O-OG1 2.84Å | ||
| 238 | R | 55.7 | Low | 71 | Confident | 262 Ų | 262 | 94.2 Ų | 94.2 | 99% | 0.989 | 49% | 0.489 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -55.6 | -14 | 175.2 | -120.5 | 170.2 | 170.6 | 149 | -4.5 | 113.9 | T240 | R238-T240 VanDerWaalsContact C-N 3.25Å; R238-T240 PolarHBondContact O-N 3.2Å |
| 239 | G | 58.9 | Low | 71 | Confident | 28 Ų | 28 | 90 Ų | 90 | 29% | 0.289 | 47% | 0.47 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -73.9 | -10.1 | 173.3 | 0 | 0 | 0 | 0 | 0 | 114.3 | R230 S237 S241 Y242 H243 | R230-G239 PolarHBondContact NH1-O 2.62Å; R230-G239 VanDerWaalsContact NH1-O 3.12Å; S237-G239 PolarHBondContact O-N 3.33Å; S237-G239 PolarHBondContact OG-N 3.11Å; G239-S241 VanDerWaalsContact C-N 3.26Å; G239-S241 PolarHBondContact O-N 2.04Å; G239-S241 VanDerWaalsContact O-N 3.16Å; G239-Y242 PolarHBondContact O-N 2.87Å; G239-H243 PolarHBondContact O-CD2 3.35Å |
| 240 | T | 61.9 | Low | 71.2 | Confident | 56 Ų | 56 | 89 Ų | 89 | 34% | 0.344 | 46% | 0.458 | S | S | . | . | H | α-helix | trans | -59.1 | -33.8 | -171.6 | -61.4 | 0 | 0 | 0 | 0 | 113.6 | R230 S237 R238 | R230-T240 PolarHBondContact NH1-O 2.77Å; R230-T240 VanDerWaalsContact NH2-CA 3.31Å; R230-T240 PolarHBondContact NH2-O 3.04Å; S237-T240 WeakPolarHBondContact O-CB 3.24Å; S237-T240 PolarHBondContact O-N 3.27Å; S237-T240 PolarHBondContact O-OG1 2.84Å; R238-T240 VanDerWaalsContact C-N 3.25Å; R238-T240 PolarHBondContact O-N 3.2Å |
| 241 | S | 66.6 | Low | 71.5 | Confident | 51 Ų | 51 | 91.2 Ų | 91.2 | 36% | 0.357 | 47% | 0.472 | S | S | . | . | H | α-helix | trans | -81.9 | -24.7 | -177.5 | -177.2 | 0 | 0 | 0 | 0 | 114.1 | G239 E245 K307 | G239-S241 VanDerWaalsContact C-N 3.26Å; G239-S241 PolarHBondContact O-N 2.04Å; G239-S241 VanDerWaalsContact O-N 3.16Å; S241-E245 PolarHBondContact O-N 3.34Å; S241-K307 WeakPolarHBondContact OG-CE 3.42Å; S241-K307 PolarHBondContact OG-NZ 2.98Å |
| 242 | Y | 69.9 | Low | 71.9 | Confident | 132 Ų | 132 | 86 Ų | 86 | 52% | 0.518 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -76.1 | -41.6 | -177 | 175.9 | -102.9 | 0 | 0 | 0 | 112.8 | G239 L244 E245 M246 | G239-Y242 PolarHBondContact O-N 2.87Å; Y242-L244 VanDerWaalsContact C-N 3.33Å; Y242-L244 PolarHBondContact O-N 3.39Å; Y242-E245 WeakPolarHBondContact O-CB 3.36Å; Y242-E245 PolarHBondContact O-N 3.06Å; Y242-M246 HydrophobicContact CD1-SD 3.89Å; Y242-M246 HydrophobicContact CE1-CG 4.13Å; Y242-M246 HydrophobicContact CE1-SD 3.17Å; Y242-M246 WeakPolarHBondContact CE1-SD 3.47Å; Y242-M246 HydrophobicContact CE2-CG 4.37Å; Y242-M246 HydrophobicContact CE2-SD 4.31Å; Y242-M246 WeakPolarHBondContact O-CG 3.27Å; Y242-M246 PolarHBondContact O-N 3.07Å; Y242-M246 PolarHBondContact OH-SD 3.01Å |
| 243 | H | 74.3 | Confident | 72.3 | Confident | 59 Ų | 59 | 76.7 Ų | 76.7 | 27% | 0.273 | 41% | 0.414 | S | S | . | . | H | α-helix | trans | -70.8 | -30.1 | 177.8 | -51.6 | -117.9 | 0 | 0 | 0 | 112.6 | R230 G239 M246 I247 | R230-H243 HydrophobicContact CG-CB 3.89Å; R230-H243 PolarHBondContact NH1-CD2 3.19Å; G239-H243 PolarHBondContact O-CD2 3.35Å; H243-M246 PolarHBondContact O-N 3.15Å; H243-I247 WeakPolarHBondContact O-CD1 3.5Å; H243-I247 VanDerWaalsContact O-CG1 3.23Å; H243-I247 WeakPolarHBondContact O-CG1 3.5Å; H243-I247 PolarHBondContact O-N 2.96Å |
| 244 | L | 75.6 | Confident | 73.1 | Confident | 90 Ų | 90 | 71.2 Ų | 71.2 | 47% | 0.471 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -65.3 | -43.6 | 173.8 | -73.2 | 174.4 | 0 | 0 | 0 | 110.9 | Y242 M246 I247 C248 | Y242-L244 VanDerWaalsContact C-N 3.33Å; Y242-L244 PolarHBondContact O-N 3.39Å; L244-M246 VanDerWaalsContact C-N 3.33Å; L244-M246 PolarHBondContact O-N 3.12Å; L244-I247 PolarHBondContact O-N 3.2Å; L244-C248 WeakPolarHBondContact O-CB 3.38Å; L244-C248 PolarHBondContact O-N 3.15Å; L244-C248 PolarHBondContact O-SG 2.96Å |
| 245 | E | 78.7 | Confident | 74.7 | Confident | 38 Ų | 38 | 67.5 Ų | 67.5 | 18% | 0.178 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -55.5 | -47.8 | 172.8 | 176.4 | -169.7 | 168.7 | 0 | 0 | 111.5 | S241 Y242 C248 Q249 L305 R306 K307 | S241-E245 PolarHBondContact O-N 3.34Å; Y242-E245 WeakPolarHBondContact O-CB 3.36Å; Y242-E245 PolarHBondContact O-N 3.06Å; E245-C248 PolarHBondContact O-N 3.41Å; E245-Q249 VanDerWaalsContact O-CB 3.3Å; E245-Q249 WeakPolarHBondContact O-CB 3.41Å; E245-Q249 PolarHBondContact O-N 2.98Å; E245-L305 WeakPolarHBondContact CG-O 3.36Å; E245-R306 VanDerWaalsContact OE1-CA 3.26Å; E245-R306 WeakPolarHBondContact OE1-CA 3.42Å; E245-K307 VanDerWaalsContact CD-N 3.32Å; E245-K307 HydrophobicContact CG-CB 4.2Å; E245-K307 WeakPolarHBondContact OE1-CB 3.32Å; E245-K307 PolarHBondContact OE1-N 3.4Å; E245-K307 WeakPolarHBondContact OE2-CB 3.43Å |
| 246 | M | 80.4 | Confident | 76.5 | Confident | 43 Ų | 43 | 62.5 Ų | 62.5 | 21% | 0.212 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -63 | -43.5 | 177.4 | -68.9 | -177.5 | 74.3 | 0 | 0 | 112.8 | L226 Y242 H243 L244 Q249 L250 | L226-M246 HydrophobicContact CD1-CB 4Å; L226-M246 HydrophobicContact CD1-CE 4.42Å; Y242-M246 HydrophobicContact CD1-SD 3.89Å; Y242-M246 HydrophobicContact CE1-CG 4.13Å; Y242-M246 HydrophobicContact CE1-SD 3.17Å; Y242-M246 WeakPolarHBondContact CE1-SD 3.47Å; Y242-M246 HydrophobicContact CE2-CG 4.37Å; Y242-M246 HydrophobicContact CE2-SD 4.31Å; Y242-M246 WeakPolarHBondContact O-CG 3.27Å; Y242-M246 PolarHBondContact O-N 3.07Å; Y242-M246 PolarHBondContact OH-SD 3.01Å; H243-M246 PolarHBondContact O-N 3.15Å; L244-M246 VanDerWaalsContact C-N 3.33Å; L244-M246 PolarHBondContact O-N 3.12Å; M246-Q249 PolarHBondContact O-N 3.49Å; M246-L250 WeakPolarHBondContact O-CG 3.32Å; M246-L250 PolarHBondContact O-N 3.29Å |
| 247 | I | 83.1 | Confident | 78.2 | Confident | 22 Ų | 22 | 59.1 Ų | 59.1 | 11% | 0.113 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -63.8 | -49.2 | 178.2 | -68.9 | 164 | 0 | 0 | 0 | 110.2 | L226 L227 H243 L244 Q249 L250 L251 | L226-I247 HydrophobicContact CB-CD1 3.92Å; L226-I247 HydrophobicContact CB-CG1 3.83Å; L226-I247 HydrophobicContact CD1-CG1 4.06Å; L227-I247 HydrophobicContact CB-CD1 4.27Å; H243-I247 WeakPolarHBondContact O-CD1 3.5Å; H243-I247 VanDerWaalsContact O-CG1 3.23Å; H243-I247 WeakPolarHBondContact O-CG1 3.5Å; H243-I247 PolarHBondContact O-N 2.96Å; L244-I247 PolarHBondContact O-N 3.2Å; I247-Q249 PolarHBondContact O-N 2.99Å; I247-L250 PolarHBondContact O-N 2.98Å; I247-L250 VanDerWaalsContact O-N 3.17Å; I247-L251 HydrophobicContact CG2-CD1 3.95Å; I247-L251 HydrophobicContact CG2-CG 4.36Å; I247-L251 WeakPolarHBondContact O-CG 3.21Å; I247-L251 PolarHBondContact O-N 3.47Å |
| 248 | C | 82.9 | Confident | 80 | Confident | 75 Ų | 75 | 58 Ų | 58 | 51% | 0.507 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -58 | -39.7 | 176.6 | -70.2 | 0 | 0 | 0 | 0 | 111.6 | L244 E245 A252 | L244-C248 WeakPolarHBondContact O-CB 3.38Å; L244-C248 PolarHBondContact O-N 3.15Å; L244-C248 PolarHBondContact O-SG 2.96Å; E245-C248 PolarHBondContact O-N 3.41Å; C248-A252 WeakPolarHBondContact O-CB 3.26Å; C248-A252 PolarHBondContact O-N 3.08Å |
| 249 | Q | 86 | Confident | 81.8 | Confident | 17 Ų | 17 | 49.6 Ų | 49.6 | 8% | 0.079 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -62.1 | -47.8 | 175.6 | -176.2 | 178.3 | 5.3 | 0 | 0 | 112.4 | E245 M246 I247 A252 I253 Y302 L305 | E245-Q249 VanDerWaalsContact O-CB 3.3Å; E245-Q249 WeakPolarHBondContact O-CB 3.41Å; E245-Q249 PolarHBondContact O-N 2.98Å; M246-Q249 PolarHBondContact O-N 3.49Å; I247-Q249 PolarHBondContact O-N 2.99Å; Q249-A252 PolarHBondContact O-N 3.28Å; Q249-I253 HydrophobicContact CG-CD1 4Å; Q249-I253 WeakPolarHBondContact O-CD1 3.44Å; Q249-I253 VanDerWaalsContact O-CG1 3.24Å; Q249-I253 WeakPolarHBondContact O-CG1 3.26Å; Q249-I253 PolarHBondContact O-N 3.41Å; Q249-Y302 PolarHBondContact NE2-O 2.92Å; Q249-L305 HydrophobicContact CB-CB 4.15Å; Q249-L305 HydrophobicContact CB-CD1 4.28Å; Q249-L305 HydrophobicContact CG-CB 4.09Å; Q249-L305 HydrophobicContact CG-CD1 4.2Å |
| 250 | L | 85.4 | Confident | 83.4 | Confident | 5 Ų | 5 | 48.7 Ų | 48.7 | 3% | 0.026 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -62.7 | -42.7 | 178.6 | -67.5 | 174.9 | 0 | 0 | 0 | 111.8 | A222 L226 M246 I247 A252 I253 M254 | A222-L250 HydrophobicContact CB-CD1 3.93Å; L226-L250 HydrophobicContact CD1-CD1 4.2Å; M246-L250 WeakPolarHBondContact O-CG 3.32Å; M246-L250 PolarHBondContact O-N 3.29Å; I247-L250 PolarHBondContact O-N 2.98Å; I247-L250 VanDerWaalsContact O-N 3.17Å; L250-A252 PolarHBondContact O-N 2.84Å; L250-I253 PolarHBondContact O-N 2.64Å; L250-M254 WeakPolarHBondContact O-CB 2.99Å; L250-M254 VanDerWaalsContact O-CG 3.28Å; L250-M254 WeakPolarHBondContact O-CG 3.32Å; L250-M254 PolarHBondContact O-N 2.94Å |
| 251 | L | 87.3 | Confident | 85 | Confident | 87 Ų | 87 | 46.2 Ų | 46.2 | 46% | 0.455 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -63 | -40.7 | 176.1 | -68.8 | 175.6 | 0 | 0 | 0 | 112.2 | I247 M254 L255 | I247-L251 HydrophobicContact CG2-CD1 3.95Å; I247-L251 HydrophobicContact CG2-CG 4.36Å; I247-L251 WeakPolarHBondContact O-CG 3.21Å; I247-L251 PolarHBondContact O-N 3.47Å; L251-M254 HydrophobicContact CD2-CE 3.79Å; L251-M254 HydrophobicContact CD2-SD 4.38Å; L251-M254 PolarHBondContact O-N 3.13Å; L251-L255 WeakPolarHBondContact O-CB 3.33Å; L251-L255 PolarHBondContact O-N 3.47Å |
| 252 | A | 88.3 | Confident | 86.3 | Confident | 28 Ų | 28 | 44.4 Ų | 44.4 | 23% | 0.231 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -65.1 | -43.9 | 176.7 | 0 | 0 | 0 | 0 | 0 | 111.9 | C248 Q249 L250 L255 V256 V301 L305 | C248-A252 WeakPolarHBondContact O-CB 3.26Å; C248-A252 PolarHBondContact O-N 3.08Å; Q249-A252 PolarHBondContact O-N 3.28Å; L250-A252 PolarHBondContact O-N 2.84Å; A252-L255 PolarHBondContact O-N 3.03Å; A252-V256 WeakPolarHBondContact O-CB 3.4Å; A252-V256 VanDerWaalsContact O-CG2 3.3Å; A252-V256 WeakPolarHBondContact O-CG2 3.4Å; A252-V256 PolarHBondContact O-N 3.18Å; A252-V301 HydrophobicContact CB-CG1 3.95Å; A252-L305 HydrophobicContact CB-CD1 3.45Å; A252-L305 VanDerWaalsContact CB-CD1 3.45Å |
| 253 | I | 87.8 | Confident | 87.4 | Confident | 3 Ų | 3 | 40.4 Ų | 40.4 | 2% | 0.015 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -58.5 | -50.8 | 175.2 | -63.8 | 158.7 | 0 | 0 | 0 | 109.5 | Q249 L250 L255 V256 S257 V301 Y302 | Q249-I253 HydrophobicContact CG-CD1 4Å; Q249-I253 WeakPolarHBondContact O-CD1 3.44Å; Q249-I253 VanDerWaalsContact O-CG1 3.24Å; Q249-I253 WeakPolarHBondContact O-CG1 3.26Å; Q249-I253 PolarHBondContact O-N 3.41Å; L250-I253 PolarHBondContact O-N 2.64Å; I253-L255 PolarHBondContact O-N 3.03Å; I253-V256 PolarHBondContact O-N 3.31Å; I253-S257 WeakPolarHBondContact O-CB 3.32Å; I253-S257 PolarHBondContact O-N 3.21Å; I253-S257 PolarHBondContact O-OG 3.14Å; I253-V301 HydrophobicContact CB-CG1 4.27Å; I253-V301 HydrophobicContact CD1-CG1 4.49Å; I253-V301 HydrophobicContact CG1-CB 4.25Å; I253-V301 HydrophobicContact CG1-CG1 3.37Å; I253-Y302 HydrophobicContact CD1-CD1 3.81Å; I253-Y302 HydrophobicContact CD1-CE1 3.28Å; I253-Y302 HydrophobicContact CG1-CE1 4.04Å |
| 254 | M | 88.8 | Confident | 88.3 | Confident | 26 Ų | 26 | 38 Ų | 38 | 13% | 0.128 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -54 | -50.6 | 177.8 | -75.3 | 166.8 | 30.7 | 0 | 0 | 112 | N219 L250 L251 S257 C258 | N219-M254 HydrophobicContact CB-CG 3.48Å; N219-M254 VanDerWaalsContact CB-CG 3.48Å; N219-M254 HydrophobicContact CB-SD 3.3Å; N219-M254 WeakPolarHBondContact CB-SD 3.32Å; L250-M254 WeakPolarHBondContact O-CB 2.99Å; L250-M254 VanDerWaalsContact O-CG 3.28Å; L250-M254 WeakPolarHBondContact O-CG 3.32Å; L250-M254 PolarHBondContact O-N 2.94Å; L251-M254 HydrophobicContact CD2-CE 3.79Å; L251-M254 HydrophobicContact CD2-SD 4.38Å; L251-M254 PolarHBondContact O-N 3.13Å; M254-S257 PolarHBondContact O-N 3.25Å; M254-C258 WeakPolarHBondContact O-CB 3.22Å; M254-C258 PolarHBondContact O-N 3.44Å; M254-C258 PolarHBondContact O-SG 3.32Å |
| 255 | L | 91.7 | Very high | 89.2 | Confident | 115 Ų | 115 | 33.8 Ų | 33.8 | 60% | 0.602 | 20% | 0.198 | S | C | * | . | H | α-helix | trans | -62.5 | -49.4 | -177.6 | -179.6 | 67 | 0 | 0 | 0 | 111.8 | L251 A252 I253 S257 C258 V259 | L251-L255 WeakPolarHBondContact O-CB 3.33Å; L251-L255 PolarHBondContact O-N 3.47Å; A252-L255 PolarHBondContact O-N 3.03Å; I253-L255 PolarHBondContact O-N 3.03Å; L255-S257 VanDerWaalsContact C-N 3.35Å; L255-S257 PolarHBondContact O-N 2.8Å; L255-C258 PolarHBondContact O-N 3.26Å; L255-V259 HydrophobicContact CD1-CG2 4.21Å; L255-V259 WeakPolarHBondContact O-CG2 3.04Å; L255-V259 PolarHBondContact O-N 3.33Å |
| 256 | V | 92 | Very high | 89.9 | Confident | 31 Ų | 31 | 35.1 Ų | 35.1 | 19% | 0.188 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -60.6 | -46.8 | -179.9 | 171.7 | 0 | 0 | 0 | 0 | 110.1 | A252 I253 C258 V259 C260 L297 V301 | A252-V256 WeakPolarHBondContact O-CB 3.4Å; A252-V256 VanDerWaalsContact O-CG2 3.3Å; A252-V256 WeakPolarHBondContact O-CG2 3.4Å; A252-V256 PolarHBondContact O-N 3.18Å; I253-V256 PolarHBondContact O-N 3.31Å; V256-C258 PolarHBondContact O-N 2.83Å; V256-V259 PolarHBondContact O-N 3.41Å; V256-C260 WeakPolarHBondContact O-CB 3.28Å; V256-C260 PolarHBondContact O-N 3.23Å; V256-C260 PolarHBondContact O-SG 2.9Å; V256-L297 HydrophobicContact CG1-CB 4.04Å; V256-L297 HydrophobicContact CG1-CD1 3.93Å; V256-V301 HydrophobicContact CG2-CG2 4.19Å |
| 257 | S | 91.4 | Very high | 90.4 | Very high | 4 Ų | 4 | 36 Ų | 36 | 3% | 0.028 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -61.7 | -41.1 | 178.3 | -58.7 | 0 | 0 | 0 | 0 | 112.6 | I253 M254 L255 W261 N294 | I253-S257 WeakPolarHBondContact O-CB 3.32Å; I253-S257 PolarHBondContact O-N 3.21Å; I253-S257 PolarHBondContact O-OG 3.14Å; M254-S257 PolarHBondContact O-N 3.25Å; L255-S257 VanDerWaalsContact C-N 3.35Å; L255-S257 PolarHBondContact O-N 2.8Å; S257-W261 WeakPolarHBondContact O-CB 3.34Å; S257-W261 PolarHBondContact O-N 3.17Å; S257-N294 WeakPolarHBondContact CA-OD1 3.35Å |
| 258 | C | 93.1 | Very high | 90.7 | Very high | 46 Ų | 46 | 35 Ų | 35 | 31% | 0.311 | 21% | 0.207 | S | C | . | . | H | α-helix | trans | -63.8 | -47.7 | 177 | -67.7 | 0 | 0 | 0 | 0 | 112.2 | I216 M254 L255 V256 C260 G262 P263 | I216-C258 WeakPolarHBondContact CD1-SG 3.28Å; M254-C258 WeakPolarHBondContact O-CB 3.22Å; M254-C258 PolarHBondContact O-N 3.44Å; M254-C258 PolarHBondContact O-SG 3.32Å; L255-C258 PolarHBondContact O-N 3.26Å; V256-C258 PolarHBondContact O-N 2.83Å; C258-C260 VanDerWaalsContact C-N 3.33Å; C258-C260 PolarHBondContact O-N 3.42Å; C258-G262 VanDerWaalsContact O-CA 3.31Å; C258-G262 WeakPolarHBondContact O-CA 3.46Å; C258-G262 PolarHBondContact O-N 3.31Å; C258-P263 WeakPolarHBondContact O-CD 3.32Å |
| 259 | V | 93.8 | Very high | 91.1 | Very high | 85 Ų | 85 | 33.4 Ų | 33.4 | 52% | 0.515 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -67.6 | -35.5 | -177.1 | 172.3 | 0 | 0 | 0 | 0 | 111.4 | L255 V256 P263 | L255-V259 HydrophobicContact CD1-CG2 4.21Å; L255-V259 WeakPolarHBondContact O-CG2 3.04Å; L255-V259 PolarHBondContact O-N 3.33Å; V256-V259 PolarHBondContact O-N 3.41Å; V259-P263 VanDerWaalsContact O-CD 3.22Å; V259-P263 WeakPolarHBondContact O-CD 3.31Å; V259-P263 WeakPolarHBondContact O-CG 3.45Å |
| 260 | C | 93.5 | Very high | 91.2 | Very high | 9 Ų | 9 | 35.9 Ų | 35.9 | 6% | 0.061 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -83.7 | -45 | -176.8 | -61.5 | 0 | 0 | 0 | 0 | 113 | V256 C258 M290 A291 N294 | V256-C260 WeakPolarHBondContact O-CB 3.28Å; V256-C260 PolarHBondContact O-N 3.23Å; V256-C260 PolarHBondContact O-SG 2.9Å; C258-C260 VanDerWaalsContact C-N 3.33Å; C258-C260 PolarHBondContact O-N 3.42Å; C260-M290 VanDerWaalsContact CB-O 3.28Å; C260-M290 WeakPolarHBondContact CB-O 3.26Å; C260-M290 CarbonylContact O-C 3.48Å; C260-A291 VanDerWaalsContact O-CA 3.32Å; C260-A291 WeakPolarHBondContact O-CA 3.31Å; C260-A291 PolarHBondContact O-N 3.42Å; C260-N294 HydrophobicContact CB-CB 3.54Å |
| 261 | W | 94.9 | Very high | 91.2 | Very high | 4 Ų | 4 | 37.9 Ų | 37.9 | 2% | 0.015 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -93.4 | -35.2 | -175.5 | -70.7 | 103.5 | 0 | 0 | 0 | 114.2 | G118 P121 L122 L212 S257 L264 L265 A291 N294 Q295 | G118-W261 WeakPolarHBondContact O-CH2 3.44Å; G118-W261 WeakPolarHBondContact O-CZ3 3.25Å; P121-W261 HydrophobicContact CB-CZ2 4.26Å; L122-W261 HydrophobicContact CD1-CD2 4.07Å; L122-W261 HydrophobicContact CD1-CE3 3.8Å; L122-W261 HydrophobicContact CD1-CZ3 4.21Å; L122-W261 HydrophobicContact CD2-CB 4.04Å; L122-W261 HydrophobicContact CD2-CD2 3.75Å; L122-W261 HydrophobicContact CD2-CE3 4.34Å; L122-W261 HydrophobicContact CD2-CG 3.58Å; L122-W261 HydrophobicContact CG-CD2 3.93Å; L122-W261 HydrophobicContact CG-CE3 4.13Å; L122-W261 HydrophobicContact CG-CG 4.31Å; L212-W261 HydrophobicContact CD2-CB 4.36Å; S257-W261 WeakPolarHBondContact O-CB 3.34Å; S257-W261 PolarHBondContact O-N 3.17Å; W261-L264 HydrophobicContact CE3-CD2 4.3Å; W261-L264 HydrophobicContact CZ3-CD2 4.23Å; W261-L264 PolarHBondContact O-N 3.31Å; W261-L264 VanDerWaalsContact O-N 3.15Å; W261-L265 HydrophobicContact CB-CD1 4.3Å; W261-L265 WeakPolarHBondContact O-CG 3.43Å; W261-L265 PolarHBondContact O-N 2.92Å; W261-L265 VanDerWaalsContact O-N 3.12Å; W261-A291 HydrophobicContact CD2-CB 4.22Å; W261-A291 HydrophobicContact CE3-CB 3.83Å; W261-A291 HydrophobicContact CH2-CB 4.23Å; W261-A291 HydrophobicContact CZ3-CB 3.84Å; W261-N294 PolarHBondContact NE1-ND2 3.01Å; W261-Q295 HydrophobicContact CZ2-CG 4.49Å |
| 262 | G | 93.5 | Very high | 91.1 | Very high | 14 Ų | 14 | 34.1 Ų | 34.1 | 14% | 0.144 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -53.6 | -50.9 | -175.8 | 0 | 0 | 0 | 0 | 0 | 113.2 | C258 L264 L265 V266 | C258-G262 VanDerWaalsContact O-CA 3.31Å; C258-G262 WeakPolarHBondContact O-CA 3.46Å; C258-G262 PolarHBondContact O-N 3.31Å; G262-L264 VanDerWaalsContact C-N 3.29Å; G262-L264 PolarHBondContact O-N 3.38Å; G262-L265 PolarHBondContact O-N 3.35Å; G262-V266 WeakPolarHBondContact O-CB 3.33Å; G262-V266 WeakPolarHBondContact O-CG2 3.49Å; G262-V266 PolarHBondContact O-N 2.98Å |
| 263 | P | 93.5 | Very high | 90.8 | Very high | 48 Ų | 48 | 36.7 Ų | 36.7 | 31% | 0.312 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -59.1 | -36.7 | 179.1 | -26.6 | 35.7 | 0 | 0 | 0 | 113.8 | C258 V259 H267 T287 | C258-P263 WeakPolarHBondContact O-CD 3.32Å; V259-P263 VanDerWaalsContact O-CD 3.22Å; V259-P263 WeakPolarHBondContact O-CD 3.31Å; V259-P263 WeakPolarHBondContact O-CG 3.45Å; P263-H267 VanDerWaalsContact O-CB 3.24Å; P263-H267 WeakPolarHBondContact O-CB 3.39Å; P263-H267 PolarHBondContact O-N 3.26Å; P263-H267 PolarHBondContact O-ND1 3.4Å; P263-T287 HydrophobicContact CB-CG2 3.91Å |
| 264 | L | 93 | Very high | 90.1 | Very high | 9 Ų | 9 | 40.5 Ų | 40.5 | 5% | 0.047 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -67.4 | -52.9 | 178.6 | 176.6 | 63.7 | 0 | 0 | 0 | 110.7 | W261 G262 V266 H267 V268 L284 V288 A291 | W261-L264 HydrophobicContact CE3-CD2 4.3Å; W261-L264 HydrophobicContact CZ3-CD2 4.23Å; W261-L264 PolarHBondContact O-N 3.31Å; W261-L264 VanDerWaalsContact O-N 3.15Å; G262-L264 VanDerWaalsContact C-N 3.29Å; G262-L264 PolarHBondContact O-N 3.38Å; L264-V266 VanDerWaalsContact C-N 3.35Å; L264-V266 PolarHBondContact O-N 2.95Å; L264-H267 PolarHBondContact O-N 3.12Å; L264-V268 HydrophobicContact CD1-CG2 4.26Å; L264-V268 WeakPolarHBondContact O-CG2 3.5Å; L264-V268 PolarHBondContact O-N 2.96Å; L264-L284 HydrophobicContact CD1-CD1 4.21Å; L264-V288 HydrophobicContact CD1-CG2 3.63Å; L264-A291 HydrophobicContact CD2-CB 3.7Å |
| 265 | L | 94.8 | Very high | 88.7 | Confident | 0 Ų | 0 | 44.3 Ų | 44.3 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -62.6 | -42.2 | -176.2 | -62.6 | 167.7 | 0 | 0 | 0 | 111.6 | L122 F204 L209 L212 W261 G262 I269 | L122-L265 HydrophobicContact CD1-CD1 4.24Å; L122-L265 HydrophobicContact CD1-CD2 4.38Å; F204-L265 HydrophobicContact CE1-CD2 4.09Å; F204-L265 HydrophobicContact CZ-CD2 4.48Å; L209-L265 HydrophobicContact CB-CD1 4.45Å; L212-L265 HydrophobicContact CD2-CD1 4.29Å; W261-L265 HydrophobicContact CB-CD1 4.3Å; W261-L265 WeakPolarHBondContact O-CG 3.43Å; W261-L265 PolarHBondContact O-N 2.92Å; W261-L265 VanDerWaalsContact O-N 3.12Å; G262-L265 PolarHBondContact O-N 3.35Å; L265-I269 WeakPolarHBondContact O-CG1 3.48Å; L265-I269 PolarHBondContact O-N 2.66Å |
| 266 | V | 92.8 | Very high | 87 | Confident | 67 Ų | 67 | 46 Ų | 46 | 41% | 0.406 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -68 | -43.5 | 177.4 | 174.1 | 0 | 0 | 0 | 0 | 111.4 | G262 L264 V268 I269 I270 | G262-V266 WeakPolarHBondContact O-CB 3.33Å; G262-V266 WeakPolarHBondContact O-CG2 3.49Å; G262-V266 PolarHBondContact O-N 2.98Å; L264-V266 VanDerWaalsContact C-N 3.35Å; L264-V266 PolarHBondContact O-N 2.95Å; V266-V268 VanDerWaalsContact C-N 3.32Å; V266-V268 PolarHBondContact O-N 3.17Å; V266-I269 PolarHBondContact O-N 3.31Å; V266-I270 HydrophobicContact CG1-CD1 3.76Å; V266-I270 HydrophobicContact CG1-CG1 4.4Å; V266-I270 WeakPolarHBondContact O-CG1 3.44Å; V266-I270 PolarHBondContact O-N 2.98Å |
| 267 | H | 90 | Very high | 85.1 | Confident | 61 Ų | 61 | 52.1 Ų | 52.1 | 28% | 0.282 | 30% | 0.3 | S | S | . | . | H | α-helix | trans | -62 | -39.7 | 177.3 | -88.1 | 105.4 | 0 | 0 | 0 | 112.4 | P263 L264 I269 I270 L271 S283 T287 | P263-H267 VanDerWaalsContact O-CB 3.24Å; P263-H267 WeakPolarHBondContact O-CB 3.39Å; P263-H267 PolarHBondContact O-N 3.26Å; P263-H267 PolarHBondContact O-ND1 3.4Å; L264-H267 PolarHBondContact O-N 3.12Å; H267-I269 VanDerWaalsContact C-N 3.35Å; H267-I270 PolarHBondContact O-N 3.37Å; H267-L271 WeakPolarHBondContact O-CB 3.44Å; H267-L271 VanDerWaalsContact O-CG 3.29Å; H267-L271 WeakPolarHBondContact O-CG 3.2Å; H267-L271 PolarHBondContact O-N 3.31Å; H267-S283 PolarHBondContact NE2-OG 2.92Å; H267-S283 VanDerWaalsContact NE2-OG 3.15Å; H267-T287 VanDerWaalsContact ND1-CG2 3.27Å; H267-T287 WeakPolarHBondContact ND1-CG2 3.45Å |
| 268 | V | 90.7 | Very high | 83.4 | Confident | 0 Ų | 0 | 58.7 Ų | 58.7 | 0% | 0 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -63.9 | -41.6 | 177.9 | 173.5 | 0 | 0 | 0 | 0 | 111.1 | F186 M189 P201 S205 L264 V266 L271 S272 L284 | F186-V268 HydrophobicContact CE1-CG2 3.93Å; F186-V268 HydrophobicContact CZ-CG2 4.48Å; M189-V268 HydrophobicContact CE-CB 4.41Å; M189-V268 HydrophobicContact CE-CG1 3.48Å; M189-V268 VanDerWaalsContact CE-CG1 3.48Å; M189-V268 HydrophobicContact CE-CG2 4.23Å; M189-V268 HydrophobicContact SD-CG1 4.48Å; P201-V268 HydrophobicContact CB-CG1 3.79Å; S205-V268 WeakPolarHBondContact OG-CB 3.37Å; S205-V268 WeakPolarHBondContact OG-CG1 3.3Å; L264-V268 HydrophobicContact CD1-CG2 4.26Å; L264-V268 WeakPolarHBondContact O-CG2 3.5Å; L264-V268 PolarHBondContact O-N 2.96Å; V266-V268 VanDerWaalsContact C-N 3.32Å; V266-V268 PolarHBondContact O-N 3.17Å; V268-L271 PolarHBondContact O-N 3.13Å; V268-S272 WeakPolarHBondContact O-CB 3.43Å; V268-S272 PolarHBondContact O-N 3.17Å; V268-S272 PolarHBondContact O-OG 3.03Å; V268-L284 HydrophobicContact CG2-CD1 4.29Å |
| 269 | I | 90.5 | Very high | 81.5 | Confident | 42 Ų | 42 | 58.1 Ų | 58.1 | 22% | 0.215 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -59.2 | -49.5 | 174 | -66.2 | 167.2 | 0 | 0 | 0 | 110.3 | L202 L209 L265 V266 H267 L271 S272 T273 | L202-I269 HydrophobicContact CD1-CG1 4.2Å; L202-I269 HydrophobicContact CD1-CG2 4.4Å; L209-I269 HydrophobicContact CD2-CD1 4.37Å; L265-I269 WeakPolarHBondContact O-CG1 3.48Å; L265-I269 PolarHBondContact O-N 2.66Å; V266-I269 PolarHBondContact O-N 3.31Å; H267-I269 VanDerWaalsContact C-N 3.35Å; I269-L271 PolarHBondContact O-N 2.97Å; I269-S272 PolarHBondContact O-N 3.39Å; I269-T273 HydrophobicContact CG2-CG2 4.35Å; I269-T273 WeakPolarHBondContact O-CB 2.95Å; I269-T273 WeakPolarHBondContact O-CG2 3.18Å; I269-T273 PolarHBondContact O-N 3.05Å; I269-T273 PolarHBondContact O-OG1 2.84Å |
| 270 | I | 88.2 | Confident | 79.7 | Confident | 69 Ų | 69 | 58.2 Ų | 58.2 | 35% | 0.354 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -59.8 | -47 | -178.8 | -68.8 | 169.1 | 0 | 0 | 0 | 111 | V266 H267 S272 T273 I274 | V266-I270 HydrophobicContact CG1-CD1 3.76Å; V266-I270 HydrophobicContact CG1-CG1 4.4Å; V266-I270 WeakPolarHBondContact O-CG1 3.44Å; V266-I270 PolarHBondContact O-N 2.98Å; H267-I270 PolarHBondContact O-N 3.37Å; I270-S272 VanDerWaalsContact C-N 3.31Å; I270-S272 PolarHBondContact O-N 2.96Å; I270-T273 PolarHBondContact O-N 3.49Å; I270-T273 PolarHBondContact O-OG1 3.15Å; I270-I274 HydrophobicContact CG2-CD1 4.12Å; I270-I274 WeakPolarHBondContact O-CB 3.34Å; I270-I274 PolarHBondContact O-N 3.4Å |
| 271 | L | 85.6 | Confident | 78 | Confident | 47 Ų | 47 | 59.1 Ų | 59.1 | 25% | 0.246 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -66.1 | -32.9 | 179.3 | -70.7 | 173.1 | 0 | 0 | 0 | 112.8 | H267 V268 I269 P279 L284 | H267-L271 WeakPolarHBondContact O-CB 3.44Å; H267-L271 VanDerWaalsContact O-CG 3.29Å; H267-L271 WeakPolarHBondContact O-CG 3.2Å; H267-L271 PolarHBondContact O-N 3.31Å; V268-L271 PolarHBondContact O-N 3.13Å; I269-L271 PolarHBondContact O-N 2.97Å; L271-P279 HydrophobicContact CD2-CB 4.1Å; L271-L284 HydrophobicContact CD1-CB 4.42Å; L271-L284 HydrophobicContact CD1-CD1 4.07Å; L271-L284 HydrophobicContact CD1-CD2 4Å; L271-L284 HydrophobicContact CD1-CG 4.4Å |
| 272 | S | 84.6 | Confident | 76.3 | Confident | 8 Ų | 8 | 65.7 Ų | 65.7 | 6% | 0.056 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -77.5 | -26.7 | 179.2 | -51.7 | 0 | 0 | 0 | 0 | 112.5 | V198 P201 V268 I269 I270 | V198-S272 WeakPolarHBondContact CG1-O 3.04Å; P201-S272 WeakPolarHBondContact CG-OG 3.24Å; V268-S272 WeakPolarHBondContact O-CB 3.43Å; V268-S272 PolarHBondContact O-N 3.17Å; V268-S272 PolarHBondContact O-OG 3.03Å; I269-S272 PolarHBondContact O-N 3.39Å; I270-S272 VanDerWaalsContact C-N 3.31Å; I270-S272 PolarHBondContact O-N 2.96Å |
| 273 | T | 82.1 | Confident | 75.4 | Confident | 82 Ų | 82 | 66.7 Ų | 66.7 | 50% | 0.503 | 37% | 0.371 | S | S | . | . | H | α-helix | trans | -105.3 | -27.5 | -170.7 | 53.6 | 0 | 0 | 0 | 0 | 114.7 | I269 I270 | I269-T273 HydrophobicContact CG2-CG2 4.35Å; I269-T273 WeakPolarHBondContact O-CB 2.95Å; I269-T273 WeakPolarHBondContact O-CG2 3.18Å; I269-T273 PolarHBondContact O-N 3.05Å; I269-T273 PolarHBondContact O-OG1 2.84Å; I270-T273 PolarHBondContact O-N 3.49Å; I270-T273 PolarHBondContact O-OG1 3.15Å |
| 274 | I | 74.6 | Confident | 74.9 | Confident | 84 Ų | 84 | 65 Ų | 65 | 43% | 0.431 | 36% | 0.359 | S | S | . | . | trans | -109.4 | 110.1 | -178.4 | -50.1 | -174.2 | 0 | 0 | 0 | 108.6 | I270 K276 | I270-I274 HydrophobicContact CG2-CD1 4.12Å; I270-I274 WeakPolarHBondContact O-CB 3.34Å; I270-I274 PolarHBondContact O-N 3.4Å; I274-K276 HydrophobicContact CG2-CD 4.35Å; I274-K276 HydrophobicContact CG2-CG 3.88Å; I274-K276 PolarHBondContact O-N 3.23Å | ||
| 275 | A | 58.6 | Low | 74.4 | Confident | 106 Ų | 106 | 65.5 Ų | 65.5 | 88% | 0.876 | 36% | 0.362 | S | S | * | . | trans | -65.6 | 96.9 | 166.9 | 0 | 0 | 0 | 0 | 0 | 108.8 | ||||
| 276 | K | 56 | Low | 73.9 | Confident | 151 Ų | 151 | 67.7 Ų | 67.7 | 66% | 0.657 | 38% | 0.375 | S | S | * | . | trans | -110 | 134.3 | 174.8 | -95.2 | -178 | 178.1 | -175.3 | 0 | 110.5 | I274 E278 | I274-K276 HydrophobicContact CG2-CD 4.35Å; I274-K276 HydrophobicContact CG2-CG 3.88Å; I274-K276 PolarHBondContact O-N 3.23Å; K276-E278 PolarHBondContact O-N 3.47Å | ||
| 277 | D | 53 | Low | 73.7 | Confident | 158 Ų | 158 | 64.9 Ų | 64.9 | 85% | 0.845 | 36% | 0.358 | S | S | * | . | S | Bend | trans | -66.9 | -8.2 | -179.5 | -87.6 | -36.1 | 0 | 0 | 0 | 115.2 | ||
| 278 | E | 54.9 | Low | 73.6 | Confident | 142 Ų | 142 | 62.6 Ų | 62.6 | 66% | 0.664 | 35% | 0.349 | S | S | * | . | trans | -150.3 | 105.9 | 166 | -89.7 | -52 | 153.8 | 0 | 0 | 112.5 | R180 K276 S280 | R180-E278 IonicContact NH1-OE2 2.69Å; R180-E278 PolarHBondContact NH1-OE2 2.94Å; K276-E278 PolarHBondContact O-N 3.47Å; E278-S280 PolarHBondContact O-N 2.99Å | ||
| 279 | P | 53.8 | Low | 73.6 | Confident | 35 Ų | 35 | 65.3 Ų | 65.3 | 23% | 0.227 | 36% | 0.359 | C | S | . | . | trans | -77.9 | 118.8 | 166.6 | 29.5 | -28 | 0 | 0 | 0 | 108.6 | R180 L271 S281 | R180-P279 PolarHBondContact NH1-O 3.4Å; L271-P279 HydrophobicContact CD2-CB 4.1Å; P279-S281 PolarHBondContact O-N 3.33Å; P279-S281 PolarHBondContact O-OG 3.25Å | ||
| 280 | S | 55.7 | Low | 73.5 | Confident | 86 Ų | 86 | 67.4 Ų | 67.4 | 60% | 0.601 | 37% | 0.369 | S | S | * | . | trans | -67.7 | 85.2 | 163.2 | 53.4 | 0 | 0 | 0 | 0 | 108.1 | E278 F282 S283 | E278-S280 PolarHBondContact O-N 2.99Å; S280-F282 PolarHBondContact O-N 2.92Å; S280-S283 WeakPolarHBondContact O-CA 3.36Å; S280-S283 WeakPolarHBondContact O-CB 3.11Å; S280-S283 PolarHBondContact O-N 2.69Å | ||
| 281 | S | 57.7 | Low | 73.5 | Confident | 29 Ų | 29 | 64.3 Ų | 64.3 | 20% | 0.203 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -56.3 | -19 | -179.1 | -41.5 | 0 | 0 | 0 | 0 | 112.9 | R180 P279 S283 L284 L285 | R180-S281 WeakPolarHBondContact CB-OG 3.19Å; R180-S281 WeakPolarHBondContact CD-OG 3.17Å; R180-S281 PolarHBondContact NE-OG 3.3Å; P279-S281 PolarHBondContact O-N 3.33Å; P279-S281 PolarHBondContact O-OG 3.25Å; S281-S283 VanDerWaalsContact C-N 3.31Å; S281-L284 PolarHBondContact O-N 2.91Å; S281-L285 PolarHBondContact O-N 3.24Å |
| 282 | F | 59.3 | Low | 73.7 | Confident | 142 Ų | 142 | 63.7 Ų | 63.7 | 62% | 0.623 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -60.8 | -35.6 | 168.2 | -173.7 | -100.4 | 0 | 0 | 0 | 113.2 | S280 T286 | S280-F282 PolarHBondContact O-N 2.92Å; F282-T286 WeakPolarHBondContact O-CB 3.39Å; F282-T286 PolarHBondContact O-N 3.29Å; F282-T286 PolarHBondContact O-OG1 3.47Å |
| 283 | S | 73.7 | Confident | 73.9 | Confident | 35 Ų | 35 | 69.4 Ų | 69.4 | 25% | 0.245 | 37% | 0.372 | C | S | . | . | H | α-helix | trans | -63.1 | -45.4 | 176.3 | -169.7 | 0 | 0 | 0 | 0 | 111.4 | H267 S280 S281 T286 T287 | H267-S283 PolarHBondContact NE2-OG 2.92Å; H267-S283 VanDerWaalsContact NE2-OG 3.15Å; S280-S283 WeakPolarHBondContact O-CA 3.36Å; S280-S283 WeakPolarHBondContact O-CB 3.11Å; S280-S283 PolarHBondContact O-N 2.69Å; S281-S283 VanDerWaalsContact C-N 3.31Å; S283-T286 WeakPolarHBondContact O-CB 3.21Å; S283-T286 PolarHBondContact O-N 2.98Å; S283-T287 WeakPolarHBondContact O-CG2 3.29Å; S283-T287 PolarHBondContact O-N 3.41Å |
| 284 | L | 82.6 | Confident | 74.2 | Confident | 11 Ų | 11 | 65.5 Ų | 65.5 | 6% | 0.058 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -68.7 | -42.6 | -177.6 | -173.5 | 63.3 | 0 | 0 | 0 | 112.8 | W184 L264 V268 L271 S281 T286 T287 V288 | W184-L284 HydrophobicContact CH2-CD2 3.59Å; W184-L284 HydrophobicContact CH2-CG 3.7Å; W184-L284 HydrophobicContact CZ2-CD2 3.83Å; W184-L284 HydrophobicContact CZ2-CG 3.88Å; L264-L284 HydrophobicContact CD1-CD1 4.21Å; V268-L284 HydrophobicContact CG2-CD1 4.29Å; L271-L284 HydrophobicContact CD1-CB 4.42Å; L271-L284 HydrophobicContact CD1-CD1 4.07Å; L271-L284 HydrophobicContact CD1-CD2 4Å; L271-L284 HydrophobicContact CD1-CG 4.4Å; S281-L284 PolarHBondContact O-N 2.91Å; L284-T286 PolarHBondContact O-N 2.85Å; L284-T287 PolarHBondContact O-N 3.15Å; L284-T287 PolarHBondContact O-OG1 3.04Å; L284-V288 WeakPolarHBondContact O-CG2 3.43Å; L284-V288 PolarHBondContact O-N 3.21Å |
| 285 | L | 83.3 | Confident | 74.8 | Confident | 21 Ų | 21 | 62.1 Ų | 62.1 | 11% | 0.11 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -62 | -35.1 | 174.6 | 178.9 | 60.8 | 0 | 0 | 0 | 111.4 | S281 R289 | S281-L285 PolarHBondContact O-N 3.24Å; L285-R289 VanDerWaalsContact O-CG 3.3Å; L285-R289 WeakPolarHBondContact O-CG 3.44Å; L285-R289 PolarHBondContact O-N 3.43Å |
| 286 | T | 85 | Confident | 76.2 | Confident | 46 Ų | 46 | 57.3 Ų | 57.3 | 28% | 0.282 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -67.3 | -41.8 | 176.8 | -58 | 0 | 0 | 0 | 0 | 111.3 | F282 S283 L284 R289 M290 | F282-T286 WeakPolarHBondContact O-CB 3.39Å; F282-T286 PolarHBondContact O-N 3.29Å; F282-T286 PolarHBondContact O-OG1 3.47Å; S283-T286 WeakPolarHBondContact O-CB 3.21Å; S283-T286 PolarHBondContact O-N 2.98Å; L284-T286 PolarHBondContact O-N 2.85Å; T286-R289 WeakPolarHBondContact O-CB 3.49Å; T286-R289 PolarHBondContact O-N 3.06Å; T286-M290 WeakPolarHBondContact O-CG 3.46Å; T286-M290 PolarHBondContact O-N 3.35Å |
| 287 | T | 88 | Confident | 77.6 | Confident | 7 Ų | 7 | 53 Ų | 53 | 4% | 0.043 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -69.6 | -35.6 | 178.1 | 62.5 | 0 | 0 | 0 | 0 | 112.7 | P263 H267 S283 L284 R289 M290 A291 | P263-T287 HydrophobicContact CB-CG2 3.91Å; H267-T287 VanDerWaalsContact ND1-CG2 3.27Å; H267-T287 WeakPolarHBondContact ND1-CG2 3.45Å; S283-T287 WeakPolarHBondContact O-CG2 3.29Å; S283-T287 PolarHBondContact O-N 3.41Å; L284-T287 PolarHBondContact O-N 3.15Å; L284-T287 PolarHBondContact O-OG1 3.04Å; T287-R289 VanDerWaalsContact C-N 3.33Å; T287-R289 PolarHBondContact O-N 3Å; T287-M290 PolarHBondContact O-N 2.82Å; T287-A291 PolarHBondContact O-N 3.36Å |
| 288 | V | 88.6 | Confident | 78.9 | Confident | 14 Ų | 14 | 45.6 Ų | 45.6 | 9% | 0.085 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -60.2 | -44.2 | 169.8 | 171 | 0 | 0 | 0 | 0 | 110.7 | M114 W184 L264 L284 M290 A291 T292 | M114-V288 HydrophobicContact CE-CG1 3.65Å; W184-V288 HydrophobicContact CH2-CG2 3.78Å; W184-V288 HydrophobicContact CZ2-CG2 4.41Å; W184-V288 HydrophobicContact CZ3-CG2 3.8Å; L264-V288 HydrophobicContact CD1-CG2 3.63Å; L284-V288 WeakPolarHBondContact O-CG2 3.43Å; L284-V288 PolarHBondContact O-N 3.21Å; V288-M290 PolarHBondContact O-N 3.3Å; V288-A291 WeakPolarHBondContact O-CB 3.36Å; V288-A291 PolarHBondContact O-N 3.35Å; V288-T292 PolarHBondContact O-N 3.45Å |
| 289 | R | 88.9 | Confident | 80.1 | Confident | 56 Ų | 56 | 39 Ų | 39 | 21% | 0.211 | 20% | 0.204 | C | C | . | . | H | α-helix | trans | -61.3 | -42.5 | 175.2 | -75.3 | 171.8 | 169.8 | 174.5 | -2.5 | 111.9 | S28 L285 T286 T287 A291 T292 W293 | S28-R289 PolarHBondContact O-NH2 3.2Å; S28-R289 PolarHBondContact OG-NH2 3.5Å; L285-R289 VanDerWaalsContact O-CG 3.3Å; L285-R289 WeakPolarHBondContact O-CG 3.44Å; L285-R289 PolarHBondContact O-N 3.43Å; T286-R289 WeakPolarHBondContact O-CB 3.49Å; T286-R289 PolarHBondContact O-N 3.06Å; T287-R289 VanDerWaalsContact C-N 3.33Å; T287-R289 PolarHBondContact O-N 3Å; R289-A291 VanDerWaalsContact C-N 3.3Å; R289-A291 PolarHBondContact O-N 3.27Å; R289-T292 PolarHBondContact O-N 3Å; R289-T292 VanDerWaalsContact O-N 3.15Å; R289-T292 PolarHBondContact O-OG1 3.44Å; R289-W293 VanDerWaalsContact O-CD1 3.23Å; R289-W293 PolarHBondContact O-N 2.68Å |
| 290 | M | 88.6 | Confident | 81.2 | Confident | 86 Ų | 86 | 40.7 Ų | 40.7 | 42% | 0.424 | 21% | 0.206 | S | C | . | . | H | α-helix | trans | -58.7 | -42.2 | 174.7 | -68.2 | -60.9 | -173.9 | 0 | 0 | 111.7 | C260 T286 T287 V288 T292 W293 | C260-M290 VanDerWaalsContact CB-O 3.28Å; C260-M290 WeakPolarHBondContact CB-O 3.26Å; C260-M290 CarbonylContact O-C 3.48Å; T286-M290 WeakPolarHBondContact O-CG 3.46Å; T286-M290 PolarHBondContact O-N 3.35Å; T287-M290 PolarHBondContact O-N 2.82Å; V288-M290 PolarHBondContact O-N 3.3Å; M290-T292 VanDerWaalsContact C-N 3.32Å; M290-T292 PolarHBondContact O-N 3.23Å; M290-W293 WeakPolarHBondContact O-CB 3.28Å; M290-W293 PolarHBondContact O-N 3Å; M290-W293 VanDerWaalsContact O-N 3.11Å |
| 291 | A | 89.9 | Confident | 82.4 | Confident | 4 Ų | 4 | 37.3 Ų | 37.3 | 3% | 0.033 | 18% | 0.182 | C | C | . | . | H | α-helix | trans | -61.7 | -38.8 | 175.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | C260 W261 L264 T287 V288 R289 W293 N294 | C260-A291 VanDerWaalsContact O-CA 3.32Å; C260-A291 WeakPolarHBondContact O-CA 3.31Å; C260-A291 PolarHBondContact O-N 3.42Å; W261-A291 HydrophobicContact CD2-CB 4.22Å; W261-A291 HydrophobicContact CE3-CB 3.83Å; W261-A291 HydrophobicContact CH2-CB 4.23Å; W261-A291 HydrophobicContact CZ3-CB 3.84Å; L264-A291 HydrophobicContact CD2-CB 3.7Å; T287-A291 PolarHBondContact O-N 3.36Å; V288-A291 WeakPolarHBondContact O-CB 3.36Å; V288-A291 PolarHBondContact O-N 3.35Å; R289-A291 VanDerWaalsContact C-N 3.3Å; R289-A291 PolarHBondContact O-N 3.27Å; A291-W293 VanDerWaalsContact C-N 3.26Å; A291-W293 PolarHBondContact O-N 3.44Å; A291-N294 WeakPolarHBondContact O-CB 3.13Å; A291-N294 PolarHBondContact O-N 2.68Å |
| 292 | T | 88.7 | Confident | 83 | Confident | 34 Ų | 34 | 37 Ų | 37 | 21% | 0.209 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -63.9 | -29.4 | 175.2 | 62 | 0 | 0 | 0 | 0 | 113.2 | V288 R289 M290 N294 Q295 I296 | V288-T292 PolarHBondContact O-N 3.45Å; R289-T292 PolarHBondContact O-N 3Å; R289-T292 VanDerWaalsContact O-N 3.15Å; R289-T292 PolarHBondContact O-OG1 3.44Å; M290-T292 VanDerWaalsContact C-N 3.32Å; M290-T292 PolarHBondContact O-N 3.23Å; T292-N294 PolarHBondContact O-N 2.94Å; T292-Q295 WeakPolarHBondContact O-CB 3.47Å; T292-Q295 PolarHBondContact O-N 2.78Å; T292-I296 WeakPolarHBondContact O-CG1 3.3Å; T292-I296 PolarHBondContact O-N 3.42Å |
| 293 | W | 88 | Confident | 83.6 | Confident | 128 Ų | 128 | 31.2 Ų | 31.2 | 49% | 0.485 | 15% | 0.152 | S | C | . | . | H | α-helix | trans | -64.4 | -29.1 | 173.7 | -80.9 | 95.3 | 0 | 0 | 0 | 112.5 | R289 M290 A291 Q295 I296 L297 | R289-W293 VanDerWaalsContact O-CD1 3.23Å; R289-W293 PolarHBondContact O-N 2.68Å; M290-W293 WeakPolarHBondContact O-CB 3.28Å; M290-W293 PolarHBondContact O-N 3Å; M290-W293 VanDerWaalsContact O-N 3.11Å; A291-W293 VanDerWaalsContact C-N 3.26Å; A291-W293 PolarHBondContact O-N 3.44Å; W293-Q295 VanDerWaalsContact C-N 3.35Å; W293-Q295 PolarHBondContact O-N 3Å; W293-I296 HydrophobicContact CE3-CD1 4.47Å; W293-I296 PolarHBondContact O-N 3.19Å; W293-L297 WeakPolarHBondContact O-CB 3.39Å; W293-L297 VanDerWaalsContact O-CG 3.26Å; W293-L297 WeakPolarHBondContact O-CG 3.37Å; W293-L297 PolarHBondContact O-N 2.99Å |
| 294 | N | 89.3 | Confident | 82.9 | Confident | 1 Ų | 1 | 32.5 Ų | 32.5 | 1% | 0.005 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -59.7 | -47.4 | 173.4 | -163.1 | 80.6 | 0 | 0 | 0 | 111.4 | S257 C260 W261 A291 T292 I296 L297 D298 | S257-N294 WeakPolarHBondContact CA-OD1 3.35Å; C260-N294 HydrophobicContact CB-CB 3.54Å; W261-N294 PolarHBondContact NE1-ND2 3.01Å; A291-N294 WeakPolarHBondContact O-CB 3.13Å; A291-N294 PolarHBondContact O-N 2.68Å; T292-N294 PolarHBondContact O-N 2.94Å; N294-I296 PolarHBondContact O-N 3.01Å; N294-L297 PolarHBondContact O-N 3.03Å; N294-L297 VanDerWaalsContact O-N 3.08Å; N294-D298 PolarHBondContact ND2-OD1 3.03Å; N294-D298 PolarHBondContact ND2-OD2 3.23Å; N294-D298 WeakPolarHBondContact O-CB 3.39Å; N294-D298 VanDerWaalsContact O-CG 3.29Å; N294-D298 PolarHBondContact O-N 2.98Å; N294-D298 PolarHBondContact OD1-OD1 2.96Å |
| 295 | Q | 87.9 | Confident | 81.7 | Confident | 12 Ų | 12 | 34 Ų | 34 | 6% | 0.056 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -62.3 | -26.3 | 180 | -61.5 | 171 | -8.2 | 0 | 0 | 112.1 | N43 D76 Y117 W261 T292 W293 | N43-Q295 PolarHBondContact ND2-O 3.44Å; D76-Q295 HydrophobicContact CB-CB 4.14Å; Y117-Q295 PolarHBondContact O-NE2 3.4Å; Y117-Q295 VanDerWaalsContact O-NE2 3.1Å; W261-Q295 HydrophobicContact CZ2-CG 4.49Å; T292-Q295 WeakPolarHBondContact O-CB 3.47Å; T292-Q295 PolarHBondContact O-N 2.78Å; W293-Q295 VanDerWaalsContact C-N 3.35Å; W293-Q295 PolarHBondContact O-N 3Å |
| 296 | I | 86.9 | Confident | 81 | Confident | 5 Ų | 5 | 38 Ų | 38 | 3% | 0.026 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -78 | -45.2 | 173.8 | -58.6 | 177.1 | 0 | 0 | 0 | 110.6 | S35 V38 S42 T292 W293 N294 | S35-I296 WeakPolarHBondContact O-CD1 3.42Å; V38-I296 HydrophobicContact CG1-CG2 3.79Å; S42-I296 PolarHBondContact OG-O 3.27Å; T292-I296 WeakPolarHBondContact O-CG1 3.3Å; T292-I296 PolarHBondContact O-N 3.42Å; W293-I296 HydrophobicContact CE3-CD1 4.47Å; W293-I296 PolarHBondContact O-N 3.19Å; N294-I296 PolarHBondContact O-N 3.01Å |
| 297 | L | 85 | Confident | 79.7 | Confident | 61 Ų | 61 | 38.7 Ų | 38.7 | 32% | 0.319 | 18% | 0.176 | S | C | . | . | H | α-helix | trans | -81.6 | -33.3 | -170.5 | -68.9 | 173.7 | 0 | 0 | 0 | 113.7 | V256 W293 N294 W300 V301 | V256-L297 HydrophobicContact CG1-CB 4.04Å; V256-L297 HydrophobicContact CG1-CD1 3.93Å; W293-L297 WeakPolarHBondContact O-CB 3.39Å; W293-L297 VanDerWaalsContact O-CG 3.26Å; W293-L297 WeakPolarHBondContact O-CG 3.37Å; W293-L297 PolarHBondContact O-N 2.99Å; N294-L297 PolarHBondContact O-N 3.03Å; N294-L297 VanDerWaalsContact O-N 3.08Å; L297-W300 WeakPolarHBondContact O-CA 3.22Å; L297-W300 WeakPolarHBondContact O-CB 3.33Å; L297-W300 PolarHBondContact O-N 3.31Å; L297-V301 WeakPolarHBondContact O-CG2 3.37Å; L297-V301 PolarHBondContact O-N 3.31Å |
| 298 | D | 81.4 | Confident | 78.3 | Confident | 2 Ų | 2 | 41.5 Ų | 41.5 | 1% | 0.011 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -43.4 | -57.7 | -176.6 | -89.4 | 5.4 | 0 | 0 | 0 | 113 | L72 N294 W300 V301 Y302 | L72-D298 HydrophobicContact CD2-CB 4.44Å; N294-D298 PolarHBondContact ND2-OD1 3.03Å; N294-D298 PolarHBondContact ND2-OD2 3.23Å; N294-D298 WeakPolarHBondContact O-CB 3.39Å; N294-D298 VanDerWaalsContact O-CG 3.29Å; N294-D298 PolarHBondContact O-N 2.98Å; N294-D298 PolarHBondContact OD1-OD1 2.96Å; D298-W300 VanDerWaalsContact C-N 3.27Å; D298-W300 PolarHBondContact O-N 3.1Å; D298-V301 PolarHBondContact O-N 3.07Å; D298-Y302 HydrophobicContact CB-CE2 4.45Å; D298-Y302 WeakPolarHBondContact O-CD2 3.34Å; D298-Y302 WeakPolarHBondContact O-CE2 3.47Å; D298-Y302 PolarHBondContact O-N 2.78Å |
| 299 | P | 78.9 | Confident | 76.9 | Confident | 4 Ų | 4 | 42.9 Ų | 42.9 | 3% | 0.026 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -59.5 | -35.8 | 179.6 | 21.5 | -33 | 0 | 0 | 0 | 113.5 | A46 V73 Y302 I303 | A46-P299 HydrophobicContact CB-CB 3.34Å; A46-P299 HydrophobicContact CB-CG 4.11Å; V73-P299 HydrophobicContact CG2-CB 4.13Å; P299-Y302 PolarHBondContact O-N 2.75Å; P299-I303 WeakPolarHBondContact O-CB 3.34Å; P299-I303 WeakPolarHBondContact O-CD1 3.24Å; P299-I303 WeakPolarHBondContact O-CG1 3.45Å; P299-I303 PolarHBondContact O-N 3.29Å |
| 300 | W | 78.9 | Confident | 75.4 | Confident | 70 Ų | 70 | 44 Ų | 44 | 27% | 0.265 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -73.5 | -37.1 | -179.1 | -62 | 110 | 0 | 0 | 0 | 112.5 | S42 F45 L297 D298 Y302 I303 L304 | S42-W300 PolarHBondContact OG-NE1 3.47Å; F45-W300 AromaticContact CD1-CH2 3.41Å; F45-W300 HydrophobicContact CD1-CH2 3.41Å; F45-W300 VanDerWaalsContact CD1-CH2 3.41Å; F45-W300 HydrophobicContact CD1-CZ2 4.19Å; F45-W300 HydrophobicContact CD1-CZ3 4Å; F45-W300 AromaticContact CE1-CH2 3.74Å; F45-W300 HydrophobicContact CE1-CH2 3.74Å; F45-W300 AromaticContact CE1-CZ3 3.97Å; F45-W300 HydrophobicContact CE1-CZ3 3.97Å; F45-W300 HydrophobicContact CG-CH2 4.48Å; L297-W300 WeakPolarHBondContact O-CA 3.22Å; L297-W300 WeakPolarHBondContact O-CB 3.33Å; L297-W300 PolarHBondContact O-N 3.31Å; D298-W300 VanDerWaalsContact C-N 3.27Å; D298-W300 PolarHBondContact O-N 3.1Å; W300-Y302 PolarHBondContact O-N 3.26Å; W300-I303 PolarHBondContact O-N 3.45Å; W300-L304 HydrophobicContact CB-CD1 3.76Å; W300-L304 HydrophobicContact CB-CG 4.01Å; W300-L304 HydrophobicContact CD2-CD1 4.48Å; W300-L304 HydrophobicContact CE3-CD1 4.18Å; W300-L304 HydrophobicContact CE3-CD2 3.88Å; W300-L304 HydrophobicContact CE3-CG 3.87Å; W300-L304 HydrophobicContact CG-CD1 4.36Å; W300-L304 HydrophobicContact CZ3-CD2 4.37Å; W300-L304 WeakPolarHBondContact O-CA 3.33Å; W300-L304 WeakPolarHBondContact O-CB 3.33Å; W300-L304 WeakPolarHBondContact O-CG 3.19Å; W300-L304 PolarHBondContact O-N 3.18Å |
| 301 | V | 78.9 | Confident | 74.1 | Confident | 16 Ų | 16 | 46.6 Ų | 46.6 | 10% | 0.097 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -61 | -32.6 | 173 | -173.3 | 0 | 0 | 0 | 0 | 109.9 | A252 I253 V256 L297 D298 L305 | A252-V301 HydrophobicContact CB-CG1 3.95Å; I253-V301 HydrophobicContact CB-CG1 4.27Å; I253-V301 HydrophobicContact CD1-CG1 4.49Å; I253-V301 HydrophobicContact CG1-CB 4.25Å; I253-V301 HydrophobicContact CG1-CG1 3.37Å; V256-V301 HydrophobicContact CG2-CG2 4.19Å; L297-V301 WeakPolarHBondContact O-CG2 3.37Å; L297-V301 PolarHBondContact O-N 3.31Å; D298-V301 PolarHBondContact O-N 3.07Å; V301-L305 HydrophobicContact CG1-CD1 3.64Å; V301-L305 WeakPolarHBondContact O-CD1 3.35Å |
| 302 | Y | 71.3 | Confident | 72.9 | Confident | 21 Ų | 21 | 53.8 Ų | 53.8 | 8% | 0.082 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -75.5 | -34.7 | 174.2 | -63.8 | -64.7 | 0 | 0 | 0 | 115.2 | F65 L72 M128 Q249 I253 D298 P299 W300 | F65-Y302 HydrophobicContact CZ-CD1 4.41Å; L72-Y302 HydrophobicContact CD2-CE2 4.2Å; M128-Y302 HydrophobicContact CE-CE2 4.5Å; M128-Y302 HydrophobicContact SD-CD1 4.48Å; M128-Y302 HydrophobicContact SD-CE1 3.58Å; M128-Y302 VanDerWaalsContact SD-CE1 3.58Å; M128-Y302 HydrophobicContact SD-CE2 4.19Å; M128-Y302 PolarHBondContact SD-OH 3.48Å; Q249-Y302 PolarHBondContact NE2-O 2.92Å; I253-Y302 HydrophobicContact CD1-CD1 3.81Å; I253-Y302 HydrophobicContact CD1-CE1 3.28Å; I253-Y302 HydrophobicContact CG1-CE1 4.04Å; D298-Y302 HydrophobicContact CB-CE2 4.45Å; D298-Y302 WeakPolarHBondContact O-CD2 3.34Å; D298-Y302 WeakPolarHBondContact O-CE2 3.47Å; D298-Y302 PolarHBondContact O-N 2.78Å; P299-Y302 PolarHBondContact O-N 2.75Å; W300-Y302 PolarHBondContact O-N 3.26Å |
| 303 | I | 70.9 | Confident | 71.7 | Confident | 22 Ų | 22 | 55.6 Ų | 55.6 | 11% | 0.113 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -94.1 | -49.6 | -172.6 | -65.7 | 166.2 | 0 | 0 | 0 | 112.1 | A46 I49 P299 W300 R306 | A46-I303 HydrophobicContact CB-CD1 4.07Å; I49-I303 HydrophobicContact CD1-CD1 4.16Å; I49-I303 HydrophobicContact CD1-CG2 4.48Å; P299-I303 WeakPolarHBondContact O-CB 3.34Å; P299-I303 WeakPolarHBondContact O-CD1 3.24Å; P299-I303 WeakPolarHBondContact O-CG1 3.45Å; P299-I303 PolarHBondContact O-N 3.29Å; W300-I303 PolarHBondContact O-N 3.45Å; I303-R306 WeakPolarHBondContact O-CB 3.45Å; I303-R306 PolarHBondContact O-N 3.31Å |
| 304 | L | 60.1 | Low | 70.7 | Confident | 61 Ų | 61 | 56.1 Ų | 56.1 | 32% | 0.319 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -66.9 | -38.4 | -174 | -64.7 | -179.5 | 0 | 0 | 0 | 111.8 | W300 R306 V309 L310 I313 | W300-L304 HydrophobicContact CB-CD1 3.76Å; W300-L304 HydrophobicContact CB-CG 4.01Å; W300-L304 HydrophobicContact CD2-CD1 4.48Å; W300-L304 HydrophobicContact CE3-CD1 4.18Å; W300-L304 HydrophobicContact CE3-CD2 3.88Å; W300-L304 HydrophobicContact CE3-CG 3.87Å; W300-L304 HydrophobicContact CG-CD1 4.36Å; W300-L304 HydrophobicContact CZ3-CD2 4.37Å; W300-L304 WeakPolarHBondContact O-CA 3.33Å; W300-L304 WeakPolarHBondContact O-CB 3.33Å; W300-L304 WeakPolarHBondContact O-CG 3.19Å; W300-L304 PolarHBondContact O-N 3.18Å; L304-R306 PolarHBondContact O-N 3.23Å; L304-R306 VanDerWaalsContact O-N 3.13Å; L304-V309 HydrophobicContact CD2-CG1 4.12Å; L304-L310 WeakPolarHBondContact O-CD2 3.37Å; L304-L310 WeakPolarHBondContact O-CG 3.4Å; L304-I313 HydrophobicContact CD2-CD1 3.75Å |
| 305 | L | 58.1 | Low | 69.6 | Low | 44 Ų | 44 | 62.8 Ų | 62.8 | 23% | 0.23 | 30% | 0.3 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -73.7 | 0.4 | -178.6 | -66.3 | 172.8 | 0 | 0 | 0 | 113.6 | E245 Q249 A252 V301 K307 | E245-L305 WeakPolarHBondContact CG-O 3.36Å; Q249-L305 HydrophobicContact CB-CB 4.15Å; Q249-L305 HydrophobicContact CB-CD1 4.28Å; Q249-L305 HydrophobicContact CG-CB 4.09Å; Q249-L305 HydrophobicContact CG-CD1 4.2Å; A252-L305 HydrophobicContact CB-CD1 3.45Å; A252-L305 VanDerWaalsContact CB-CD1 3.45Å; V301-L305 HydrophobicContact CG1-CD1 3.64Å; V301-L305 WeakPolarHBondContact O-CD1 3.35Å; L305-K307 PolarHBondContact O-N 2.77Å |
| 306 | R | 67.4 | Low | 68.7 | Low | 105 Ų | 105 | 67.6 Ų | 67.6 | 40% | 0.396 | 33% | 0.325 | S | S | . | . | S | Bend | trans | -70.3 | 127 | 166.8 | -68.2 | -175.1 | -179.8 | 179.8 | 1.7 | 109.8 | E245 I303 L304 A308 V309 L310 | E245-R306 VanDerWaalsContact OE1-CA 3.26Å; E245-R306 WeakPolarHBondContact OE1-CA 3.42Å; I303-R306 WeakPolarHBondContact O-CB 3.45Å; I303-R306 PolarHBondContact O-N 3.31Å; L304-R306 PolarHBondContact O-N 3.23Å; L304-R306 VanDerWaalsContact O-N 3.13Å; R306-A308 PolarHBondContact O-N 3.15Å; R306-V309 HydrophobicContact CB-CG2 4.25Å; R306-V309 CarbonylContact O-C 3.6Å; R306-V309 WeakPolarHBondContact O-CA 3.34Å; R306-V309 WeakPolarHBondContact O-CB 3.24Å; R306-V309 PolarHBondContact O-N 3.14Å; R306-L310 PolarHBondContact O-N 3.21Å |
| 307 | K | 57.7 | Low | 68 | Low | 60 Ų | 60 | 73.1 Ų | 73.1 | 26% | 0.261 | 35% | 0.349 | S | S | . | . | H | α-helix | trans | -58.8 | -25.1 | -178 | -175.9 | -174.1 | -178.1 | -170.7 | 0 | 113.9 | S241 E245 L305 V309 R311 | S241-K307 WeakPolarHBondContact OG-CE 3.42Å; S241-K307 PolarHBondContact OG-NZ 2.98Å; E245-K307 VanDerWaalsContact CD-N 3.32Å; E245-K307 HydrophobicContact CG-CB 4.2Å; E245-K307 WeakPolarHBondContact OE1-CB 3.32Å; E245-K307 PolarHBondContact OE1-N 3.4Å; E245-K307 WeakPolarHBondContact OE2-CB 3.43Å; L305-K307 PolarHBondContact O-N 2.77Å; K307-V309 VanDerWaalsContact C-N 3.34Å; K307-R311 VanDerWaalsContact CE-CZ 3.42Å; K307-R311 VanDerWaalsContact O-CB 3.24Å; K307-R311 WeakPolarHBondContact O-CB 3.44Å; K307-R311 WeakPolarHBondContact O-CG 3.43Å; K307-R311 PolarHBondContact O-N 3.36Å; K307-R311 PolarHBondContact O-NE 2.94Å |
| 308 | A | 58.5 | Low | 67.1 | Low | 65 Ų | 65 | 75 Ų | 75 | 54% | 0.537 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -68.7 | -34.9 | 171.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | R306 K312 | R306-A308 PolarHBondContact O-N 3.15Å; A308-K312 WeakPolarHBondContact O-CG 3.34Å; A308-K312 PolarHBondContact O-N 3.16Å |
| 309 | V | 59.1 | Low | 66.2 | Low | 43 Ų | 43 | 79.1 Ų | 79.1 | 26% | 0.261 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -81.2 | -47.9 | 177.8 | -178.4 | 0 | 0 | 0 | 0 | 110 | L304 R306 K307 R311 K312 I313 | L304-V309 HydrophobicContact CD2-CG1 4.12Å; R306-V309 HydrophobicContact CB-CG2 4.25Å; R306-V309 CarbonylContact O-C 3.6Å; R306-V309 WeakPolarHBondContact O-CA 3.34Å; R306-V309 WeakPolarHBondContact O-CB 3.24Å; R306-V309 PolarHBondContact O-N 3.14Å; K307-V309 VanDerWaalsContact C-N 3.34Å; V309-R311 VanDerWaalsContact C-N 3.29Å; V309-R311 PolarHBondContact O-N 3.35Å; V309-K312 PolarHBondContact O-N 2.88Å; V309-I313 HydrophobicContact CG1-CD1 3.74Å; V309-I313 HydrophobicContact CG1-CG1 4.3Å; V309-I313 WeakPolarHBondContact O-CG1 3.41Å; V309-I313 PolarHBondContact O-N 3.3Å |
| 310 | L | 58.4 | Low | 65.2 | Low | 80 Ų | 80 | 83.9 Ų | 83.9 | 42% | 0.419 | 42% | 0.418 | S | S | . | . | H | α-helix | trans | -55.3 | -42.3 | 174 | -68.4 | 178 | 0 | 0 | 0 | 112.4 | L304 R306 I313 F314 | L304-L310 WeakPolarHBondContact O-CD2 3.37Å; L304-L310 WeakPolarHBondContact O-CG 3.4Å; R306-L310 PolarHBondContact O-N 3.21Å; L310-I313 PolarHBondContact O-N 3.09Å; L310-F314 WeakPolarHBondContact O-CB 3.41Å; L310-F314 PolarHBondContact O-N 3.05Å |
| 311 | R | 60.5 | Low | 64 | Low | 141 Ų | 141 | 89.7 Ų | 89.7 | 53% | 0.532 | 44% | 0.44 | S | S | . | . | H | α-helix | trans | -65.7 | -39.7 | 176.3 | -82.4 | -174.6 | -77.5 | -157.7 | 0.2 | 112.8 | K307 V309 M315 | K307-R311 VanDerWaalsContact CE-CZ 3.42Å; K307-R311 VanDerWaalsContact O-CB 3.24Å; K307-R311 WeakPolarHBondContact O-CB 3.44Å; K307-R311 WeakPolarHBondContact O-CG 3.43Å; K307-R311 PolarHBondContact O-N 3.36Å; K307-R311 PolarHBondContact O-NE 2.94Å; V309-R311 VanDerWaalsContact C-N 3.29Å; V309-R311 PolarHBondContact O-N 3.35Å; R311-M315 VanDerWaalsContact O-CB 3.28Å; R311-M315 WeakPolarHBondContact O-CB 3.29Å; R311-M315 WeakPolarHBondContact O-CG 3.48Å; R311-M315 PolarHBondContact O-N 3.47Å |
| 312 | K | 64.5 | Low | 62.7 | Low | 154 Ų | 154 | 90.2 Ų | 90.2 | 67% | 0.67 | 45% | 0.448 | S | S | * | . | H | α-helix | trans | -66.8 | -43.1 | 176.3 | -78.2 | -177.2 | 176.9 | -170.1 | 0 | 111.4 | A308 V309 M315 L316 | A308-K312 WeakPolarHBondContact O-CG 3.34Å; A308-K312 PolarHBondContact O-N 3.16Å; V309-K312 PolarHBondContact O-N 2.88Å; K312-M315 PolarHBondContact O-N 3.07Å; K312-L316 WeakPolarHBondContact O-CB 3.31Å; K312-L316 WeakPolarHBondContact O-CG 3.36Å; K312-L316 PolarHBondContact O-N 2.94Å |
| 313 | I | 64.4 | Low | 61.5 | Low | 72 Ų | 72 | 94.7 Ų | 94.7 | 37% | 0.369 | 48% | 0.482 | S | S | . | . | H | α-helix | trans | -64 | -46.7 | 175.9 | -66.3 | 172.1 | 0 | 0 | 0 | 110.1 | L304 V309 L310 M315 L316 F317 | L304-I313 HydrophobicContact CD2-CD1 3.75Å; V309-I313 HydrophobicContact CG1-CD1 3.74Å; V309-I313 HydrophobicContact CG1-CG1 4.3Å; V309-I313 WeakPolarHBondContact O-CG1 3.41Å; V309-I313 PolarHBondContact O-N 3.3Å; L310-I313 PolarHBondContact O-N 3.09Å; I313-M315 VanDerWaalsContact C-N 3.35Å; I313-M315 PolarHBondContact O-N 3.35Å; I313-L316 CarbonylContact O-C 3.27Å; I313-L316 PolarHBondContact O-N 3.05Å; I313-F317 VanDerWaalsContact O-CB 3.29Å; I313-F317 WeakPolarHBondContact O-CB 3.27Å; I313-F317 PolarHBondContact O-N 3.2Å |
| 314 | F | 67.4 | Low | 60.4 | Low | 140 Ų | 140 | 102.8 Ų | 102.8 | 61% | 0.614 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -60.5 | -42.5 | 176.8 | -176 | -95.7 | 0 | 0 | 0 | 112.1 | L310 F317 H318 | L310-F314 WeakPolarHBondContact O-CB 3.41Å; L310-F314 PolarHBondContact O-N 3.05Å; F314-F317 PolarHBondContact O-N 3.39Å; F314-H318 WeakPolarHBondContact O-CB 3.21Å; F314-H318 PolarHBondContact O-N 3.36Å |
| 315 | M | 66.4 | Low | 59.4 | Low | 140 Ų | 140 | 105.1 Ų | 105.1 | 69% | 0.69 | 53% | 0.529 | S | S | * | . | H | α-helix | trans | -64.4 | -39.5 | 174.6 | -70.2 | -90 | -76.2 | 0 | 0 | 112 | R311 K312 I313 S319 | R311-M315 VanDerWaalsContact O-CB 3.28Å; R311-M315 WeakPolarHBondContact O-CB 3.29Å; R311-M315 WeakPolarHBondContact O-CG 3.48Å; R311-M315 PolarHBondContact O-N 3.47Å; K312-M315 PolarHBondContact O-N 3.07Å; I313-M315 VanDerWaalsContact C-N 3.35Å; I313-M315 PolarHBondContact O-N 3.35Å; M315-S319 WeakPolarHBondContact O-CB 3.49Å; M315-S319 PolarHBondContact O-N 3.23Å |
| 316 | L | 68.6 | Low | 58.6 | Low | 114 Ų | 114 | 111.4 Ų | 111.4 | 60% | 0.597 | 56% | 0.557 | S | S | * | * | H | α-helix | trans | -68.6 | -43.7 | 175.5 | -73.5 | 167.5 | 0 | 0 | 0 | 111.5 | K312 I313 S319 C320 | K312-L316 WeakPolarHBondContact O-CB 3.31Å; K312-L316 WeakPolarHBondContact O-CG 3.36Å; K312-L316 PolarHBondContact O-N 2.94Å; I313-L316 CarbonylContact O-C 3.27Å; I313-L316 PolarHBondContact O-N 3.05Å; L316-S319 CarbonylContact O-C 3.54Å; L316-S319 WeakPolarHBondContact O-CA 3.22Å; L316-S319 WeakPolarHBondContact O-CB 3.37Å; L316-S319 PolarHBondContact O-N 3.07Å; L316-S319 VanDerWaalsContact O-N 3.1Å; L316-C320 WeakPolarHBondContact O-CB 3.34Å; L316-C320 PolarHBondContact O-N 3.46Å; L316-C320 PolarHBondContact O-SG 2.96Å |
| 317 | F | 70.9 | Confident | 57.3 | Low | 121 Ų | 121 | 111.9 Ų | 111.9 | 53% | 0.531 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -64.6 | -43.8 | 178 | -148.5 | -98.2 | 0 | 0 | 0 | 110.3 | I313 F314 S319 C320 W321 | I313-F317 VanDerWaalsContact O-CB 3.29Å; I313-F317 WeakPolarHBondContact O-CB 3.27Å; I313-F317 PolarHBondContact O-N 3.2Å; F314-F317 PolarHBondContact O-N 3.39Å; F317-S319 VanDerWaalsContact C-N 3.3Å; F317-S319 PolarHBondContact O-N 2.78Å; F317-C320 PolarHBondContact O-N 2.75Å; F317-W321 AromaticContact CD1-CE3 3.59Å; F317-W321 HydrophobicContact CD1-CE3 3.59Å; F317-W321 AromaticContact CD1-CZ3 3.94Å; F317-W321 HydrophobicContact CD1-CZ3 3.94Å; F317-W321 HydrophobicContact CE1-CD2 4.31Å; F317-W321 AromaticContact CE1-CE3 3.21Å; F317-W321 HydrophobicContact CE1-CE3 3.21Å; F317-W321 HydrophobicContact CE1-CH2 4.05Å; F317-W321 AromaticContact CE1-CZ3 3.07Å; F317-W321 HydrophobicContact CE1-CZ3 3.07Å; F317-W321 HydrophobicContact CE2-CZ3 4.21Å; F317-W321 HydrophobicContact CG-CE3 4.46Å; F317-W321 AromaticContact CZ-CE3 3.8Å; F317-W321 HydrophobicContact CZ-CE3 3.8Å; F317-W321 HydrophobicContact CZ-CH2 4.21Å; F317-W321 AromaticContact CZ-CZ3 3.25Å; F317-W321 HydrophobicContact CZ-CZ3 3.25Å; F317-W321 VanDerWaalsContact O-CB 3.32Å; F317-W321 WeakPolarHBondContact O-CB 3.5Å; F317-W321 PolarHBondContact O-N 3.11Å |
| 318 | H | 67.4 | Low | 56.5 | Low | 100 Ų | 100 | 116.7 Ų | 116.7 | 46% | 0.463 | 59% | 0.592 | S | S | . | * | H | α-helix | trans | -69 | -25.7 | 172.6 | -166.4 | -77 | 0 | 0 | 0 | 112.4 | F314 G322 | F314-H318 WeakPolarHBondContact O-CB 3.21Å; F314-H318 PolarHBondContact O-N 3.36Å; H318-G322 WeakPolarHBondContact O-CA 3.49Å; H318-G322 PolarHBondContact O-N 3.49Å |
| 319 | S | 61.4 | Low | 55.5 | Low | 88 Ų | 88 | 121.9 Ų | 121.9 | 62% | 0.615 | 61% | 0.605 | S | S | * | * | H | α-helix | trans | -74.8 | -34.2 | 170.9 | -171.2 | 0 | 0 | 0 | 0 | 111.9 | M315 L316 F317 | M315-S319 WeakPolarHBondContact O-CB 3.49Å; M315-S319 PolarHBondContact O-N 3.23Å; L316-S319 CarbonylContact O-C 3.54Å; L316-S319 WeakPolarHBondContact O-CA 3.22Å; L316-S319 WeakPolarHBondContact O-CB 3.37Å; L316-S319 PolarHBondContact O-N 3.07Å; L316-S319 VanDerWaalsContact O-N 3.1Å; F317-S319 VanDerWaalsContact C-N 3.3Å; F317-S319 PolarHBondContact O-N 2.78Å |
| 320 | C | 57.5 | Low | 54.4 | Low | 105 Ų | 105 | 129.7 Ų | 129.7 | 71% | 0.709 | 63% | 0.63 | S | S | * | * | H | α-helix | trans | -76.3 | -31 | 174.9 | -68.8 | 0 | 0 | 0 | 0 | 112.3 | L316 F317 | L316-C320 WeakPolarHBondContact O-CB 3.34Å; L316-C320 PolarHBondContact O-N 3.46Å; L316-C320 PolarHBondContact O-SG 2.96Å; F317-C320 PolarHBondContact O-N 2.75Å |
| 321 | W | 54.7 | Low | 53.2 | Low | 192 Ų | 192 | 134.6 Ų | 134.6 | 73% | 0.727 | 64% | 0.643 | S | S | * | * | H | α-helix | trans | -93.3 | -13.9 | 176.4 | -125.5 | -71.5 | 0 | 0 | 0 | 113.6 | F317 | F317-W321 AromaticContact CD1-CE3 3.59Å; F317-W321 HydrophobicContact CD1-CE3 3.59Å; F317-W321 AromaticContact CD1-CZ3 3.94Å; F317-W321 HydrophobicContact CD1-CZ3 3.94Å; F317-W321 HydrophobicContact CE1-CD2 4.31Å; F317-W321 AromaticContact CE1-CE3 3.21Å; F317-W321 HydrophobicContact CE1-CE3 3.21Å; F317-W321 HydrophobicContact CE1-CH2 4.05Å; F317-W321 AromaticContact CE1-CZ3 3.07Å; F317-W321 HydrophobicContact CE1-CZ3 3.07Å; F317-W321 HydrophobicContact CE2-CZ3 4.21Å; F317-W321 HydrophobicContact CG-CE3 4.46Å; F317-W321 AromaticContact CZ-CE3 3.8Å; F317-W321 HydrophobicContact CZ-CE3 3.8Å; F317-W321 HydrophobicContact CZ-CH2 4.21Å; F317-W321 AromaticContact CZ-CZ3 3.25Å; F317-W321 HydrophobicContact CZ-CZ3 3.25Å; F317-W321 VanDerWaalsContact O-CB 3.32Å; F317-W321 WeakPolarHBondContact O-CB 3.5Å; F317-W321 PolarHBondContact O-N 3.11Å |
| 322 | G | 50.6 | Low | 52 | Low | 26 Ų | 26 | 135.9 Ų | 135.9 | 27% | 0.268 | 66% | 0.655 | S | S | . | * | trans | -104.8 | 29.5 | -167.7 | 0 | 0 | 0 | 0 | 0 | 115.1 | H318 K324 | H318-G322 WeakPolarHBondContact O-CA 3.49Å; H318-G322 PolarHBondContact O-N 3.49Å; G322-K324 PolarHBondContact O-N 3.32Å | ||
| 323 | S | 46.8 | Very low | 50.6 | Low | 115 Ų | 115 | 139.6 Ų | 139.6 | 80% | 0.804 | 67% | 0.665 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.8 | 2.2 | 158.9 | 48.3 | 0 | 0 | 0 | 0 | 112.8 | ||
| 324 | K | 47.1 | Very low | 49.3 | Very low | 193 Ų | 193 | 140.2 Ų | 140.2 | 84% | 0.839 | 68% | 0.676 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -129 | 19.6 | 178.1 | -93.8 | -165.9 | 179.9 | -176.2 | 0 | 117.2 | G322 | G322-K324 PolarHBondContact O-N 3.32Š|
| 325 | L | 40.2 | Very low | 47.9 | Very low | 109 Ų | 109 | 138.1 Ų | 138.1 | 57% | 0.571 | 68% | 0.675 | S | S | * | * | trans | -141.8 | 54.5 | 174.2 | -147.6 | 74.9 | 0 | 0 | 0 | 113.9 | T327 | L325-T327 PolarHBondContact O-N 3.03Š| ||
| 326 | H | 40.3 | Very low | 46.7 | Very low | 177 Ų | 177 | 139.8 Ų | 139.8 | 82% | 0.819 | 69% | 0.685 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -81.9 | 10.7 | 172.7 | -149.4 | -76.5 | 0 | 0 | 0 | 113.5 | ||
| 327 | T | 41.1 | Very low | 45.3 | Very low | 114 Ų | 114 | 138.2 Ų | 138.2 | 70% | 0.699 | 70% | 0.697 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -107.5 | 6.1 | -169.7 | -26.7 | 0 | 0 | 0 | 0 | 114.7 | L325 | L325-T327 PolarHBondContact O-N 3.03Š|
| 328 | F | 40.1 | Very low | 43.7 | Very low | 161 Ų | 161 | 138.3 Ų | 138.3 | 71% | 0.706 | 71% | 0.712 | S | S | * | * | S | Bend | trans | -99.1 | -17.9 | 179.1 | -134.8 | -95.2 | 0 | 0 | 0 | 114.5 | R330 | F328-R330 VanDerWaalsContact C-N 3.35Å; F328-R330 PolarHBondContact O-N 3.19Å |
| 329 | H | 38.8 | Very low | 42.1 | Very low | 175 Ų | 175 | 139.6 Ų | 139.6 | 81% | 0.81 | 73% | 0.733 | S | S | * | * | S | Bend | trans | -85.1 | -4.1 | 179.4 | -120.9 | -68.4 | 0 | 0 | 0 | 114.5 | ||
| 330 | R | 35.8 | Very low | 40.7 | Very low | 207 Ų | 207 | 138.8 Ų | 138.8 | 78% | 0.781 | 74% | 0.738 | S | S | * | * | S | Bend | trans | -94.3 | -20.4 | 179.3 | -165.4 | 174.4 | -71.4 | -177.4 | -1.1 | 113.6 | F328 | F328-R330 VanDerWaalsContact C-N 3.35Å; F328-R330 PolarHBondContact O-N 3.19Å |
| 331 | W | 33.7 | Very low | 39.4 | Very low | 183 Ų | 183 | 142.8 Ų | 142.8 | 69% | 0.693 | 75% | 0.746 | S | S | * | * | G | 310 helix | trans | -80.1 | -23.7 | -174.8 | -158.6 | 68.9 | 0 | 0 | 0 | 114 | R333 S334 | W331-R333 VanDerWaalsContact C-N 3.28Å; W331-R333 PolarHBondContact O-N 3.22Å; W331-S334 PolarHBondContact O-OG 3.08Å |
| 332 | Q | 35.1 | Very low | 38.7 | Very low | 168 Ų | 168 | 139.4 Ų | 139.4 | 79% | 0.785 | 75% | 0.749 | S | S | * | * | G | 310 helix | trans | -82.2 | -1.4 | -178.6 | -133.6 | -177.9 | -24 | 0 | 0 | 114.2 | ||
| 333 | R | 35 | Very low | 37.6 | Very low | 232 Ų | 232 | 144.2 Ų | 144.2 | 88% | 0.875 | 78% | 0.779 | S | S | * | * | G | 310 helix | trans | -108.8 | -2.3 | 179.5 | -154.5 | 179.2 | -88.5 | -172.1 | -5.5 | 113.4 | W331 | W331-R333 VanDerWaalsContact C-N 3.28Å; W331-R333 PolarHBondContact O-N 3.22Å |
| 334 | S | 36.6 | Very low | 36.9 | Very low | 85 Ų | 85 | 148.4 Ų | 148.4 | 59% | 0.594 | 78% | 0.782 | S | S | * | * | S | Bend | trans | -108.2 | 4.3 | -177.8 | 46 | 0 | 0 | 0 | 0 | 114.8 | W331 | W331-S334 PolarHBondContact O-OG 3.08Š|
| 335 | T | 37.2 | Very low | 36.1 | Very low | 96 Ų | 96 | 143.7 Ų | 143.7 | 59% | 0.589 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -117.6 | 11.7 | -178.8 | 47.3 | 0 | 0 | 0 | 0 | 114.6 | ||
| 336 | L | 42.8 | Very low | 35.5 | Very low | 174 Ų | 174 | 149.1 Ų | 149.1 | 91% | 0.911 | 79% | 0.788 | S | S | * | * | S | Bend | trans | -131.4 | 77.5 | 170.7 | -138.9 | 83.7 | 0 | 0 | 0 | 109.8 | ||
| 337 | G | 38.9 | Very low | 35 | Very low | 81 Ų | 81 | 147 Ų | 147 | 84% | 0.835 | 79% | 0.792 | S | S | * | * | trans | 167.1 | 57 | -179.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 338 | S | 37.2 | Very low | 34.6 | Very low | 123 Ų | 123 | 148.7 Ų | 148.7 | 86% | 0.86 | 80% | 0.795 | S | S | * | * | trans | -144.3 | 89.3 | 163.8 | 173.4 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 339 | S | 33.8 | Very low | 34 | Very low | 128 Ų | 128 | 151.9 Ų | 151.9 | 90% | 0.895 | 80% | 0.802 | S | S | * | * | trans | -172.4 | 128.1 | 142.2 | -162.7 | 0 | 0 | 0 | 0 | 110.1 | ||||
| 340 | G | 30.6 | Very low | 33.5 | Very low | 70 Ų | 70 | 154.4 Ų | 154.4 | 72% | 0.722 | 81% | 0.806 | S | S | * | * | trans | 95.7 | 89.5 | 152.1 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 341 | E | 32.2 | Very low | 33.3 | Very low | 190 Ų | 190 | 149.5 Ų | 149.5 | 89% | 0.888 | 80% | 0.804 | S | S | * | * | trans | 32.6 | 149.2 | 144.2 | -74.6 | -176 | 136.8 | 0 | 0 | 124.7 | ||||
| 342 | P | 38.7 | Very low | 33.2 | Very low | 120 Ų | 120 | 152.9 Ų | 152.9 | 78% | 0.779 | 82% | 0.816 | S | S | * | * | trans | -89.5 | 134.1 | -177.4 | 36.1 | -29.6 | 0 | 0 | 0 | 112 | ||||
| 343 | S | 28.1 | Very low | 33 | Very low | 128 Ų | 128 | 154 Ų | 154 | 90% | 0.895 | 82% | 0.822 | S | S | * | * | trans | -139.4 | 142.8 | 158.6 | -101.1 | 0 | 0 | 0 | 0 | 113.2 | ||||
| 344 | K | 31.5 | Very low | 33.1 | Very low | 203 Ų | 203 | 149 Ų | 149 | 88% | 0.883 | 82% | 0.819 | S | S | * | * | trans | -59.3 | 145.6 | -163 | -69 | 161.4 | 174.6 | 173.7 | 0 | 114.6 | ||||
| 345 | S | 31.2 | Very low | 33 | Very low | 94 Ų | 94 | 152.8 Ų | 152.8 | 66% | 0.657 | 83% | 0.832 | S | S | * | * | trans | 47 | 117.3 | 133.2 | -165 | 0 | 0 | 0 | 0 | 118.4 | ||||
| 346 | Y | 27.8 | Very low | 33 | Very low | 223 Ų | 223 | 153.8 Ų | 153.8 | 88% | 0.875 | 84% | 0.84 | S | S | * | * | -162.8 | 122.1 | 121.1 | -89.3 | -69.1 | 0 | 0 | 0 | 109.6 | |||||
| 347 | C | 30.1 | Very low | 32.4 | Very low | 132 Ų | 132 | 153.5 Ų | 153.5 | 89% | 0.892 | 84% | 0.84 | S | S | * | * | trans | -86.2 | 117.6 | 174.3 | -153.7 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 348 | I | 30.7 | Very low | 32.3 | Very low | 149 Ų | 149 | 156.4 Ų | 156.4 | 76% | 0.764 | 84% | 0.841 | S | S | * | * | trans | -123.4 | 113.9 | 168.3 | -63.4 | -171.5 | 0 | 0 | 0 | 109.8 | ||||
| 349 | R | 28.4 | Very low | 32.2 | Very low | 228 Ų | 228 | 155.3 Ų | 155.3 | 86% | 0.86 | 84% | 0.84 | S | S | * | * | trans | -77.7 | 119.2 | 177.8 | -173.8 | -174.9 | -85.8 | -176.3 | -7.3 | 108.2 | S351 | R349-S351 PolarHBondContact O-N 3.42Š| ||
| 350 | Y | 28.6 | Very low | 32.4 | Very low | 229 Ų | 229 | 155.6 Ų | 155.6 | 90% | 0.898 | 84% | 0.836 | S | S | * | * | trans | -79.9 | 113.3 | 172.7 | -106.6 | -89.9 | 0 | 0 | 0 | 110.1 | ||||
| 351 | S | 30.5 | Very low | 32.5 | Very low | 104 Ų | 104 | 161 Ų | 161 | 73% | 0.727 | 84% | 0.842 | S | S | * | * | trans | -88.2 | 130.9 | 169.6 | -57.1 | 0 | 0 | 0 | 0 | 110 | R349 | R349-S351 PolarHBondContact O-N 3.42Š| ||
| 352 | R | 33.4 | Very low | 32.3 | Very low | 253 Ų | 253 | 157.9 Ų | 157.9 | 96% | 0.955 | 84% | 0.836 | S | S | * | * | trans | -62.9 | 136.4 | 169.5 | -93.3 | 176.3 | 176.3 | 179 | -1.2 | 111.1 | ||||
| 353 | Q | 30.6 | Very low | 31.9 | Very low | 192 Ų | 192 | 160 Ų | 160 | 90% | 0.897 | 84% | 0.839 | S | S | * | * | trans | -123.4 | 140.5 | 154.9 | -91.1 | -180 | -27.4 | 0 | 0 | 109.2 | ||||
| 354 | P | 36.3 | Very low | 32.2 | Very low | 128 Ų | 128 | 163.4 Ų | 163.4 | 83% | 0.831 | 86% | 0.855 | S | S | * | * | P | Polyproline II helix | trans | -96.7 | 156.6 | 173.5 | 25.3 | -10.8 | 0 | 0 | 0 | 113.7 | ||
| 355 | L | 34.6 | Very low | 32.3 | Very low | 164 Ų | 164 | 161.4 Ų | 161.4 | 86% | 0.859 | 85% | 0.853 | S | S | * | * | P | Polyproline II helix | trans | -54.5 | 156 | 174.1 | -104.9 | 78.6 | 0 | 0 | 0 | 114 | ||
| 356 | P | 36.7 | Very low | 32.3 | Very low | 117 Ų | 117 | 164.9 Ų | 164.9 | 76% | 0.76 | 86% | 0.864 | S | S | * | * | P | Polyproline II helix | trans | -92.7 | 142.5 | 167 | 35.1 | -27.9 | 0 | 0 | 0 | 112.8 | ||
| 357 | D | 31.7 | Very low | 32.6 | Very low | 168 Ų | 168 | 161.7 Ų | 161.7 | 90% | 0.898 | 86% | 0.863 | S | S | * | * | P | Polyproline II helix | trans | -76.9 | 135.6 | 173.1 | -73 | -45.3 | 0 | 0 | 0 | 112 | ||
| 358 | T | 35.7 | Very low | 32.7 | Very low | 141 Ų | 141 | 163.5 Ų | 163.5 | 87% | 0.865 | 86% | 0.861 | S | S | * | * | trans | -91 | 112 | 168.7 | -10.6 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 359 | A | 35.3 | Very low | 32.9 | Very low | 101 Ų | 101 | 164.4 Ų | 164.4 | 84% | 0.835 | 87% | 0.867 | S | S | * | * | trans | -95.9 | 131.8 | 170.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||||
| 360 | V | 38.1 | Very low | 33.2 | Very low | 133 Ų | 133 | 160.1 Ų | 160.1 | 81% | 0.806 | 87% | 0.868 | S | S | * | * | trans | -114.5 | 120.2 | 171.4 | 171.7 | 0 | 0 | 0 | 0 | 107.5 | ||||
| 361 | Q | 32.3 | Very low | 33.5 | Very low | 185 Ų | 185 | 155.2 Ų | 155.2 | 86% | 0.864 | 87% | 0.866 | S | S | * | * | trans | -170.8 | 106.9 | 154 | -106.8 | 175.3 | 3.1 | 0 | 0 | 108.6 | ||||
| 362 | T | 29 | Very low | 33.7 | Very low | 123 Ų | 123 | 159.2 Ų | 159.2 | 76% | 0.755 | 88% | 0.876 | S | S | * | * | 82 | 107.2 | 93.5 | -40 | 0 | 0 | 0 | 0 | 115 | |||||
| 363 | I | 30.4 | Very low | 33.8 | Very low | 166 Ų | 166 | 151.3 Ų | 151.3 | 85% | 0.851 | 87% | 0.87 | S | S | * | * | trans | -148.8 | 115.4 | 147.6 | -54.8 | 179.8 | 0 | 0 | 0 | 102.3 | ||||
| 364 | T | 34.6 | Very low | 34.1 | Very low | 198 Ų | 198 | 147.6 Ų | 147.6 | 100% | 1.215 | 87% | 0.867 | S | S | * | * | -146.2 | 0 | 57.2 | 43 | 0 | 0 | 0 | 0 | 112.5 |
Retrieved 364 of 364 residues in 534.4 ms
(Link to these results)