| 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 | 40.2 | Very low | 48.1 | Very low | 253 Ų | 253 | 142.5 Ų | 142.5 | 100% | 1.246 | 85% | 0.852 | S | S | * | * | 0 | 117.8 | 0 | -144.5 | 160 | -179.9 | 0 | 0 | 106 | |||||
| 2 | G | 46.3 | Very low | 48.2 | Very low | 69 Ų | 69 | 147.6 Ų | 147.6 | 71% | 0.711 | 86% | 0.86 | S | S | * | * | trans | 91.7 | 74.7 | -179.2 | 0 | 0 | 0 | 0 | 0 | 114.7 | ||||
| 3 | T | 47.8 | Very low | 48.7 | Very low | 150 Ų | 150 | 143.1 Ų | 143.1 | 92% | 0.92 | 85% | 0.85 | S | S | * | * | 92.7 | 115.8 | 83.7 | 46.1 | 0 | 0 | 0 | 0 | 113.1 | |||||
| 4 | A | 48.4 | Very low | 49.2 | Very low | 91 Ų | 91 | 142.1 Ų | 142.1 | 75% | 0.752 | 85% | 0.85 | S | S | * | * | trans | -90.3 | 152.5 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 5 | D | 47.2 | Very low | 49.3 | Very low | 159 Ų | 159 | 145.4 Ų | 145.4 | 85% | 0.85 | 85% | 0.853 | S | S | * | * | trans | -158.9 | 109.8 | 150.8 | -102.4 | -24.7 | 0 | 0 | 0 | 104.8 | ||||
| 6 | S | 48.9 | Very low | 49.8 | Very low | 104 Ų | 104 | 148 Ų | 148 | 73% | 0.727 | 85% | 0.853 | S | S | * | * | 52.4 | 95.7 | 70.4 | -73 | 0 | 0 | 0 | 0 | 112.9 | |||||
| 7 | D | 50.1 | Low | 50.1 | Low | 153 Ų | 153 | 146.8 Ų | 146.8 | 82% | 0.818 | 85% | 0.849 | S | S | * | * | trans | -154.9 | 111.6 | 146.5 | -111.6 | -16.1 | 0 | 0 | 0 | 112.5 | ||||
| 8 | E | 46.4 | Very low | 50.8 | Low | 179 Ų | 179 | 147.1 Ų | 147.1 | 84% | 0.836 | 84% | 0.841 | S | S | * | * | trans | 51.5 | 103.4 | 135.9 | -140.8 | 149.3 | 124.9 | 0 | 0 | 121 | ||||
| 9 | M | 48.7 | Very low | 51.3 | Low | 196 Ų | 196 | 146.9 Ų | 146.9 | 97% | 0.966 | 84% | 0.836 | S | S | * | * | trans | -96.6 | 108.1 | 166.6 | -155.5 | 166.8 | -157.1 | 0 | 0 | 109 | ||||
| 10 | A | 52.4 | Low | 51.4 | Low | 85 Ų | 85 | 145.8 Ų | 145.8 | 70% | 0.702 | 83% | 0.827 | S | S | * | * | P | Polyproline II helix | trans | -93.7 | 144.6 | 170.3 | 0 | 0 | 0 | 0 | 0 | 110.7 | ||
| 11 | P | 52.9 | Low | 51.9 | Low | 129 Ų | 129 | 144 Ų | 144 | 84% | 0.838 | 82% | 0.819 | S | S | * | * | P | Polyproline II helix | trans | -82.5 | 134.6 | -168.1 | 32.7 | -33 | 0 | 0 | 0 | 112.8 | A13 | P11-A13 PolarHBondContact O-N 3.44Š|
| 12 | E | 49.3 | Very low | 52.5 | Low | 203 Ų | 203 | 139.9 Ų | 139.9 | 95% | 0.949 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -56.1 | 126.6 | 169.6 | -89.4 | -179.1 | 133.2 | 0 | 0 | 111.6 | ||
| 13 | A | 54.5 | Low | 52.7 | Low | 89 Ų | 89 | 143.1 Ų | 143.1 | 74% | 0.736 | 80% | 0.796 | S | S | * | * | P | Polyproline II helix | trans | -80.5 | 142.4 | 167.4 | 0 | 0 | 0 | 0 | 0 | 110.5 | P11 | P11-A13 PolarHBondContact O-N 3.44Š|
| 14 | P | 55.8 | Low | 53.1 | Low | 130 Ų | 130 | 143.4 Ų | 143.4 | 84% | 0.844 | 79% | 0.787 | S | S | * | * | P | Polyproline II helix | trans | -76.4 | 133.3 | -173 | 8.4 | 4.1 | 0 | 0 | 0 | 112.6 | ||
| 15 | Q | 50.2 | Low | 53.6 | Low | 191 Ų | 191 | 147.1 Ų | 147.1 | 89% | 0.893 | 79% | 0.788 | S | S | * | * | P | Polyproline II helix | trans | -62.9 | 135.5 | 174.9 | -84 | 178.8 | -15.7 | 0 | 0 | 112.6 | T17 | Q15-T17 PolarHBondContact O-N 3.33Š|
| 16 | H | 58.1 | Low | 54.2 | Low | 187 Ų | 187 | 144.4 Ų | 144.4 | 87% | 0.866 | 77% | 0.771 | S | S | * | * | trans | -69.6 | 112.3 | 177.6 | -152.3 | -77.2 | 0 | 0 | 0 | 110.6 | H18 | H16-H18 PolarHBondContact O-N 3.23Š| ||
| 17 | T | 55 | Low | 55.1 | Low | 127 Ų | 127 | 143.3 Ų | 143.3 | 78% | 0.779 | 76% | 0.763 | S | S | * | * | trans | -69.4 | 110.8 | 172.6 | 37.1 | 0 | 0 | 0 | 0 | 110.8 | Q15 | Q15-T17 PolarHBondContact O-N 3.33Š| ||
| 18 | H | 62.3 | Low | 56 | Low | 152 Ų | 152 | 140 Ų | 140 | 70% | 0.704 | 76% | 0.756 | S | S | * | * | trans | -83.8 | 116.1 | 171.5 | -176 | -95 | 0 | 0 | 0 | 109.6 | H16 D20 | H16-H18 PolarHBondContact O-N 3.23Å; H18-D20 IonicContact CE1-OD2 3.53Å | ||
| 19 | I | 59.9 | Low | 57 | Low | 145 Ų | 145 | 137.3 Ų | 137.3 | 74% | 0.744 | 75% | 0.747 | S | S | * | * | trans | -99.7 | 107.8 | 173.2 | -60.2 | 174.3 | 0 | 0 | 0 | 107.7 | V21 | I19-V21 HydrophobicContact CG2-CG2 4Š| ||
| 20 | D | 54.2 | Low | 57.8 | Low | 123 Ų | 123 | 130 Ų | 130 | 66% | 0.658 | 72% | 0.718 | S | S | * | * | trans | -89.7 | 107.4 | 176.8 | -140.3 | -24.1 | 0 | 0 | 0 | 109.3 | H18 | H18-D20 IonicContact CE1-OD2 3.53Š| ||
| 21 | V | 62.4 | Low | 58.7 | Low | 110 Ų | 110 | 131.3 Ų | 131.3 | 67% | 0.667 | 71% | 0.708 | S | S | * | * | trans | -94.5 | 97.6 | 178.8 | -177 | 0 | 0 | 0 | 0 | 109.2 | I19 I23 | I19-V21 HydrophobicContact CG2-CG2 4Å; V21-I23 HydrophobicContact CG1-CG1 4.24Å; V21-I23 PolarHBondContact O-N 3.17Å | ||
| 22 | H | 51.6 | Low | 59.6 | Low | 165 Ų | 165 | 130.9 Ų | 130.9 | 76% | 0.764 | 70% | 0.698 | S | S | * | * | trans | -76.8 | 96.2 | 174.5 | -117.6 | -83.8 | 0 | 0 | 0 | 110.7 | H24 | H22-H24 PolarHBondContact O-N 2.97Š| ||
| 23 | I | 51.3 | Low | 60.5 | Low | 137 Ų | 137 | 125.5 Ų | 125.5 | 70% | 0.703 | 68% | 0.675 | S | S | * | * | trans | -76.4 | 100.8 | 171.6 | -61.8 | 174.1 | 0 | 0 | 0 | 108.8 | V21 Q25 | V21-I23 HydrophobicContact CG1-CG1 4.24Å; V21-I23 PolarHBondContact O-N 3.17Å; I23-Q25 HydrophobicContact CG2-CB 4.43Å; I23-Q25 PolarHBondContact O-N 3.48Å | ||
| 24 | H | 55.2 | Low | 61.2 | Low | 157 Ų | 157 | 125.3 Ų | 125.3 | 73% | 0.727 | 66% | 0.661 | S | S | * | * | trans | -89 | 78.2 | 176 | -140.4 | 14.6 | 0 | 0 | 0 | 110.6 | H22 E26 | H22-H24 PolarHBondContact O-N 2.97Å; H24-E26 PolarHBondContact O-N 3.24Å | ||
| 25 | Q | 59.2 | Low | 61.9 | Low | 169 Ų | 169 | 123.6 Ų | 123.6 | 79% | 0.79 | 65% | 0.648 | S | S | * | * | trans | -84.5 | 86.3 | 173.5 | -171 | 173.4 | -18.8 | 0 | 0 | 109.8 | I23 S27 | I23-Q25 HydrophobicContact CG2-CB 4.43Å; I23-Q25 PolarHBondContact O-N 3.48Å; Q25-S27 PolarHBondContact O-N 3.18Å | ||
| 26 | E | 59.7 | Low | 62.6 | Low | 102 Ų | 102 | 117.5 Ų | 117.5 | 48% | 0.477 | 63% | 0.626 | S | S | . | * | trans | -71.7 | 115.7 | 173.3 | -68.4 | -172.6 | 158.3 | 0 | 0 | 110.9 | H24 K31 | H24-E26 PolarHBondContact O-N 3.24Å; E26-K31 WeakPolarHBondContact OE2-CE 3.47Å | ||
| 27 | S | 67.4 | Low | 62.9 | Low | 81 Ų | 81 | 109.5 Ų | 109.5 | 57% | 0.566 | 59% | 0.591 | S | S | * | * | trans | -55.7 | 135.9 | 175.1 | -62.7 | 0 | 0 | 0 | 0 | 111.9 | Q25 L29 A30 K31 | Q25-S27 PolarHBondContact O-N 3.18Å; S27-L29 PolarHBondContact O-N 3.17Å; S27-L29 VanDerWaalsContact O-N 3.08Å; S27-A30 WeakPolarHBondContact O-CA 3.32Å; S27-A30 VanDerWaalsContact O-CB 3.31Å; S27-A30 WeakPolarHBondContact O-CB 3.18Å; S27-A30 PolarHBondContact O-N 3.28Å; S27-K31 PolarHBondContact O-N 3.06Å; S27-K31 VanDerWaalsContact O-N 3.14Å | ||
| 28 | A | 70.7 | Confident | 63.2 | Low | 82 Ų | 82 | 106.6 Ų | 106.6 | 68% | 0.678 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -53.8 | -32.6 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | K31 L32 | A28-K31 PolarHBondContact O-N 3.25Å; A28-L32 WeakPolarHBondContact O-CB 3.49Å; A28-L32 PolarHBondContact O-N 2.86Å |
| 29 | L | 65.8 | Low | 63.1 | Low | 124 Ų | 124 | 103.4 Ų | 103.4 | 65% | 0.649 | 58% | 0.576 | S | S | * | * | H | α-helix | trans | -66.1 | -39.9 | 174.5 | -168.7 | 150.1 | 0 | 0 | 0 | 112 | S27 K31 L32 L33 | S27-L29 PolarHBondContact O-N 3.17Å; S27-L29 VanDerWaalsContact O-N 3.08Å; L29-K31 VanDerWaalsContact C-N 3.34Å; L29-L32 PolarHBondContact O-N 3.21Å; L29-L33 HydrophobicContact CD2-CD1 3.52Å; L29-L33 HydrophobicContact CD2-CG 3.96Å; L29-L33 WeakPolarHBondContact O-CB 3.16Å; L29-L33 WeakPolarHBondContact O-CG 3.26Å; L29-L33 PolarHBondContact O-N 3.33Å |
| 30 | A | 66.1 | Low | 62.8 | Low | 42 Ų | 42 | 99.9 Ų | 99.9 | 35% | 0.347 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -63.7 | -42.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 110.6 | S27 L33 L34 | S27-A30 WeakPolarHBondContact O-CA 3.32Å; S27-A30 VanDerWaalsContact O-CB 3.31Å; S27-A30 WeakPolarHBondContact O-CB 3.18Å; S27-A30 PolarHBondContact O-N 3.28Å; A30-L33 PolarHBondContact O-N 3.17Å; A30-L34 WeakPolarHBondContact O-CB 3.29Å; A30-L34 PolarHBondContact O-N 3.32Å |
| 31 | K | 70.7 | Confident | 62.4 | Low | 113 Ų | 113 | 105 Ų | 105 | 49% | 0.491 | 57% | 0.569 | S | S | . | * | H | α-helix | trans | -60.2 | -46.2 | 172.6 | -71.4 | -173.6 | 179.5 | 179.2 | 0 | 111.8 | E26 S27 A28 L29 L33 L34 T35 | E26-K31 WeakPolarHBondContact OE2-CE 3.47Å; S27-K31 PolarHBondContact O-N 3.06Å; S27-K31 VanDerWaalsContact O-N 3.14Å; A28-K31 PolarHBondContact O-N 3.25Å; L29-K31 VanDerWaalsContact C-N 3.34Å; K31-L33 PolarHBondContact O-N 3.34Å; K31-L34 CarbonylContact O-C 3.59Å; K31-L34 WeakPolarHBondContact O-CB 3.23Å; K31-L34 PolarHBondContact O-N 2.9Å; K31-L34 VanDerWaalsContact O-N 3.16Å; K31-T35 PolarHBondContact O-N 2.93Å; K31-T35 PolarHBondContact O-OG1 3.17Å |
| 32 | L | 71.7 | Confident | 61.7 | Low | 120 Ų | 120 | 103.8 Ų | 103.8 | 63% | 0.628 | 56% | 0.563 | S | S | * | * | H | α-helix | trans | -64.1 | -41.2 | -179.9 | -160.6 | 151.6 | 0 | 0 | 0 | 112 | A28 L29 T35 C36 | A28-L32 WeakPolarHBondContact O-CB 3.49Å; A28-L32 PolarHBondContact O-N 2.86Å; L29-L32 PolarHBondContact O-N 3.21Å; L32-T35 PolarHBondContact O-N 3.33Å; L32-C36 WeakPolarHBondContact O-CB 3.45Å; L32-C36 PolarHBondContact O-N 3.15Å |
| 33 | L | 69.4 | Low | 61.5 | Low | 90 Ų | 90 | 107.7 Ų | 107.7 | 47% | 0.471 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -61.5 | -44.7 | 171.5 | -72.9 | 178.3 | 0 | 0 | 0 | 111.3 | L29 A30 K31 C36 C37 | L29-L33 HydrophobicContact CD2-CD1 3.52Å; L29-L33 HydrophobicContact CD2-CG 3.96Å; L29-L33 WeakPolarHBondContact O-CB 3.16Å; L29-L33 WeakPolarHBondContact O-CG 3.26Å; L29-L33 PolarHBondContact O-N 3.33Å; A30-L33 PolarHBondContact O-N 3.17Å; K31-L33 PolarHBondContact O-N 3.34Å; L33-C36 PolarHBondContact O-N 3.14Å; L33-C37 VanDerWaalsContact O-CB 3.24Å; L33-C37 WeakPolarHBondContact O-CB 3.43Å; L33-C37 PolarHBondContact O-N 2.85Å; L33-C37 PolarHBondContact O-SG 3.08Å |
| 34 | L | 68.4 | Low | 61.2 | Low | 84 Ų | 84 | 105.8 Ų | 105.8 | 44% | 0.44 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -61.6 | -43.8 | 175.8 | -110.3 | 122.3 | 0 | 0 | 0 | 112.1 | A30 K31 C37 S38 F218 | A30-L34 WeakPolarHBondContact O-CB 3.29Å; A30-L34 PolarHBondContact O-N 3.32Å; K31-L34 CarbonylContact O-C 3.59Å; K31-L34 WeakPolarHBondContact O-CB 3.23Å; K31-L34 PolarHBondContact O-N 2.9Å; K31-L34 VanDerWaalsContact O-N 3.16Å; L34-C37 PolarHBondContact O-N 3.46Å; L34-S38 WeakPolarHBondContact O-CB 3.43Å; L34-S38 PolarHBondContact O-N 2.91Å; L34-F218 HydrophobicContact CD2-CE1 4.32Å; L34-F218 HydrophobicContact CD2-CZ 3.94Å; L34-F218 HydrophobicContact CG-CZ 4.26Å |
| 35 | T | 70.5 | Confident | 60.5 | Low | 94 Ų | 94 | 104.3 Ų | 104.3 | 58% | 0.577 | 58% | 0.578 | S | S | * | * | H | α-helix | trans | -62.6 | -48.4 | 177.3 | -54 | 0 | 0 | 0 | 0 | 110.6 | K31 L32 C37 S38 A39 | K31-T35 PolarHBondContact O-N 2.93Å; K31-T35 PolarHBondContact O-OG1 3.17Å; L32-T35 PolarHBondContact O-N 3.33Å; T35-C37 VanDerWaalsContact C-N 3.33Å; T35-C37 PolarHBondContact O-N 3.16Å; T35-S38 PolarHBondContact O-N 3.47Å; T35-S38 PolarHBondContact O-OG 3.16Å; T35-A39 PolarHBondContact O-N 3.4Å; T35-A39 VanDerWaalsContact O-N 3.17Å |
| 36 | C | 65 | Low | 60.1 | Low | 64 Ų | 64 | 103.6 Ų | 103.6 | 43% | 0.432 | 57% | 0.574 | S | S | . | * | H | α-helix | trans | -58.5 | -47.4 | 176.1 | -171.7 | 0 | 0 | 0 | 0 | 110.7 | L32 L33 S38 A39 L40 | L32-C36 WeakPolarHBondContact O-CB 3.45Å; L32-C36 PolarHBondContact O-N 3.15Å; L33-C36 PolarHBondContact O-N 3.14Å; C36-S38 VanDerWaalsContact C-N 3.28Å; C36-S38 PolarHBondContact O-N 2.79Å; C36-A39 WeakPolarHBondContact O-CB 3.44Å; C36-A39 PolarHBondContact O-N 3.36Å; C36-A39 VanDerWaalsContact O-N 3.1Å; C36-L40 WeakPolarHBondContact O-CD1 3.43Å; C36-L40 PolarHBondContact O-N 2.88Å |
| 37 | C | 64.7 | Low | 59.8 | Low | 19 Ų | 19 | 103.1 Ų | 103.1 | 13% | 0.128 | 59% | 0.588 | C | S | . | * | H | α-helix | trans | -67.6 | -25.8 | -179.8 | -67.8 | 0 | 0 | 0 | 0 | 114.1 | L33 L34 T35 C214 F218 | L33-C37 VanDerWaalsContact O-CB 3.24Å; L33-C37 WeakPolarHBondContact O-CB 3.43Å; L33-C37 PolarHBondContact O-N 2.85Å; L33-C37 PolarHBondContact O-SG 3.08Å; L34-C37 PolarHBondContact O-N 3.46Å; T35-C37 VanDerWaalsContact C-N 3.33Å; T35-C37 PolarHBondContact O-N 3.16Å; C37-C214 HydrophobicContact CB-CB 3.45Å; C37-C214 VanDerWaalsContact CB-CB 3.45Å; C37-C214 WeakPolarHBondContact CB-SG 3.16Å; C37-C214 WeakPolarHBondContact SG-CB 3.31Å; C37-C214 CovalentContact SG-SG 2.01Å; C37-C214 PolarHBondContact SG-SG 3.44Å; C37-F218 HydrophobicContact CB-CD2 4.19Å; C37-F218 HydrophobicContact CB-CE2 3.39Å; C37-F218 HydrophobicContact CB-CZ 4.11Å |
| 38 | S | 60.6 | Low | 59.1 | Low | 65 Ų | 65 | 109.8 Ų | 109.8 | 46% | 0.455 | 60% | 0.6 | S | S | . | * | H | α-helix | trans | -72.4 | -31.2 | 171.6 | 73.7 | 0 | 0 | 0 | 0 | 113.5 | L34 T35 C36 L40 | L34-S38 WeakPolarHBondContact O-CB 3.43Å; L34-S38 PolarHBondContact O-N 2.91Å; T35-S38 PolarHBondContact O-N 3.47Å; T35-S38 PolarHBondContact O-OG 3.16Å; C36-S38 VanDerWaalsContact C-N 3.28Å; C36-S38 PolarHBondContact O-N 2.79Å; S38-L40 VanDerWaalsContact C-N 3.35Å |
| 39 | A | 59.7 | Low | 58.6 | Low | 86 Ų | 86 | 106.4 Ų | 106.4 | 71% | 0.711 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -73.5 | -26.3 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | T35 C36 R41 | T35-A39 PolarHBondContact O-N 3.4Å; T35-A39 VanDerWaalsContact O-N 3.17Å; C36-A39 WeakPolarHBondContact O-CB 3.44Å; C36-A39 PolarHBondContact O-N 3.36Å; C36-A39 VanDerWaalsContact O-N 3.1Å; A39-R41 VanDerWaalsContact C-N 3.28Å; A39-R41 PolarHBondContact O-N 3.02Å |
| 40 | L | 55.7 | Low | 58.7 | Low | 70 Ų | 70 | 101 Ų | 101 | 37% | 0.366 | 55% | 0.547 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -83.8 | 17.3 | -174.6 | -90.3 | 132.9 | 0 | 0 | 0 | 114.8 | C36 S38 P42 | C36-L40 WeakPolarHBondContact O-CD1 3.43Å; C36-L40 PolarHBondContact O-N 2.88Å; S38-L40 VanDerWaalsContact C-N 3.35Å; L40-P42 WeakPolarHBondContact O-CD 3.42Å; L40-P42 WeakPolarHBondContact O-CG 3.41Å |
| 41 | R | 44.3 | Very low | 59.1 | Low | 232 Ų | 232 | 101.9 Ų | 101.9 | 88% | 0.875 | 55% | 0.55 | S | S | * | * | trans | -61.6 | 109 | -169.3 | -171 | 178 | -166.5 | 166.5 | 2.8 | 114.5 | A39 | A39-R41 VanDerWaalsContact C-N 3.28Å; A39-R41 PolarHBondContact O-N 3.02Å | ||
| 42 | P | 48.7 | Very low | 59.6 | Low | 83 Ų | 83 | 106 Ų | 106 | 54% | 0.539 | 56% | 0.563 | S | S | . | * | trans | -113 | 163.2 | 171.4 | 13.9 | 12.4 | 0 | 0 | 0 | 111.7 | L40 | L40-P42 WeakPolarHBondContact O-CD 3.42Å; L40-P42 WeakPolarHBondContact O-CG 3.41Å | ||
| 43 | R | 47.2 | Very low | 59.9 | Low | 248 Ų | 248 | 104.2 Ų | 104.2 | 94% | 0.936 | 55% | 0.553 | S | S | * | * | trans | -66.6 | 128.7 | -172.8 | -164.1 | 169.8 | -176.2 | 160 | -0.7 | 112.2 | T45 | R43-T45 PolarHBondContact O-N 2.86Š| ||
| 44 | A | 44.6 | Very low | 60.4 | Low | 97 Ų | 97 | 101.4 Ų | 101.4 | 80% | 0.802 | 54% | 0.538 | S | S | * | . | trans | -72.1 | 112 | -169.8 | 0 | 0 | 0 | 0 | 0 | 114.4 | ||||
| 45 | T | 40.5 | Very low | 61.3 | Low | 126 Ų | 126 | 100.2 Ų | 100.2 | 77% | 0.773 | 53% | 0.534 | S | S | * | . | trans | -148.5 | 138.8 | 157.6 | 44 | 0 | 0 | 0 | 0 | 109.8 | R43 | R43-T45 PolarHBondContact O-N 2.86Š| ||
| 46 | Q | 50 | Low | 62.1 | Low | 154 Ų | 154 | 98 Ų | 98 | 72% | 0.72 | 53% | 0.526 | S | S | * | . | trans | 95.2 | 88.9 | 162.8 | -63.4 | 177 | -29.7 | 0 | 0 | 120.4 | R48 | Q46-R48 VanDerWaalsContact C-N 3.32Š| ||
| 47 | A | 54 | Low | 63.1 | Low | 92 Ų | 92 | 95.4 Ų | 95.4 | 76% | 0.76 | 51% | 0.508 | S | S | * | . | H | α-helix | trans | -63.1 | -36.6 | 153.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | G49 S50 | A47-G49 VanDerWaalsContact C-N 3.34Å; A47-G49 PolarHBondContact O-N 3.28Å; A47-S50 PolarHBondContact O-N 3.17Å; A47-S50 PolarHBondContact O-OG 3.43Å |
| 48 | R | 53.2 | Low | 64.3 | Low | 220 Ų | 220 | 96.6 Ų | 96.6 | 83% | 0.83 | 51% | 0.51 | S | S | * | . | H | α-helix | trans | -70.4 | -23.3 | -178.9 | -166.7 | 170.5 | -174.7 | 161.3 | 1.2 | 114.3 | Q46 | Q46-R48 VanDerWaalsContact C-N 3.32Å |
| 49 | G | 60 | Low | 65.9 | Low | 11 Ų | 11 | 96.1 Ų | 96.1 | 11% | 0.113 | 50% | 0.504 | C | S | . | . | H | α-helix | trans | -74.2 | -29.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | A47 S51 R52 L53 | A47-G49 VanDerWaalsContact C-N 3.34Å; A47-G49 PolarHBondContact O-N 3.28Å; G49-S51 PolarHBondContact O-N 2.67Å; G49-R52 PolarHBondContact O-N 2.89Å; G49-L53 VanDerWaalsContact O-CG 3.29Å; G49-L53 WeakPolarHBondContact O-CG 3.36Å; G49-L53 PolarHBondContact O-N 3.38Å |
| 50 | S | 68.8 | Low | 67.4 | Low | 12 Ų | 12 | 96.1 Ų | 96.1 | 8% | 0.084 | 49% | 0.491 | C | S | . | . | H | α-helix | trans | -66.5 | -38.4 | -172.1 | 67.3 | 0 | 0 | 0 | 0 | 114.3 | A47 L53 L54 R216 | A47-S50 PolarHBondContact O-N 3.17Å; A47-S50 PolarHBondContact O-OG 3.43Å; S50-L53 PolarHBondContact O-N 3.1Å; S50-L54 VanDerWaalsContact O-CG 3.28Å; S50-L54 WeakPolarHBondContact O-CG 3.46Å; S50-L54 PolarHBondContact O-N 3.15Å; S50-R216 PolarHBondContact OG-NH2 3.45Å |
| 51 | S | 73.1 | Confident | 69.1 | Low | 60 Ų | 60 | 93 Ų | 93 | 42% | 0.42 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -67.9 | -41.7 | 176.3 | 58.8 | 0 | 0 | 0 | 0 | 111.5 | G49 L53 L54 V55 | G49-S51 PolarHBondContact O-N 2.67Å; S51-L53 VanDerWaalsContact C-N 3.33Å; S51-L53 PolarHBondContact O-N 3.43Å; S51-L54 PolarHBondContact O-N 2.01Å; S51-V55 WeakPolarHBondContact O-CG2 3Å; S51-V55 PolarHBondContact O-N 3.21Å |
| 52 | R | 80.6 | Confident | 71.5 | Confident | 200 Ų | 200 | 84 Ų | 84 | 76% | 0.755 | 44% | 0.443 | S | S | * | . | H | α-helix | trans | -62.4 | -40.5 | 175.4 | -67.6 | -177.1 | 68 | -168.6 | 0.9 | 111.9 | G49 V55 A56 | G49-R52 PolarHBondContact O-N 2.89Å; R52-V55 PolarHBondContact O-N 3.3Å; R52-A56 WeakPolarHBondContact O-CB 2.99Å; R52-A56 PolarHBondContact O-N 2.87Å |
| 53 | L | 78.5 | Confident | 73.8 | Confident | 82 Ų | 82 | 83.2 Ų | 83.2 | 43% | 0.429 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -67 | -39.7 | 176.8 | -72.1 | 169 | 0 | 0 | 0 | 112.1 | G49 S50 S51 V55 A56 S57 L212 | G49-L53 VanDerWaalsContact O-CG 3.29Å; G49-L53 WeakPolarHBondContact O-CG 3.36Å; G49-L53 PolarHBondContact O-N 3.38Å; S50-L53 PolarHBondContact O-N 3.1Å; S51-L53 VanDerWaalsContact C-N 3.33Å; S51-L53 PolarHBondContact O-N 3.43Å; L53-V55 VanDerWaalsContact C-N 3.32Å; L53-A56 PolarHBondContact O-N 2.89Å; L53-S57 VanDerWaalsContact O-CB 3.27Å; L53-S57 WeakPolarHBondContact O-CB 3.48Å; L53-S57 PolarHBondContact O-N 3.42Å; L53-L212 HydrophobicContact CB-CD1 4.04Å; L53-L212 HydrophobicContact CD1-CD2 3.98Å |
| 54 | L | 81.5 | Confident | 76.1 | Confident | 31 Ų | 31 | 71.8 Ų | 71.8 | 16% | 0.162 | 39% | 0.394 | C | S | . | . | H | α-helix | trans | -63.1 | -41.1 | 173.3 | -73.1 | 165.3 | 0 | 0 | 0 | 111.4 | S50 S51 S57 W58 P209 L212 | S50-L54 VanDerWaalsContact O-CG 3.28Å; S50-L54 WeakPolarHBondContact O-CG 3.46Å; S50-L54 PolarHBondContact O-N 3.15Å; S51-L54 PolarHBondContact O-N 2.01Å; L54-S57 PolarHBondContact O-N 3.1Å; L54-W58 PolarHBondContact O-N 2.83Å; L54-P209 HydrophobicContact CD2-CB 4.31Å; L54-P209 HydrophobicContact CD2-CG 4.49Å; L54-L212 HydrophobicContact CD2-CD1 3.77Å; L54-L212 HydrophobicContact CG-CD1 3.75Å |
| 55 | V | 85.9 | Confident | 78.5 | Confident | 58 Ų | 58 | 67.2 Ų | 67.2 | 35% | 0.352 | 36% | 0.356 | S | S | . | . | H | α-helix | trans | -64.5 | -49.1 | 176.3 | 172.1 | 0 | 0 | 0 | 0 | 111.3 | S51 R52 L53 S57 W58 V59 | S51-V55 WeakPolarHBondContact O-CG2 3Å; S51-V55 PolarHBondContact O-N 3.21Å; R52-V55 PolarHBondContact O-N 3.3Å; L53-V55 VanDerWaalsContact C-N 3.32Å; V55-S57 VanDerWaalsContact C-N 3.26Å; V55-S57 PolarHBondContact O-N 3Å; V55-W58 VanDerWaalsContact CA-NE1 3.35Å; V55-W58 HydrophobicContact CG1-CZ2 3.96Å; V55-W58 PolarHBondContact O-N 2.94Å; V55-W58 PolarHBondContact O-NE1 2.86Å; V55-V59 WeakPolarHBondContact O-CG2 3.41Å; V55-V59 PolarHBondContact O-N 3.32Å |
| 56 | A | 87.8 | Confident | 81.1 | Confident | 49 Ų | 49 | 65.4 Ų | 65.4 | 41% | 0.405 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -57.9 | -40.9 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | R52 L53 W58 V59 M60 | R52-A56 WeakPolarHBondContact O-CB 2.99Å; R52-A56 PolarHBondContact O-N 2.87Å; L53-A56 PolarHBondContact O-N 2.89Å; A56-W58 PolarHBondContact O-N 3.39Å; A56-V59 PolarHBondContact O-N 3.05Å; A56-M60 WeakPolarHBondContact O-CB 3.32Å; A56-M60 WeakPolarHBondContact O-CG 3.44Å; A56-M60 PolarHBondContact O-N 3.16Å |
| 57 | S | 86.6 | Confident | 83.2 | Confident | 8 Ų | 8 | 61.7 Ų | 61.7 | 6% | 0.056 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -59 | -49.4 | -178.9 | 169.5 | 0 | 0 | 0 | 0 | 112.4 | L53 L54 V55 M60 Q61 A205 | L53-S57 VanDerWaalsContact O-CB 3.27Å; L53-S57 WeakPolarHBondContact O-CB 3.48Å; L53-S57 PolarHBondContact O-N 3.42Å; L54-S57 PolarHBondContact O-N 3.1Å; V55-S57 VanDerWaalsContact C-N 3.26Å; V55-S57 PolarHBondContact O-N 3Å; S57-M60 PolarHBondContact O-N 3.18Å; S57-Q61 WeakPolarHBondContact O-CG 3.33Å; S57-Q61 PolarHBondContact O-N 2.89Å; S57-A205 PolarHBondContact OG-O 2.86Å; S57-A205 VanDerWaalsContact OG-O 3.06Å |
| 58 | W | 89.6 | Confident | 85.1 | Confident | 44 Ų | 44 | 57.3 Ų | 57.3 | 17% | 0.167 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -72.1 | -33.4 | -179.6 | 68 | -107.7 | 0 | 0 | 0 | 112.6 | L54 V55 A56 M60 Q61 I62 A103 F104 | L54-W58 PolarHBondContact O-N 2.83Å; V55-W58 VanDerWaalsContact CA-NE1 3.35Å; V55-W58 HydrophobicContact CG1-CZ2 3.96Å; V55-W58 PolarHBondContact O-N 2.94Å; V55-W58 PolarHBondContact O-NE1 2.86Å; A56-W58 PolarHBondContact O-N 3.39Å; W58-M60 VanDerWaalsContact C-N 3.31Å; W58-M60 PolarHBondContact O-N 3.46Å; W58-Q61 WeakPolarHBondContact O-CB 3.07Å; W58-Q61 PolarHBondContact O-N 3.04Å; W58-I62 HydrophobicContact CE3-CD1 3.73Å; W58-I62 HydrophobicContact CZ3-CD1 3.9Å; W58-I62 WeakPolarHBondContact O-CG1 2.98Å; W58-I62 PolarHBondContact O-N 3.22Å; W58-I62 VanDerWaalsContact O-N 3.09Å; W58-A103 HydrophobicContact CB-CB 3.64Å; W58-A103 HydrophobicContact CG-CB 4.25Å; W58-F104 HydrophobicContact CD2-CB 4.32Å; W58-F104 HydrophobicContact CE3-CB 4.15Å; W58-F104 AromaticContact CH2-CD2 3.68Å; W58-F104 HydrophobicContact CH2-CD2 3.68Å; W58-F104 HydrophobicContact CH2-CE2 4.37Å; W58-F104 HydrophobicContact CH2-CG 4.47Å; W58-F104 AromaticContact CZ2-CD2 3.84Å; W58-F104 HydrophobicContact CZ2-CD2 3.84Å; W58-F104 HydrophobicContact CZ3-CB 4.26Å; W58-F104 HydrophobicContact CZ3-CD2 4.14Å |
| 59 | V | 92.8 | Very high | 86.9 | Confident | 56 Ų | 56 | 49 Ų | 49 | 34% | 0.339 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -60.5 | -46 | 172.3 | 173.1 | 0 | 0 | 0 | 0 | 109.8 | V55 A56 Q61 I62 V63 | V55-V59 WeakPolarHBondContact O-CG2 3.41Å; V55-V59 PolarHBondContact O-N 3.32Å; A56-V59 PolarHBondContact O-N 3.05Å; V59-Q61 VanDerWaalsContact C-N 3.34Å; V59-Q61 PolarHBondContact O-N 3.33Å; V59-I62 PolarHBondContact O-N 3.45Å; V59-V63 HydrophobicContact CG1-CG2 4.33Å; V59-V63 WeakPolarHBondContact O-CG2 3.24Å; V59-V63 PolarHBondContact O-N 2.84Å |
| 60 | M | 92.6 | Very high | 88.5 | Confident | 85 Ų | 85 | 52 Ų | 52 | 42% | 0.419 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -62.4 | -40.2 | 176.8 | -69.3 | -57.7 | -68.4 | 0 | 0 | 111.6 | A56 S57 W58 I62 V63 L64 | A56-M60 WeakPolarHBondContact O-CB 3.32Å; A56-M60 WeakPolarHBondContact O-CG 3.44Å; A56-M60 PolarHBondContact O-N 3.16Å; S57-M60 PolarHBondContact O-N 3.18Å; W58-M60 VanDerWaalsContact C-N 3.31Å; W58-M60 PolarHBondContact O-N 3.46Å; M60-I62 VanDerWaalsContact C-N 3.34Å; M60-I62 PolarHBondContact O-N 3.24Å; M60-V63 PolarHBondContact O-N 3.41Å; M60-L64 HydrophobicContact CB-CD1 4.28Å; M60-L64 HydrophobicContact CE-CD1 4.21Å; M60-L64 HydrophobicContact CE-CG 4.34Å; M60-L64 WeakPolarHBondContact O-CB 3.19Å; M60-L64 WeakPolarHBondContact O-CD1 3.3Å; M60-L64 WeakPolarHBondContact O-CG 3.38Å; M60-L64 PolarHBondContact O-N 3.39Å |
| 61 | Q | 91.9 | Very high | 89.5 | Confident | 5 Ų | 5 | 52.3 Ų | 52.3 | 2% | 0.023 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -58.4 | -43.5 | 174.8 | -75.6 | 176.9 | -20.5 | 0 | 0 | 112.4 | S57 W58 V59 G65 A205 | S57-Q61 WeakPolarHBondContact O-CG 3.33Å; S57-Q61 PolarHBondContact O-N 2.89Å; W58-Q61 WeakPolarHBondContact O-CB 3.07Å; W58-Q61 PolarHBondContact O-N 3.04Å; V59-Q61 VanDerWaalsContact C-N 3.34Å; V59-Q61 PolarHBondContact O-N 3.33Å; Q61-G65 PolarHBondContact O-N 3.35Å; Q61-A205 HydrophobicContact CG-CB 4.12Å |
| 62 | I | 94.1 | Very high | 90.2 | Very high | 43 Ų | 43 | 49.6 Ų | 49.6 | 22% | 0.221 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -66.1 | -52.3 | 178 | -63.2 | 174.2 | 0 | 0 | 0 | 110.6 | W58 V59 M60 L64 G65 I66 | W58-I62 HydrophobicContact CE3-CD1 3.73Å; W58-I62 HydrophobicContact CZ3-CD1 3.9Å; W58-I62 WeakPolarHBondContact O-CG1 2.98Å; W58-I62 PolarHBondContact O-N 3.22Å; W58-I62 VanDerWaalsContact O-N 3.09Å; V59-I62 PolarHBondContact O-N 3.45Å; M60-I62 VanDerWaalsContact C-N 3.34Å; M60-I62 PolarHBondContact O-N 3.24Å; I62-L64 PolarHBondContact O-N 3.31Å; I62-G65 PolarHBondContact O-N 2.88Å; I62-I66 HydrophobicContact CG2-CD1 3.92Å; I62-I66 WeakPolarHBondContact O-CG1 3.4Å; I62-I66 PolarHBondContact O-N 3.38Å |
| 63 | V | 96.1 | Very high | 90.5 | Very high | 67 Ų | 67 | 41.8 Ų | 41.8 | 41% | 0.406 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -62.1 | -47.4 | -176.5 | 173.2 | 0 | 0 | 0 | 0 | 110.9 | V59 M60 G65 I66 L67 | V59-V63 HydrophobicContact CG1-CG2 4.33Å; V59-V63 WeakPolarHBondContact O-CG2 3.24Å; V59-V63 PolarHBondContact O-N 2.84Å; M60-V63 PolarHBondContact O-N 3.41Å; V63-G65 VanDerWaalsContact C-N 3.3Å; V63-G65 PolarHBondContact O-N 3.43Å; V63-I66 PolarHBondContact O-N 3.49Å; V63-L67 HydrophobicContact CG1-CD1 4.11Å; V63-L67 WeakPolarHBondContact O-CG 3.4Å; V63-L67 PolarHBondContact O-N 2.79Å |
| 64 | L | 95.4 | Very high | 90.8 | Very high | 8 Ų | 8 | 42.7 Ų | 42.7 | 4% | 0.042 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -65.9 | -34.6 | 177.5 | -66.6 | 169.6 | 0 | 0 | 0 | 111.7 | M60 I62 L67 S68 V198 L201 L202 | M60-L64 HydrophobicContact CB-CD1 4.28Å; M60-L64 HydrophobicContact CE-CD1 4.21Å; M60-L64 HydrophobicContact CE-CG 4.34Å; M60-L64 WeakPolarHBondContact O-CB 3.19Å; M60-L64 WeakPolarHBondContact O-CD1 3.3Å; M60-L64 WeakPolarHBondContact O-CG 3.38Å; M60-L64 PolarHBondContact O-N 3.39Å; I62-L64 PolarHBondContact O-N 3.31Å; L64-L67 PolarHBondContact O-N 2.88Å; L64-S68 WeakPolarHBondContact O-CB 2.89Å; L64-S68 PolarHBondContact O-N 2.92Å; L64-V198 HydrophobicContact CB-CG1 4.05Å; L64-V198 HydrophobicContact CD2-CG1 4.13Å; L64-V198 VanDerWaalsContact O-CG1 3.25Å; L64-V198 WeakPolarHBondContact O-CG1 3.34Å; L64-L201 HydrophobicContact CD1-CB 3.63Å; L64-L201 HydrophobicContact CD2-CB 4.03Å; L64-L201 HydrophobicContact CD2-CD1 4.01Å; L64-L202 HydrophobicContact CB-CD1 4.46Å; L64-L202 HydrophobicContact CB-CD2 3.51Å; L64-L202 HydrophobicContact CB-CG 3.77Å; L64-L202 HydrophobicContact CD1-CD2 4.13Å; L64-L202 HydrophobicContact CD1-CG 4.26Å; L64-L202 HydrophobicContact CG-CD2 4.49Å |
| 65 | G | 94.9 | Very high | 90.9 | Very high | 0 Ų | 0 | 41.4 Ų | 41.4 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -63.8 | -43.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.7 | Q61 I62 V63 S68 A69 G93 | Q61-G65 PolarHBondContact O-N 3.35Å; I62-G65 PolarHBondContact O-N 2.88Å; V63-G65 VanDerWaalsContact C-N 3.3Å; V63-G65 PolarHBondContact O-N 3.43Å; G65-S68 WeakPolarHBondContact O-CB 3.16Å; G65-S68 PolarHBondContact O-N 3.35Å; G65-A69 PolarHBondContact O-N 3.04Å; G65-G93 VanDerWaalsContact O-CA 3.28Å; G65-G93 WeakPolarHBondContact O-CA 3.44Å |
| 66 | I | 95.6 | Very high | 90.5 | Very high | 88 Ų | 88 | 44.4 Ų | 44.4 | 45% | 0.451 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -63.2 | -46.7 | 173.7 | -65.6 | 166.5 | 0 | 0 | 0 | 110.4 | I62 V63 S68 A69 V70 V97 | I62-I66 HydrophobicContact CG2-CD1 3.92Å; I62-I66 WeakPolarHBondContact O-CG1 3.4Å; I62-I66 PolarHBondContact O-N 3.38Å; V63-I66 PolarHBondContact O-N 3.49Å; I66-S68 VanDerWaalsContact C-N 3.29Å; I66-S68 PolarHBondContact O-N 3.42Å; I66-A69 PolarHBondContact O-N 3.33Å; I66-A69 VanDerWaalsContact O-N 3.16Å; I66-V70 HydrophobicContact CG2-CG2 4.2Å; I66-V70 WeakPolarHBondContact O-CG2 3.41Å; I66-V70 PolarHBondContact O-N 3.33Å; I66-V97 HydrophobicContact CG1-CG2 4.11Å |
| 67 | L | 94.9 | Very high | 89.9 | Confident | 77 Ų | 77 | 48.3 Ų | 48.3 | 40% | 0.403 | 26% | 0.26 | S | S | . | . | H | α-helix | trans | -60.1 | -39.8 | 177.1 | -72.3 | 172.4 | 0 | 0 | 0 | 111.9 | V63 L64 V70 L71 V198 | V63-L67 HydrophobicContact CG1-CD1 4.11Å; V63-L67 WeakPolarHBondContact O-CG 3.4Å; V63-L67 PolarHBondContact O-N 2.79Å; L64-L67 PolarHBondContact O-N 2.88Å; L67-V70 PolarHBondContact O-N 3.41Å; L67-L71 VanDerWaalsContact O-CB 3.26Å; L67-L71 WeakPolarHBondContact O-CB 3.42Å; L67-L71 VanDerWaalsContact O-CG 3.22Å; L67-L71 WeakPolarHBondContact O-CG 3.42Å; L67-L71 PolarHBondContact O-N 2.96Å; L67-V198 HydrophobicContact CB-CG2 4.29Å |
| 68 | S | 93.4 | Very high | 89.1 | Confident | 0 Ų | 0 | 49.4 Ų | 49.4 | 0% | 0 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -59.3 | -47.6 | 174.1 | -175.3 | 0 | 0 | 0 | 0 | 111.1 | L64 G65 I66 G72 A89 T92 W199 | L64-S68 WeakPolarHBondContact O-CB 2.89Å; L64-S68 PolarHBondContact O-N 2.92Å; G65-S68 WeakPolarHBondContact O-CB 3.16Å; G65-S68 PolarHBondContact O-N 3.35Å; I66-S68 VanDerWaalsContact C-N 3.29Å; I66-S68 PolarHBondContact O-N 3.42Å; S68-G72 WeakPolarHBondContact O-CA 3.42Å; S68-G72 PolarHBondContact O-N 3.1Å; S68-A89 PolarHBondContact OG-O 2.84Å; S68-T92 PolarHBondContact OG-OG1 2.95Å; S68-W199 PolarHBondContact OG-NE1 2.93Å |
| 69 | A | 91.2 | Very high | 87.9 | Confident | 44 Ų | 44 | 53.7 Ų | 53.7 | 36% | 0.364 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -64.5 | -43.1 | 178.5 | 0 | 0 | 0 | 0 | 0 | 112.6 | G65 I66 G72 G73 | G65-A69 PolarHBondContact O-N 3.04Å; I66-A69 PolarHBondContact O-N 3.33Å; I66-A69 VanDerWaalsContact O-N 3.16Å; A69-G72 PolarHBondContact O-N 3.05Å; A69-G73 PolarHBondContact O-N 3.37Å |
| 70 | V | 92.5 | Very high | 86.3 | Confident | 75 Ų | 75 | 60 Ų | 60 | 46% | 0.455 | 31% | 0.308 | S | S | . | . | H | α-helix | trans | -64.8 | -50.8 | 179 | 170 | 0 | 0 | 0 | 0 | 111.1 | I66 L67 G72 G73 F74 | I66-V70 HydrophobicContact CG2-CG2 4.2Å; I66-V70 WeakPolarHBondContact O-CG2 3.41Å; I66-V70 PolarHBondContact O-N 3.33Å; L67-V70 PolarHBondContact O-N 3.41Å; V70-G72 VanDerWaalsContact C-N 3.28Å; V70-G72 PolarHBondContact O-N 2.69Å; V70-G73 PolarHBondContact O-N 2.89Å; V70-G73 VanDerWaalsContact O-N 3.12Å; V70-F74 HydrophobicContact CG1-CD2 4.13Å; V70-F74 HydrophobicContact CG1-CE2 3.66Å; V70-F74 WeakPolarHBondContact O-CD2 3.46Å; V70-F74 PolarHBondContact O-N 2.89Å; V70-F74 VanDerWaalsContact O-N 3.13Å |
| 71 | L | 90.5 | Very high | 84.8 | Confident | 19 Ų | 19 | 56.1 Ų | 56.1 | 10% | 0.099 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -60.7 | -41.2 | 176.1 | -69.7 | 172.1 | 0 | 0 | 0 | 110.9 | L67 G73 F74 F75 L191 M194 L195 V198 | L67-L71 VanDerWaalsContact O-CB 3.26Å; L67-L71 WeakPolarHBondContact O-CB 3.42Å; L67-L71 VanDerWaalsContact O-CG 3.22Å; L67-L71 WeakPolarHBondContact O-CG 3.42Å; L67-L71 PolarHBondContact O-N 2.96Å; L71-G73 VanDerWaalsContact C-N 3.34Å; L71-G73 PolarHBondContact O-N 3.43Å; L71-F74 PolarHBondContact O-N 3.39Å; L71-F75 WeakPolarHBondContact O-CD2 3.32Å; L71-F75 PolarHBondContact O-N 2.87Å; L71-L191 HydrophobicContact CD2-CD2 3.66Å; L71-M194 HydrophobicContact CD1-CB 4.13Å; L71-L195 HydrophobicContact CB-CD1 4.11Å; L71-L195 HydrophobicContact CD1-CB 4.34Å; L71-L195 HydrophobicContact CD1-CD1 4.38Å; L71-V198 HydrophobicContact CD1-CG2 3.97Å |
| 72 | G | 87.9 | Confident | 83.4 | Confident | 3 Ų | 3 | 59.5 Ų | 59.5 | 3% | 0.031 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -56.3 | -45.1 | 171.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | S68 A69 V70 F74 F75 Y76 | S68-G72 WeakPolarHBondContact O-CA 3.42Å; S68-G72 PolarHBondContact O-N 3.1Å; A69-G72 PolarHBondContact O-N 3.05Å; V70-G72 VanDerWaalsContact C-N 3.28Å; V70-G72 PolarHBondContact O-N 2.69Å; G72-F74 VanDerWaalsContact C-N 3.33Å; G72-F74 PolarHBondContact O-N 2.9Å; G72-F75 WeakPolarHBondContact O-CB 3.42Å; G72-F75 PolarHBondContact O-N 2.88Å; G72-Y76 WeakPolarHBondContact O-CD2 3.45Å |
| 73 | G | 87 | Confident | 81.9 | Confident | 36 Ų | 36 | 57.8 Ų | 57.8 | 37% | 0.371 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -58.6 | -41.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | A69 V70 L71 F75 Y76 | A69-G73 PolarHBondContact O-N 3.37Å; V70-G73 PolarHBondContact O-N 2.89Å; V70-G73 VanDerWaalsContact O-N 3.12Å; L71-G73 VanDerWaalsContact C-N 3.34Å; L71-G73 PolarHBondContact O-N 3.43Å; G73-F75 PolarHBondContact O-N 3.36Å; G73-Y76 WeakPolarHBondContact O-CB 3.39Å; G73-Y76 PolarHBondContact O-N 3.41Å |
| 74 | F | 85.4 | Confident | 80.6 | Confident | 101 Ų | 101 | 55.3 Ų | 55.3 | 44% | 0.443 | 28% | 0.283 | S | S | . | . | H | α-helix | trans | -61.4 | -29.8 | 175.2 | -75.8 | -70.2 | 0 | 0 | 0 | 113.1 | V70 L71 G72 Y76 I77 L191 | V70-F74 HydrophobicContact CG1-CD2 4.13Å; V70-F74 HydrophobicContact CG1-CE2 3.66Å; V70-F74 WeakPolarHBondContact O-CD2 3.46Å; V70-F74 PolarHBondContact O-N 2.89Å; V70-F74 VanDerWaalsContact O-N 3.13Å; L71-F74 PolarHBondContact O-N 3.39Å; G72-F74 VanDerWaalsContact C-N 3.33Å; G72-F74 PolarHBondContact O-N 2.9Å; F74-Y76 VanDerWaalsContact C-N 3.29Å; F74-Y76 PolarHBondContact O-N 2.9Å; F74-I77 HydrophobicContact CD1-CD1 4Å; F74-I77 WeakPolarHBondContact O-CB 3.46Å; F74-I77 PolarHBondContact O-N 3.49Å; F74-L191 HydrophobicContact CB-CD1 4.01Å |
| 75 | F | 82.1 | Confident | 79.4 | Confident | 4 Ų | 4 | 59.1 Ų | 59.1 | 2% | 0.018 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -69.5 | -23.9 | 175.1 | -73.9 | -71.7 | 0 | 0 | 0 | 113.7 | L71 G72 G73 I77 R78 V84 F188 L191 Q192 L195 | L71-F75 WeakPolarHBondContact O-CD2 3.32Å; L71-F75 PolarHBondContact O-N 2.87Å; G72-F75 WeakPolarHBondContact O-CB 3.42Å; G72-F75 PolarHBondContact O-N 2.88Å; G73-F75 PolarHBondContact O-N 3.36Å; F75-I77 PolarHBondContact O-N 3.36Å; F75-R78 VanDerWaalsContact O-CB 3.26Å; F75-R78 WeakPolarHBondContact O-CB 3.35Å; F75-R78 PolarHBondContact O-N 3.38Å; F75-V84 HydrophobicContact CB-CG2 3.65Å; F75-V84 WeakPolarHBondContact O-CG2 3.33Å; F75-F188 AromaticContact CD1-CD1 4Å; F75-F188 HydrophobicContact CD1-CD1 4Å; F75-F188 HydrophobicContact CD1-CE1 4.42Å; F75-F188 AromaticContact CE1-CD1 3.95Å; F75-F188 HydrophobicContact CE1-CD1 3.95Å; F75-L191 HydrophobicContact CE1-CB 4.3Å; F75-L191 HydrophobicContact CE2-CB 4.07Å; F75-L191 HydrophobicContact CZ-CB 3.59Å; F75-Q192 HydrophobicContact CE1-CG 3.48Å; F75-Q192 VanDerWaalsContact CE1-CG 3.48Å; F75-Q192 HydrophobicContact CZ-CB 4.15Å; F75-Q192 HydrophobicContact CZ-CG 3.39Å; F75-L195 HydrophobicContact CD2-CD2 4.24Å; F75-L195 HydrophobicContact CE2-CD2 3.84Å |
| 76 | Y | 78.5 | Confident | 78.6 | Confident | 121 Ų | 121 | 60.9 Ų | 60.9 | 48% | 0.475 | 32% | 0.319 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.5 | -15.8 | 174.8 | -80.9 | -89.3 | 0 | 0 | 0 | 113.6 | G72 G73 F74 R78 V84 I90 | G72-Y76 WeakPolarHBondContact O-CD2 3.45Å; G73-Y76 WeakPolarHBondContact O-CB 3.39Å; G73-Y76 PolarHBondContact O-N 3.41Å; F74-Y76 VanDerWaalsContact C-N 3.29Å; F74-Y76 PolarHBondContact O-N 2.9Å; Y76-R78 PolarHBondContact O-N 2.74Å; Y76-V84 HydrophobicContact CD1-CG1 3.69Å; Y76-V84 HydrophobicContact CE1-CG1 3.57Å; Y76-V84 HydrophobicContact CE2-CG1 4.42Å; Y76-V84 HydrophobicContact CG-CG1 4.18Å; Y76-I90 HydrophobicContact CE2-CD1 3.54Å; Y76-I90 HydrophobicContact CE2-CG1 4.26Å; Y76-I90 WeakPolarHBondContact OH-CD1 3.29Å |
| 77 | I | 75.6 | Confident | 78.1 | Confident | 131 Ų | 131 | 57.5 Ų | 57.5 | 67% | 0.672 | 31% | 0.305 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -71 | -19.6 | 173 | -55.4 | 174.3 | 0 | 0 | 0 | 110.7 | F74 F75 | F74-I77 HydrophobicContact CD1-CD1 4Å; F74-I77 WeakPolarHBondContact O-CB 3.46Å; F74-I77 PolarHBondContact O-N 3.49Å; F75-I77 PolarHBondContact O-N 3.36Å |
| 78 | R | 69.6 | Low | 77.7 | Confident | 30 Ų | 30 | 53.8 Ų | 53.8 | 11% | 0.113 | 29% | 0.286 | C | S | . | . | S | Bend | trans | -84.6 | 150.9 | 178.5 | -162.8 | 178.7 | 174.1 | -177 | 1.1 | 110.8 | F75 Y76 T81 Y146 F188 | F75-R78 VanDerWaalsContact O-CB 3.26Å; F75-R78 WeakPolarHBondContact O-CB 3.35Å; F75-R78 PolarHBondContact O-N 3.38Å; Y76-R78 PolarHBondContact O-N 2.74Å; R78-T81 HydrophobicContact CG-CG2 4.42Å; R78-Y146 HydrophobicContact CG-CE2 4.47Å; R78-F188 HydrophobicContact CB-CE1 3.9Å; R78-F188 HydrophobicContact CB-CE2 4.35Å; R78-F188 HydrophobicContact CB-CZ 3.71Å; R78-F188 HydrophobicContact CG-CE1 4.36Å; R78-F188 HydrophobicContact CG-CE2 4.14Å; R78-F188 HydrophobicContact CG-CZ 4.01Å |
| 79 | D | 63.4 | Low | 77.3 | Confident | 134 Ų | 134 | 54.2 Ų | 54.2 | 72% | 0.717 | 29% | 0.289 | S | S | * | . | S | Bend | trans | -53.2 | 147.8 | 161.6 | -84.8 | -41.9 | 0 | 0 | 0 | 111.4 | T81 | D79-T81 PolarHBondContact O-N 2.87Å; D79-T81 VanDerWaalsContact O-N 3.1Å |
| 80 | Y | 59.9 | Low | 77 | Confident | 189 Ų | 189 | 55.9 Ų | 55.9 | 74% | 0.741 | 29% | 0.291 | S | S | * | . | trans | -36.5 | 109.4 | -173.6 | -67.3 | -89.1 | 0 | 0 | 0 | 114 | T85 | Y80-T85 HydrophobicContact CD1-CG2 4.42Š| ||
| 81 | T | 61.7 | Low | 77 | Confident | 3 Ų | 3 | 56.1 Ų | 56.1 | 2% | 0.018 | 28% | 0.284 | C | S | . | . | trans | -111.6 | 155.9 | 169.5 | 50.9 | 0 | 0 | 0 | 0 | 110.6 | R78 D79 L83 V84 T85 | R78-T81 HydrophobicContact CG-CG2 4.42Å; D79-T81 PolarHBondContact O-N 2.87Å; D79-T81 VanDerWaalsContact O-N 3.1Å; T81-L83 PolarHBondContact O-N 3.32Å; T81-V84 WeakPolarHBondContact O-CA 3.21Å; T81-V84 WeakPolarHBondContact O-CB 3.36Å; T81-V84 PolarHBondContact O-N 2.95Å; T81-V84 WeakPolarHBondContact OG1-CG2 3.36Å; T81-T85 WeakPolarHBondContact O-CG2 3.2Å; T81-T85 PolarHBondContact O-N 3.37Å; T81-T85 PolarHBondContact O-OG1 3.11Å | ||
| 82 | L | 61.2 | Low | 77 | Confident | 76 Ų | 76 | 55.2 Ų | 55.2 | 40% | 0.398 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -56.8 | -39.2 | -179.8 | -172.5 | 72.5 | 0 | 0 | 0 | 110.7 | V84 T85 S86 E138 D139 | L82-V84 VanDerWaalsContact C-N 3.31Å; L82-V84 PolarHBondContact O-N 3.3Å; L82-T85 VanDerWaalsContact CA-OG1 3.28Å; L82-T85 WeakPolarHBondContact CA-OG1 3.32Å; L82-T85 PolarHBondContact O-N 2.97Å; L82-T85 PolarHBondContact O-OG1 3.45Å; L82-S86 WeakPolarHBondContact O-CB 3.3Å; L82-S86 PolarHBondContact O-N 3.44Å; L82-S86 PolarHBondContact O-OG 3Å; L82-E138 HydrophobicContact CD2-CB 4.33Å; L82-D139 HydrophobicContact CB-CB 4.43Å; L82-D139 WeakPolarHBondContact CB-OD1 3.36Å; L82-D139 HydrophobicContact CD2-CB 4.49Å; L82-D139 PolarHBondContact N-OD1 3.5Å |
| 83 | L | 62.8 | Low | 77.3 | Confident | 7 Ų | 7 | 55.1 Ų | 55.1 | 4% | 0.037 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -60.1 | -38.8 | 176.2 | -142.6 | 71.9 | 0 | 0 | 0 | 113.1 | T81 S86 D139 L195 W199 | T81-L83 PolarHBondContact O-N 3.32Å; L83-S86 PolarHBondContact O-OG 2.77Å; L83-S86 VanDerWaalsContact O-OG 3.06Å; L83-D139 HydrophobicContact CD1-CB 4.25Å; L83-D139 PolarHBondContact N-OD1 3.4Å; L83-L195 HydrophobicContact CD2-CD2 4.04Å; L83-W199 HydrophobicContact CD1-CH2 4Å; L83-W199 HydrophobicContact CD1-CZ3 4.44Å; L83-W199 HydrophobicContact CD2-CH2 4.15Å; L83-W199 HydrophobicContact CG-CH2 4.23Å |
| 84 | V | 69.3 | Low | 77.6 | Confident | 15 Ų | 15 | 55.7 Ų | 55.7 | 9% | 0.091 | 28% | 0.28 | C | S | . | . | H | α-helix | trans | -71.7 | -44.9 | 174.4 | 173.3 | 0 | 0 | 0 | 0 | 110.8 | F75 Y76 T81 L82 S86 G87 | F75-V84 HydrophobicContact CB-CG2 3.65Å; F75-V84 WeakPolarHBondContact O-CG2 3.33Å; Y76-V84 HydrophobicContact CD1-CG1 3.69Å; Y76-V84 HydrophobicContact CE1-CG1 3.57Å; Y76-V84 HydrophobicContact CE2-CG1 4.42Å; Y76-V84 HydrophobicContact CG-CG1 4.18Å; T81-V84 WeakPolarHBondContact O-CA 3.21Å; T81-V84 WeakPolarHBondContact O-CB 3.36Å; T81-V84 PolarHBondContact O-N 2.95Å; T81-V84 WeakPolarHBondContact OG1-CG2 3.36Å; L82-V84 VanDerWaalsContact C-N 3.31Å; L82-V84 PolarHBondContact O-N 3.3Å; V84-S86 VanDerWaalsContact C-N 3.32Å; V84-S86 PolarHBondContact O-N 3.12Å; V84-G87 PolarHBondContact O-N 3.49Å; V84-G87 VanDerWaalsContact O-N 3.12Å |
| 85 | T | 71 | Confident | 78.1 | Confident | 89 Ų | 89 | 52.2 Ų | 52.2 | 55% | 0.546 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -64.6 | -35.8 | -178.5 | 60.4 | 0 | 0 | 0 | 0 | 113 | Y80 T81 L82 G87 | Y80-T85 HydrophobicContact CD1-CG2 4.42Å; T81-T85 WeakPolarHBondContact O-CG2 3.2Å; T81-T85 PolarHBondContact O-N 3.37Å; T81-T85 PolarHBondContact O-OG1 3.11Å; L82-T85 VanDerWaalsContact CA-OG1 3.28Å; L82-T85 WeakPolarHBondContact CA-OG1 3.32Å; L82-T85 PolarHBondContact O-N 2.97Å; L82-T85 PolarHBondContact O-OG1 3.45Å; T85-G87 PolarHBondContact O-N 3.37Å |
| 86 | S | 77.9 | Confident | 78.6 | Confident | 37 Ų | 37 | 52.1 Ų | 52.1 | 26% | 0.259 | 27% | 0.267 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -72.5 | -13 | 178 | 67 | 0 | 0 | 0 | 0 | 113.4 | L82 L83 V84 A88 W91 | L82-S86 WeakPolarHBondContact O-CB 3.3Å; L82-S86 PolarHBondContact O-N 3.44Å; L82-S86 PolarHBondContact O-OG 3Å; L83-S86 PolarHBondContact O-OG 2.77Å; L83-S86 VanDerWaalsContact O-OG 3.06Å; V84-S86 VanDerWaalsContact C-N 3.32Å; V84-S86 PolarHBondContact O-N 3.12Å; S86-A88 PolarHBondContact O-N 3.39Å; S86-A88 PolarHBondContact OG-N 3.31Å; S86-W91 PolarHBondContact O-NE1 2.81Å |
| 87 | G | 83.8 | Confident | 79.4 | Confident | 16 Ų | 16 | 48.6 Ų | 48.6 | 17% | 0.165 | 26% | 0.258 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 63.2 | 7.1 | -171.1 | 0 | 0 | 0 | 0 | 0 | 113.8 | V84 T85 A89 I90 W91 | V84-G87 PolarHBondContact O-N 3.49Å; V84-G87 VanDerWaalsContact O-N 3.12Å; T85-G87 PolarHBondContact O-N 3.37Å; G87-A89 VanDerWaalsContact C-N 3.33Å; G87-A89 PolarHBondContact O-N 2.98Å; G87-I90 PolarHBondContact O-N 3.22Å; G87-W91 VanDerWaalsContact C-NE1 3.34Å; G87-W91 PolarHBondContact O-N 2.88Å; G87-W91 PolarHBondContact O-NE1 2.94Å |
| 88 | A | 86.2 | Confident | 80.4 | Confident | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -2.2 | -78.2 | 169.2 | 0 | 0 | 0 | 0 | 0 | 115.3 | S86 I90 W91 T92 A132 L135 | S86-A88 PolarHBondContact O-N 3.39Å; S86-A88 PolarHBondContact OG-N 3.31Å; A88-I90 PolarHBondContact O-N 3.06Å; A88-W91 VanDerWaalsContact CA-NE1 3.31Å; A88-W91 VanDerWaalsContact CB-CE2 3.43Å; A88-W91 HydrophobicContact CB-CZ2 3.43Å; A88-W91 VanDerWaalsContact CB-CZ2 3.43Å; A88-W91 VanDerWaalsContact N-NE1 3.15Å; A88-W91 PolarHBondContact O-NE1 3.19Å; A88-T92 WeakPolarHBondContact O-CB 3.48Å; A88-T92 VanDerWaalsContact O-CG2 3.3Å; A88-T92 WeakPolarHBondContact O-CG2 3.44Å; A88-T92 PolarHBondContact O-N 3.47Å; A88-T92 PolarHBondContact O-OG1 2.93Å; A88-A132 HydrophobicContact CB-CB 4.2Å; A88-L135 HydrophobicContact CB-CD1 3.56Å |
| 89 | A | 84.9 | Confident | 81.5 | Confident | 8 Ų | 8 | 45.6 Ų | 45.6 | 7% | 0.066 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -70.6 | -30.5 | -170.4 | 0 | 0 | 0 | 0 | 0 | 113.7 | S68 G87 T92 G93 L195 W199 | S68-A89 PolarHBondContact OG-O 2.84Å; G87-A89 VanDerWaalsContact C-N 3.33Å; G87-A89 PolarHBondContact O-N 2.98Å; A89-T92 WeakPolarHBondContact CA-OG1 3.44Å; A89-T92 PolarHBondContact O-OG1 3.11Å; A89-G93 PolarHBondContact O-N 2.99Å; A89-G93 VanDerWaalsContact O-N 3.12Å; A89-L195 HydrophobicContact CB-CD1 4.24Å; A89-L195 HydrophobicContact CB-CD2 4.01Å; A89-W199 HydrophobicContact CB-CZ2 4.22Å |
| 90 | I | 86.3 | Confident | 82.9 | Confident | 79 Ų | 79 | 39.2 Ų | 39.2 | 41% | 0.405 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -74.6 | -55.5 | -177.4 | -60.1 | 171.7 | 0 | 0 | 0 | 110.1 | Y76 G87 A88 T92 G93 A94 | Y76-I90 HydrophobicContact CE2-CD1 3.54Å; Y76-I90 HydrophobicContact CE2-CG1 4.26Å; Y76-I90 WeakPolarHBondContact OH-CD1 3.29Å; G87-I90 PolarHBondContact O-N 3.22Å; A88-I90 PolarHBondContact O-N 3.06Å; I90-T92 PolarHBondContact O-N 3.31Å; I90-G93 PolarHBondContact O-N 3.11Å; I90-A94 WeakPolarHBondContact O-CB 3.28Å; I90-A94 PolarHBondContact O-N 3.29Å |
| 91 | W | 91.2 | Very high | 84.5 | Confident | 80 Ų | 80 | 31.9 Ų | 31.9 | 30% | 0.303 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -69.9 | -34.7 | -175.6 | 60.9 | -95.7 | 0 | 0 | 0 | 111.7 | S86 G87 A88 V95 T128 A131 L135 | S86-W91 PolarHBondContact O-NE1 2.81Å; G87-W91 VanDerWaalsContact C-NE1 3.34Å; G87-W91 PolarHBondContact O-N 2.88Å; G87-W91 PolarHBondContact O-NE1 2.94Å; A88-W91 VanDerWaalsContact CA-NE1 3.31Å; A88-W91 VanDerWaalsContact CB-CE2 3.43Å; A88-W91 HydrophobicContact CB-CZ2 3.43Å; A88-W91 VanDerWaalsContact CB-CZ2 3.43Å; A88-W91 VanDerWaalsContact N-NE1 3.15Å; A88-W91 PolarHBondContact O-NE1 3.19Å; W91-V95 WeakPolarHBondContact O-CB 3.44Å; W91-V95 VanDerWaalsContact O-CG2 3.23Å; W91-V95 WeakPolarHBondContact O-CG2 3.34Å; W91-V95 PolarHBondContact O-N 3.47Å; W91-T128 HydrophobicContact CE3-CG2 3.52Å; W91-T128 HydrophobicContact CH2-CG2 4.41Å; W91-T128 WeakPolarHBondContact CH2-O 3.43Å; W91-T128 HydrophobicContact CZ3-CG2 3.24Å; W91-A131 HydrophobicContact CH2-CB 3.72Å; W91-A131 HydrophobicContact CZ2-CB 4.48Å; W91-L135 HydrophobicContact CZ2-CD1 4.25Å |
| 92 | T | 92 | Very high | 85.9 | Confident | 1 Ų | 1 | 32 Ų | 32 | 1% | 0.006 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -61.3 | -47.5 | 170.5 | 47.7 | 0 | 0 | 0 | 0 | 112.3 | S68 A88 A89 I90 A96 T128 A132 W199 | S68-T92 PolarHBondContact OG-OG1 2.95Å; A88-T92 WeakPolarHBondContact O-CB 3.48Å; A88-T92 VanDerWaalsContact O-CG2 3.3Å; A88-T92 WeakPolarHBondContact O-CG2 3.44Å; A88-T92 PolarHBondContact O-N 3.47Å; A88-T92 PolarHBondContact O-OG1 2.93Å; A89-T92 WeakPolarHBondContact CA-OG1 3.44Å; A89-T92 PolarHBondContact O-OG1 3.11Å; I90-T92 PolarHBondContact O-N 3.31Å; T92-A96 WeakPolarHBondContact O-CB 3.49Å; T92-A96 PolarHBondContact O-N 2.97Å; T92-T128 WeakPolarHBondContact CG2-O 3.39Å; T92-A132 HydrophobicContact CG2-CB 3.55Å; T92-W199 PolarHBondContact OG1-NE1 3.28Å |
| 93 | G | 92.9 | Very high | 87.3 | Confident | 1 Ų | 1 | 28.4 Ų | 28.4 | 1% | 0.01 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -62 | -46.9 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112.6 | G65 A89 I90 V95 A96 V97 | G65-G93 VanDerWaalsContact O-CA 3.28Å; G65-G93 WeakPolarHBondContact O-CA 3.44Å; A89-G93 PolarHBondContact O-N 2.99Å; A89-G93 VanDerWaalsContact O-N 3.12Å; I90-G93 PolarHBondContact O-N 3.11Å; G93-V95 PolarHBondContact O-N 2.79Å; G93-A96 PolarHBondContact O-N 3.44Å; G93-V97 WeakPolarHBondContact O-CG2 3.44Å; G93-V97 PolarHBondContact O-N 2.97Å |
| 94 | A | 94.1 | Very high | 88.6 | Confident | 48 Ų | 48 | 32.2 Ų | 32.2 | 40% | 0.397 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -60 | -47.8 | 178.6 | 0 | 0 | 0 | 0 | 0 | 112 | I90 A96 V97 L98 | I90-A94 WeakPolarHBondContact O-CB 3.28Å; I90-A94 PolarHBondContact O-N 3.29Å; A94-A96 VanDerWaalsContact C-N 3.32Å; A94-A96 PolarHBondContact O-N 3.23Å; A94-V97 PolarHBondContact O-N 3.47Å; A94-L98 VanDerWaalsContact O-CG 3.32Å; A94-L98 WeakPolarHBondContact O-CG 3.48Å; A94-L98 PolarHBondContact O-N 3.33Å |
| 95 | V | 94.8 | Very high | 89.7 | Confident | 28 Ų | 28 | 33.7 Ų | 33.7 | 17% | 0.17 | 20% | 0.195 | C | C | . | . | H | α-helix | trans | -64 | -39 | 178.6 | 175.5 | 0 | 0 | 0 | 0 | 111.2 | W91 G93 L98 A99 A124 A125 T128 | W91-V95 WeakPolarHBondContact O-CB 3.44Å; W91-V95 VanDerWaalsContact O-CG2 3.23Å; W91-V95 WeakPolarHBondContact O-CG2 3.34Å; W91-V95 PolarHBondContact O-N 3.47Å; G93-V95 PolarHBondContact O-N 2.79Å; V95-L98 PolarHBondContact O-N 3.48Å; V95-A99 WeakPolarHBondContact O-CB 2.93Å; V95-A99 PolarHBondContact O-N 3.01Å; V95-A124 HydrophobicContact CG1-CB 3.79Å; V95-A125 HydrophobicContact CG1-CB 4.06Å; V95-T128 HydrophobicContact CB-CG2 4.28Å; V95-T128 HydrophobicContact CG1-CG2 4.21Å; V95-T128 HydrophobicContact CG2-CG2 4.1Å |
| 96 | A | 94 | Very high | 90.5 | Very high | 2 Ų | 2 | 33.5 Ų | 33.5 | 2% | 0.017 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -63.8 | -43.3 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | T92 G93 A94 A99 G100 L202 | T92-A96 WeakPolarHBondContact O-CB 3.49Å; T92-A96 PolarHBondContact O-N 2.97Å; G93-A96 PolarHBondContact O-N 3.44Å; A94-A96 VanDerWaalsContact C-N 3.32Å; A94-A96 PolarHBondContact O-N 3.23Å; A96-A99 PolarHBondContact O-N 3.25Å; A96-G100 PolarHBondContact O-N 2.92Å; A96-L202 HydrophobicContact CB-CD1 4.2Å; A96-L202 HydrophobicContact CB-CD2 3.53Å |
| 97 | V | 95.7 | Very high | 90.9 | Very high | 47 Ų | 47 | 36.3 Ų | 36.3 | 29% | 0.285 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -62.2 | -44.8 | 175 | 172.9 | 0 | 0 | 0 | 0 | 110.8 | I66 G93 A94 A99 G100 A101 | I66-V97 HydrophobicContact CG1-CG2 4.11Å; G93-V97 WeakPolarHBondContact O-CG2 3.44Å; G93-V97 PolarHBondContact O-N 2.97Å; A94-V97 PolarHBondContact O-N 3.47Å; V97-A99 PolarHBondContact O-N 2.95Å; V97-G100 PolarHBondContact O-N 3.43Å; V97-A101 VanDerWaalsContact O-CB 3.32Å; V97-A101 WeakPolarHBondContact O-CB 3.34Å; V97-A101 PolarHBondContact O-N 3.19Å |
| 98 | L | 95.5 | Very high | 91.1 | Very high | 97 Ų | 97 | 42.9 Ų | 42.9 | 51% | 0.508 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -61.9 | -43.3 | 176.7 | -71.1 | 172.7 | 0 | 0 | 0 | 111.9 | A94 V95 A101 A102 L121 | A94-L98 VanDerWaalsContact O-CG 3.32Å; A94-L98 WeakPolarHBondContact O-CG 3.48Å; A94-L98 PolarHBondContact O-N 3.33Å; V95-L98 PolarHBondContact O-N 3.48Å; L98-A101 PolarHBondContact O-N 3.37Å; L98-A102 VanDerWaalsContact O-CB 3.32Å; L98-A102 WeakPolarHBondContact O-CB 3.32Å; L98-A102 PolarHBondContact O-N 2.86Å; L98-L121 HydrophobicContact CB-CD1 4.23Å; L98-L121 HydrophobicContact CB-CD2 4.07Å |
| 99 | A | 92.7 | Very high | 91.2 | Very high | 0 Ų | 0 | 52.1 Ų | 52.1 | 0% | 0 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -60.3 | -46.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | V95 A96 V97 A102 A103 L121 A125 | V95-A99 WeakPolarHBondContact O-CB 2.93Å; V95-A99 PolarHBondContact O-N 3.01Å; A96-A99 PolarHBondContact O-N 3.25Å; V97-A99 PolarHBondContact O-N 2.95Å; A99-A102 PolarHBondContact O-N 3.45Å; A99-A103 WeakPolarHBondContact O-CB 3.36Å; A99-A103 PolarHBondContact O-N 3.32Å; A99-L121 HydrophobicContact CB-CB 3.92Å; A99-A125 HydrophobicContact CB-CB 4.27Å |
| 100 | G | 92.4 | Very high | 91.2 | Very high | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 26% | 0.263 | C | S | . | . | H | α-helix | trans | -65.7 | -41.2 | 177.1 | 0 | 0 | 0 | 0 | 0 | 113 | A96 V97 A103 F104 | A96-G100 PolarHBondContact O-N 2.92Å; V97-G100 PolarHBondContact O-N 3.43Å; G100-A103 PolarHBondContact O-N 2.82Å; G100-F104 PolarHBondContact O-N 3.03Å |
| 101 | A | 94.1 | Very high | 91.2 | Very high | 36 Ų | 36 | 51.5 Ų | 51.5 | 30% | 0.298 | 27% | 0.267 | S | S | . | . | H | α-helix | trans | -64.5 | -44 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112 | V97 L98 A103 F104 I105 | V97-A101 VanDerWaalsContact O-CB 3.32Å; V97-A101 WeakPolarHBondContact O-CB 3.34Å; V97-A101 PolarHBondContact O-N 3.19Å; L98-A101 PolarHBondContact O-N 3.37Å; A101-A103 VanDerWaalsContact C-N 3.31Å; A101-A103 PolarHBondContact O-N 2.93Å; A101-F104 WeakPolarHBondContact O-CB 3.37Å; A101-F104 PolarHBondContact O-N 3.33Å; A101-I105 VanDerWaalsContact O-CG1 3.31Å; A101-I105 WeakPolarHBondContact O-CG1 3.34Å; A101-I105 PolarHBondContact O-N 3.36Å |
| 102 | A | 92.1 | Very high | 91 | Very high | 4 Ų | 4 | 52.9 Ų | 52.9 | 3% | 0.033 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -63 | -38.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | L98 A99 I105 Y106 L117 L121 | L98-A102 VanDerWaalsContact O-CB 3.32Å; L98-A102 WeakPolarHBondContact O-CB 3.32Å; L98-A102 PolarHBondContact O-N 2.86Å; A99-A102 PolarHBondContact O-N 3.45Å; A102-I105 PolarHBondContact O-N 3.11Å; A102-Y106 WeakPolarHBondContact O-CB 3.48Å; A102-Y106 PolarHBondContact O-N 3.47Å; A102-L117 HydrophobicContact CB-CG 4.48Å; A102-L121 HydrophobicContact CB-CD1 3.55Å |
| 103 | A | 89.4 | Confident | 90.9 | Very high | 1 Ų | 1 | 62.6 Ų | 62.6 | 1% | 0.008 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -64.3 | -41.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.4 | W58 A99 G100 A101 Y106 E107 R118 | W58-A103 HydrophobicContact CB-CB 3.64Å; W58-A103 HydrophobicContact CG-CB 4.25Å; A99-A103 WeakPolarHBondContact O-CB 3.36Å; A99-A103 PolarHBondContact O-N 3.32Å; G100-A103 PolarHBondContact O-N 2.82Å; A101-A103 VanDerWaalsContact C-N 3.31Å; A101-A103 PolarHBondContact O-N 2.93Å; A103-Y106 PolarHBondContact O-N 3.23Å; A103-E107 PolarHBondContact O-N 3.44Å; A103-R118 HydrophobicContact CB-CG 4.18Å |
| 104 | F | 90.8 | Very high | 90.8 | Very high | 88 Ų | 88 | 66.4 Ų | 66.4 | 39% | 0.386 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -61.4 | -47.4 | 173.8 | 170.9 | -100.8 | 0 | 0 | 0 | 112.2 | W58 G100 A101 Y106 E107 K108 | W58-F104 HydrophobicContact CD2-CB 4.32Å; W58-F104 HydrophobicContact CE3-CB 4.15Å; W58-F104 AromaticContact CH2-CD2 3.68Å; W58-F104 HydrophobicContact CH2-CD2 3.68Å; W58-F104 HydrophobicContact CH2-CE2 4.37Å; W58-F104 HydrophobicContact CH2-CG 4.47Å; W58-F104 AromaticContact CZ2-CD2 3.84Å; W58-F104 HydrophobicContact CZ2-CD2 3.84Å; W58-F104 HydrophobicContact CZ3-CB 4.26Å; W58-F104 HydrophobicContact CZ3-CD2 4.14Å; G100-F104 PolarHBondContact O-N 3.03Å; A101-F104 WeakPolarHBondContact O-CB 3.37Å; A101-F104 PolarHBondContact O-N 3.33Å; F104-Y106 VanDerWaalsContact C-N 3.34Å; F104-Y106 PolarHBondContact O-N 3.46Å; F104-E107 PolarHBondContact O-N 2.85Å; F104-K108 HydrophobicContact CD2-CG 4.4Å; F104-K108 HydrophobicContact CE1-CG 4.33Å; F104-K108 HydrophobicContact CE2-CG 3.96Å; F104-K108 HydrophobicContact CZ-CG 3.92Å; F104-K108 WeakPolarHBondContact O-CG 3.42Å; F104-K108 PolarHBondContact O-N 2.71Å; F104-K108 VanDerWaalsContact O-N 3.11Å |
| 105 | I | 91.2 | Very high | 90.4 | Very high | 46 Ų | 46 | 65.4 Ų | 65.4 | 24% | 0.236 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -63.5 | -43 | 179.6 | -64.9 | 166.3 | 0 | 0 | 0 | 110.5 | A101 A102 E107 K108 R109 W114 | A101-I105 VanDerWaalsContact O-CG1 3.31Å; A101-I105 WeakPolarHBondContact O-CG1 3.34Å; A101-I105 PolarHBondContact O-N 3.36Å; A102-I105 PolarHBondContact O-N 3.11Å; I105-E107 VanDerWaalsContact C-N 3.33Å; I105-E107 PolarHBondContact O-N 3.35Å; I105-K108 PolarHBondContact O-N 3.27Å; I105-R109 HydrophobicContact CG2-CG 4.28Å; I105-R109 WeakPolarHBondContact O-CB 3.32Å; I105-R109 PolarHBondContact O-N 2.85Å; I105-W114 HydrophobicContact CB-CD2 4.39Å; I105-W114 HydrophobicContact CB-CE3 4.08Å; I105-W114 HydrophobicContact CB-CZ3 4.23Å; I105-W114 HydrophobicContact CD1-CE3 4.45Å; I105-W114 HydrophobicContact CD1-CH2 3.96Å; I105-W114 HydrophobicContact CD1-CZ3 3.76Å; I105-W114 HydrophobicContact CG2-CD2 3.53Å; I105-W114 HydrophobicContact CG2-CE3 3.64Å; I105-W114 HydrophobicContact CG2-CG 4.15Å; I105-W114 HydrophobicContact CG2-CH2 3.93Å; I105-W114 HydrophobicContact CG2-CZ2 3.81Å; I105-W114 HydrophobicContact CG2-CZ3 3.84Å |
| 106 | Y | 87.8 | Confident | 90.2 | Very high | 85 Ų | 85 | 69 Ų | 69 | 33% | 0.333 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -58.9 | -43.1 | 175 | 172.4 | -99.1 | 0 | 0 | 0 | 112 | A102 A103 F104 K108 G110 W114 A115 R118 | A102-Y106 WeakPolarHBondContact O-CB 3.48Å; A102-Y106 PolarHBondContact O-N 3.47Å; A103-Y106 PolarHBondContact O-N 3.23Å; F104-Y106 VanDerWaalsContact C-N 3.34Å; F104-Y106 PolarHBondContact O-N 3.46Å; Y106-K108 VanDerWaalsContact C-N 3.27Å; Y106-K108 PolarHBondContact O-N 3.45Å; Y106-G110 WeakPolarHBondContact O-CA 3.48Å; Y106-G110 PolarHBondContact O-N 3.41Å; Y106-W114 HydrophobicContact CD2-CB 4.12Å; Y106-A115 HydrophobicContact CD2-CB 3.88Å; Y106-A115 HydrophobicContact CE2-CB 3.49Å; Y106-A115 VanDerWaalsContact CE2-CB 3.49Å; Y106-R118 VanDerWaalsContact CD1-NH1 3.31Å |
| 107 | E | 86.7 | Confident | 90.1 | Very high | 95 Ų | 95 | 72.3 Ų | 72.3 | 44% | 0.444 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -63.6 | -32.9 | 178 | -165.5 | 71.7 | -169.8 | 0 | 0 | 112.3 | A103 F104 I105 | A103-E107 PolarHBondContact O-N 3.44Å; F104-E107 PolarHBondContact O-N 2.85Å; I105-E107 VanDerWaalsContact C-N 3.33Å; I105-E107 PolarHBondContact O-N 3.35Å |
| 108 | K | 88.6 | Confident | 89.8 | Confident | 155 Ų | 155 | 71.6 Ų | 71.6 | 67% | 0.674 | 36% | 0.355 | S | S | * | . | H | α-helix | trans | -88.1 | -41.4 | -177.3 | -68.5 | -61.9 | -175.4 | -177.5 | 0 | 114.5 | F104 I105 Y106 | F104-K108 HydrophobicContact CD2-CG 4.4Å; F104-K108 HydrophobicContact CE1-CG 4.33Å; F104-K108 HydrophobicContact CE2-CG 3.96Å; F104-K108 HydrophobicContact CZ-CG 3.92Å; F104-K108 WeakPolarHBondContact O-CG 3.42Å; F104-K108 PolarHBondContact O-N 2.71Å; F104-K108 VanDerWaalsContact O-N 3.11Å; I105-K108 PolarHBondContact O-N 3.27Å; Y106-K108 VanDerWaalsContact C-N 3.27Å; Y106-K108 PolarHBondContact O-N 3.45Å |
| 109 | R | 88.5 | Confident | 89.4 | Confident | 193 Ų | 193 | 71.4 Ų | 71.4 | 73% | 0.728 | 36% | 0.358 | S | S | * | . | H | α-helix | trans | -102.2 | -21.7 | -173.9 | -63.4 | -172 | -180 | -178.5 | -2.1 | 112.9 | I105 | I105-R109 HydrophobicContact CG2-CG 4.28Å; I105-R109 WeakPolarHBondContact O-CB 3.32Å; I105-R109 PolarHBondContact O-N 2.85Å |
| 110 | G | 84.9 | Confident | 89.4 | Confident | 27 Ų | 27 | 76.8 Ų | 76.8 | 28% | 0.278 | 39% | 0.386 | S | S | . | . | trans | 59.6 | -165.2 | -165.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | Y106 | Y106-G110 WeakPolarHBondContact O-CA 3.48Å; Y106-G110 PolarHBondContact O-N 3.41Å | ||
| 111 | G | 85 | Confident | 89.5 | Confident | 47 Ų | 47 | 78.2 Ų | 78.2 | 49% | 0.485 | 39% | 0.393 | S | S | . | . | trans | 104.7 | 143.9 | 172.8 | 0 | 0 | 0 | 0 | 0 | 114.6 | Y113 W114 A115 | G111-Y113 PolarHBondContact O-N 3.05Å; G111-W114 PolarHBondContact O-N 3.03Å; G111-A115 PolarHBondContact O-N 3.49Å | ||
| 112 | T | 88.5 | Confident | 89.3 | Confident | 110 Ų | 110 | 77.3 Ų | 77.3 | 68% | 0.675 | 39% | 0.385 | S | S | * | . | H | α-helix | trans | -62.1 | -42.3 | -174.2 | -47.6 | 0 | 0 | 0 | 0 | 112.7 | W114 A115 L116 | T112-W114 PolarHBondContact O-N 3.25Å; T112-A115 WeakPolarHBondContact O-CB 3.43Å; T112-A115 PolarHBondContact O-N 2.98Å; T112-L116 HydrophobicContact CG2-CD1 4.39Å; T112-L116 WeakPolarHBondContact O-CG 3.4Å; T112-L116 PolarHBondContact O-N 3.41Å |
| 113 | Y | 89.9 | Confident | 89.2 | Confident | 204 Ų | 204 | 82.5 Ų | 82.5 | 80% | 0.8 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -60.8 | -44.7 | 178 | -71.2 | -74.4 | 0 | 0 | 0 | 112.3 | G111 A115 L116 L117 | G111-Y113 PolarHBondContact O-N 3.05Å; Y113-A115 VanDerWaalsContact C-N 3.33Å; Y113-A115 PolarHBondContact O-N 3.47Å; Y113-L116 PolarHBondContact O-N 3.02Å; Y113-L117 WeakPolarHBondContact O-CB 3.36Å; Y113-L117 PolarHBondContact O-N 3.31Å |
| 114 | W | 89.6 | Confident | 89.5 | Confident | 82 Ų | 82 | 84 Ų | 84 | 31% | 0.311 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -67.8 | -33.8 | 177.1 | -66.9 | 110.4 | 0 | 0 | 0 | 112.1 | I105 Y106 G111 T112 L117 R118 | I105-W114 HydrophobicContact CB-CD2 4.39Å; I105-W114 HydrophobicContact CB-CE3 4.08Å; I105-W114 HydrophobicContact CB-CZ3 4.23Å; I105-W114 HydrophobicContact CD1-CE3 4.45Å; I105-W114 HydrophobicContact CD1-CH2 3.96Å; I105-W114 HydrophobicContact CD1-CZ3 3.76Å; I105-W114 HydrophobicContact CG2-CD2 3.53Å; I105-W114 HydrophobicContact CG2-CE3 3.64Å; I105-W114 HydrophobicContact CG2-CG 4.15Å; I105-W114 HydrophobicContact CG2-CH2 3.93Å; I105-W114 HydrophobicContact CG2-CZ2 3.81Å; I105-W114 HydrophobicContact CG2-CZ3 3.84Å; Y106-W114 HydrophobicContact CD2-CB 4.12Å; G111-W114 PolarHBondContact O-N 3.03Å; T112-W114 PolarHBondContact O-N 3.25Å; W114-L117 HydrophobicContact CE3-CD2 4Å; W114-L117 HydrophobicContact CZ3-CD2 3.87Å; W114-R118 WeakPolarHBondContact O-CB 3.39Å; W114-R118 PolarHBondContact O-N 3.34Å |
| 115 | A | 86.6 | Confident | 89.5 | Confident | 27 Ų | 27 | 80.1 Ų | 80.1 | 22% | 0.223 | 41% | 0.407 | C | S | . | . | H | α-helix | trans | -63.9 | -46.5 | 174 | 0 | 0 | 0 | 0 | 0 | 112 | Y106 G111 T112 Y113 T119 | Y106-A115 HydrophobicContact CD2-CB 3.88Å; Y106-A115 HydrophobicContact CE2-CB 3.49Å; Y106-A115 VanDerWaalsContact CE2-CB 3.49Å; G111-A115 PolarHBondContact O-N 3.49Å; T112-A115 WeakPolarHBondContact O-CB 3.43Å; T112-A115 PolarHBondContact O-N 2.98Å; Y113-A115 VanDerWaalsContact C-N 3.33Å; Y113-A115 PolarHBondContact O-N 3.47Å; A115-T119 PolarHBondContact O-N 2.94Å; A115-T119 PolarHBondContact O-OG1 3.33Å |
| 116 | L | 89.5 | Confident | 89.5 | Confident | 103 Ų | 103 | 81.2 Ų | 81.2 | 54% | 0.539 | 41% | 0.411 | S | S | . | . | H | α-helix | trans | -63.4 | -48.3 | 176.7 | -71.3 | 174.3 | 0 | 0 | 0 | 110.8 | T112 Y113 R118 T119 L120 | T112-L116 HydrophobicContact CG2-CD1 4.39Å; T112-L116 WeakPolarHBondContact O-CG 3.4Å; T112-L116 PolarHBondContact O-N 3.41Å; Y113-L116 PolarHBondContact O-N 3.02Å; L116-R118 PolarHBondContact O-N 2.83Å; L116-T119 WeakPolarHBondContact O-CB 3.45Å; L116-T119 PolarHBondContact O-N 3.48Å; L116-T119 VanDerWaalsContact O-N 3.1Å; L116-L120 WeakPolarHBondContact O-CG 3.39Å; L116-L120 PolarHBondContact O-N 3.37Å |
| 117 | L | 92 | Very high | 89.8 | Confident | 72 Ų | 72 | 80.1 Ų | 80.1 | 38% | 0.377 | 42% | 0.416 | S | S | . | . | H | α-helix | trans | -60.5 | -44.5 | 179 | -176.3 | 61.6 | 0 | 0 | 0 | 111.9 | A102 Y113 W114 T119 L120 L121 | A102-L117 HydrophobicContact CB-CG 4.48Å; Y113-L117 WeakPolarHBondContact O-CB 3.36Å; Y113-L117 PolarHBondContact O-N 3.31Å; W114-L117 HydrophobicContact CE3-CD2 4Å; W114-L117 HydrophobicContact CZ3-CD2 3.87Å; L117-T119 VanDerWaalsContact C-N 3.29Å; L117-T119 PolarHBondContact O-N 3.43Å; L117-L120 PolarHBondContact O-N 3.35Å; L117-L121 HydrophobicContact CD1-CD1 3.92Å; L117-L121 HydrophobicContact CD1-CG 4.13Å; L117-L121 HydrophobicContact CD2-CD1 4.48Å; L117-L121 HydrophobicContact CG-CD1 3.8Å; L117-L121 HydrophobicContact CG-CG 4.41Å; L117-L121 WeakPolarHBondContact O-CB 3.27Å; L117-L121 WeakPolarHBondContact O-CG 3.5Å; L117-L121 PolarHBondContact O-N 2.86Å |
| 118 | R | 89.6 | Confident | 90.1 | Very high | 32 Ų | 32 | 76.2 Ų | 76.2 | 12% | 0.121 | 40% | 0.398 | C | S | . | . | H | α-helix | trans | -55.5 | -45.4 | 173.2 | 175.1 | -172.8 | 174.4 | 154.4 | 3 | 111.3 | A103 Y106 W114 L116 T122 | A103-R118 HydrophobicContact CB-CG 4.18Å; Y106-R118 VanDerWaalsContact CD1-NH1 3.31Å; W114-R118 WeakPolarHBondContact O-CB 3.39Å; W114-R118 PolarHBondContact O-N 3.34Å; L116-R118 PolarHBondContact O-N 2.83Å; R118-T122 VanDerWaalsContact O-CB 3.32Å; R118-T122 WeakPolarHBondContact O-CB 3.29Å; R118-T122 PolarHBondContact O-N 2.85Å; R118-T122 PolarHBondContact O-OG1 3.32Å |
| 119 | T | 87.4 | Confident | 90.2 | Very high | 92 Ų | 92 | 68.9 Ų | 68.9 | 56% | 0.564 | 37% | 0.367 | S | S | * | . | H | α-helix | trans | -65.6 | -47.1 | -178.8 | -55.7 | 0 | 0 | 0 | 0 | 111.1 | A115 L116 L117 T122 L123 | A115-T119 PolarHBondContact O-N 2.94Å; A115-T119 PolarHBondContact O-OG1 3.33Å; L116-T119 WeakPolarHBondContact O-CB 3.45Å; L116-T119 PolarHBondContact O-N 3.48Å; L116-T119 VanDerWaalsContact O-N 3.1Å; L117-T119 VanDerWaalsContact C-N 3.29Å; L117-T119 PolarHBondContact O-N 3.43Å; T119-T122 PolarHBondContact O-N 3.3Å; T119-L123 WeakPolarHBondContact O-CB 3.32Å; T119-L123 PolarHBondContact O-N 3.19Å |
| 120 | L | 93.2 | Very high | 90.4 | Very high | 113 Ų | 113 | 62.7 Ų | 62.7 | 59% | 0.592 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -60.9 | -45.7 | 177 | -70.1 | 174.5 | 0 | 0 | 0 | 112 | L116 L117 L123 A124 | L116-L120 WeakPolarHBondContact O-CG 3.39Å; L116-L120 PolarHBondContact O-N 3.37Å; L117-L120 PolarHBondContact O-N 3.35Å; L120-L123 PolarHBondContact O-N 3.45Å; L120-A124 WeakPolarHBondContact O-CB 3.17Å; L120-A124 PolarHBondContact O-N 2.83Å |
| 121 | L | 93.6 | Very high | 90.7 | Very high | 30 Ų | 30 | 63.2 Ų | 63.2 | 16% | 0.157 | 35% | 0.349 | C | S | . | . | H | α-helix | trans | -68.8 | -34.3 | 178.6 | -72.7 | 169.3 | 0 | 0 | 0 | 112.5 | L98 A99 A102 L117 A124 A125 | L98-L121 HydrophobicContact CB-CD1 4.23Å; L98-L121 HydrophobicContact CB-CD2 4.07Å; A99-L121 HydrophobicContact CB-CB 3.92Å; A102-L121 HydrophobicContact CB-CD1 3.55Å; L117-L121 HydrophobicContact CD1-CD1 3.92Å; L117-L121 HydrophobicContact CD1-CG 4.13Å; L117-L121 HydrophobicContact CD2-CD1 4.48Å; L117-L121 HydrophobicContact CG-CD1 3.8Å; L117-L121 HydrophobicContact CG-CG 4.41Å; L117-L121 WeakPolarHBondContact O-CB 3.27Å; L117-L121 WeakPolarHBondContact O-CG 3.5Å; L117-L121 PolarHBondContact O-N 2.86Å; L121-A124 PolarHBondContact O-N 2.89Å; L121-A125 VanDerWaalsContact O-CB 3.32Å; L121-A125 WeakPolarHBondContact O-CB 3.44Å; L121-A125 PolarHBondContact O-N 3.45Å |
| 122 | T | 90 | Very high | 91 | Very high | 18 Ų | 18 | 61 Ų | 61 | 11% | 0.11 | 33% | 0.326 | C | S | . | . | H | α-helix | trans | -66.2 | -41.7 | 174.1 | -56.9 | 0 | 0 | 0 | 0 | 110.7 | R118 T119 A125 F126 S206 | R118-T122 VanDerWaalsContact O-CB 3.32Å; R118-T122 WeakPolarHBondContact O-CB 3.29Å; R118-T122 PolarHBondContact O-N 2.85Å; R118-T122 PolarHBondContact O-OG1 3.32Å; T119-T122 PolarHBondContact O-N 3.3Å; T122-A125 PolarHBondContact O-N 3.09Å; T122-F126 PolarHBondContact O-N 3.26Å; T122-S206 WeakPolarHBondContact CG2-O 3.41Å |
| 123 | L | 91.7 | Very high | 91.1 | Very high | 112 Ų | 112 | 58 Ų | 58 | 59% | 0.586 | 31% | 0.306 | S | S | * | . | H | α-helix | trans | -65 | -41.5 | 175.1 | -177 | 62.8 | 0 | 0 | 0 | 111.6 | T119 L120 F126 S127 | T119-L123 WeakPolarHBondContact O-CB 3.32Å; T119-L123 PolarHBondContact O-N 3.19Å; L120-L123 PolarHBondContact O-N 3.45Å; L123-F126 PolarHBondContact O-N 2.98Å; L123-S127 PolarHBondContact O-N 3.3Å; L123-S127 PolarHBondContact O-OG 3.44Å |
| 124 | A | 94.1 | Very high | 91.1 | Very high | 32 Ų | 32 | 55.4 Ų | 55.4 | 26% | 0.264 | 30% | 0.298 | S | S | . | . | H | α-helix | trans | -61.3 | -46.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 110.8 | V95 L120 L121 F126 S127 T128 | V95-A124 HydrophobicContact CG1-CB 3.79Å; L120-A124 WeakPolarHBondContact O-CB 3.17Å; L120-A124 PolarHBondContact O-N 2.83Å; L121-A124 PolarHBondContact O-N 2.89Å; A124-F126 VanDerWaalsContact C-N 3.27Å; A124-F126 PolarHBondContact O-N 3.02Å; A124-S127 PolarHBondContact O-N 3.3Å; A124-S127 PolarHBondContact O-OG 3.05Å; A124-T128 WeakPolarHBondContact O-CB 3.37Å; A124-T128 WeakPolarHBondContact O-CG2 3.47Å; A124-T128 PolarHBondContact O-N 3.33Å; A124-T128 PolarHBondContact O-OG1 3.26Å; A124-T128 VanDerWaalsContact O-OG1 3.11Å |
| 125 | A | 92 | Very high | 90.9 | Very high | 7 Ų | 7 | 54 Ų | 54 | 6% | 0.058 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -59.7 | -37.7 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | V95 A99 L121 T122 T128 A129 | V95-A125 HydrophobicContact CG1-CB 4.06Å; A99-A125 HydrophobicContact CB-CB 4.27Å; L121-A125 VanDerWaalsContact O-CB 3.32Å; L121-A125 WeakPolarHBondContact O-CB 3.44Å; L121-A125 PolarHBondContact O-N 3.45Å; T122-A125 PolarHBondContact O-N 3.09Å; A125-T128 WeakPolarHBondContact CA-OG1 3.19Å; A125-T128 PolarHBondContact O-OG1 3.42Å; A125-A129 WeakPolarHBondContact O-CB 3.3Å; A125-A129 PolarHBondContact O-N 3.44Å; A125-A129 VanDerWaalsContact O-N 3.11Å |
| 126 | F | 91 | Very high | 90.8 | Very high | 69 Ų | 69 | 54.8 Ų | 54.8 | 30% | 0.303 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -65.5 | -49.3 | 174.3 | 176.5 | -100.9 | 0 | 0 | 0 | 111.7 | T122 L123 A124 T128 A129 I130 L203 L207 | T122-F126 PolarHBondContact O-N 3.26Å; L123-F126 PolarHBondContact O-N 2.98Å; A124-F126 VanDerWaalsContact C-N 3.27Å; A124-F126 PolarHBondContact O-N 3.02Å; F126-T128 VanDerWaalsContact C-N 3.34Å; F126-T128 PolarHBondContact O-N 2.96Å; F126-A129 PolarHBondContact O-N 3.47Å; F126-I130 HydrophobicContact CD1-CD1 3.95Å; F126-I130 HydrophobicContact CE1-CD1 3.37Å; F126-I130 HydrophobicContact CE2-CD1 4.05Å; F126-I130 HydrophobicContact CZ-CD1 3.44Å; F126-I130 VanDerWaalsContact CZ-CD1 3.44Å; F126-I130 HydrophobicContact CZ-CG1 4.48Å; F126-I130 WeakPolarHBondContact O-CG1 3.49Å; F126-I130 PolarHBondContact O-N 3.27Å; F126-I130 VanDerWaalsContact O-N 3.12Å; F126-L203 HydrophobicContact CD2-CD2 3.8Å; F126-L203 HydrophobicContact CE2-CD2 4.09Å; F126-L203 WeakPolarHBondContact O-CD2 3.25Å; F126-L207 HydrophobicContact CD2-CD2 4.01Å; F126-L207 HydrophobicContact CD2-CG 4.23Å; F126-L207 HydrophobicContact CE2-CD1 4.31Å; F126-L207 HydrophobicContact CE2-CD2 3.69Å; F126-L207 HydrophobicContact CE2-CG 4.06Å; F126-L207 HydrophobicContact CZ-CD2 4.48Å |
| 127 | S | 92.9 | Very high | 90.6 | Very high | 63 Ų | 63 | 54.2 Ų | 54.2 | 44% | 0.441 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -66 | -37.8 | -179.7 | 67.6 | 0 | 0 | 0 | 0 | 112.1 | L123 A124 I130 A131 | L123-S127 PolarHBondContact O-N 3.3Å; L123-S127 PolarHBondContact O-OG 3.44Å; A124-S127 PolarHBondContact O-N 3.3Å; A124-S127 PolarHBondContact O-OG 3.05Å; S127-I130 PolarHBondContact O-N 2.86Å; S127-A131 WeakPolarHBondContact O-CB 3.44Å; S127-A131 PolarHBondContact O-N 2.97Å |
| 128 | T | 93.1 | Very high | 90 | Very high | 13 Ų | 13 | 54 Ų | 54 | 8% | 0.08 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -66.2 | -43.4 | 179.2 | 64.5 | 0 | 0 | 0 | 0 | 111.6 | W91 T92 V95 A124 A125 F126 I130 A131 A132 | W91-T128 HydrophobicContact CE3-CG2 3.52Å; W91-T128 HydrophobicContact CH2-CG2 4.41Å; W91-T128 WeakPolarHBondContact CH2-O 3.43Å; W91-T128 HydrophobicContact CZ3-CG2 3.24Å; T92-T128 WeakPolarHBondContact CG2-O 3.39Å; V95-T128 HydrophobicContact CB-CG2 4.28Å; V95-T128 HydrophobicContact CG1-CG2 4.21Å; V95-T128 HydrophobicContact CG2-CG2 4.1Å; A124-T128 WeakPolarHBondContact O-CB 3.37Å; A124-T128 WeakPolarHBondContact O-CG2 3.47Å; A124-T128 PolarHBondContact O-N 3.33Å; A124-T128 PolarHBondContact O-OG1 3.26Å; A124-T128 VanDerWaalsContact O-OG1 3.11Å; A125-T128 WeakPolarHBondContact CA-OG1 3.19Å; A125-T128 PolarHBondContact O-OG1 3.42Å; F126-T128 VanDerWaalsContact C-N 3.34Å; F126-T128 PolarHBondContact O-N 2.96Å; T128-I130 PolarHBondContact O-N 3.37Å; T128-A131 PolarHBondContact O-N 2.86Å; T128-A132 WeakPolarHBondContact O-CB 3.23Å; T128-A132 PolarHBondContact O-N 3.35Å |
| 129 | A | 91.6 | Very high | 89.3 | Confident | 1 Ų | 1 | 53 Ų | 53 | 1% | 0.008 | 29% | 0.286 | C | S | . | . | H | α-helix | trans | -66.6 | -37.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | A125 F126 A132 L133 L203 | A125-A129 WeakPolarHBondContact O-CB 3.3Å; A125-A129 PolarHBondContact O-N 3.44Å; A125-A129 VanDerWaalsContact O-N 3.11Å; F126-A129 PolarHBondContact O-N 3.47Å; A129-A132 PolarHBondContact O-N 3.44Å; A129-L133 WeakPolarHBondContact O-CG 3.46Å; A129-L133 PolarHBondContact O-N 3.5Å; A129-L203 HydrophobicContact CB-CD1 4.39Å; A129-L203 HydrophobicContact CB-CD2 3.54Å; A129-L203 HydrophobicContact CB-CG 3.6Å |
| 130 | I | 91.8 | Very high | 88.7 | Confident | 62 Ų | 62 | 54.4 Ų | 54.4 | 32% | 0.318 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -61.6 | -46.9 | 172 | -69.8 | 174.9 | 0 | 0 | 0 | 111.2 | F126 S127 T128 A132 L133 K134 L203 | F126-I130 HydrophobicContact CD1-CD1 3.95Å; F126-I130 HydrophobicContact CE1-CD1 3.37Å; F126-I130 HydrophobicContact CE2-CD1 4.05Å; F126-I130 HydrophobicContact CZ-CD1 3.44Å; F126-I130 VanDerWaalsContact CZ-CD1 3.44Å; F126-I130 HydrophobicContact CZ-CG1 4.48Å; F126-I130 WeakPolarHBondContact O-CG1 3.49Å; F126-I130 PolarHBondContact O-N 3.27Å; F126-I130 VanDerWaalsContact O-N 3.12Å; S127-I130 PolarHBondContact O-N 2.86Å; T128-I130 PolarHBondContact O-N 3.37Å; I130-A132 VanDerWaalsContact C-N 3.32Å; I130-A132 PolarHBondContact O-N 3.49Å; I130-L133 PolarHBondContact O-N 3.35Å; I130-K134 PolarHBondContact O-N 3.18Å; I130-L203 HydrophobicContact CG1-CD2 3.79Å |
| 131 | A | 92.6 | Very high | 87.5 | Confident | 38 Ų | 38 | 56.8 Ų | 56.8 | 31% | 0.314 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -65 | -37.2 | -179.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | W91 S127 T128 K134 L135 | W91-A131 HydrophobicContact CH2-CB 3.72Å; W91-A131 HydrophobicContact CZ2-CB 4.48Å; S127-A131 WeakPolarHBondContact O-CB 3.44Å; S127-A131 PolarHBondContact O-N 2.97Å; T128-A131 PolarHBondContact O-N 2.86Å; A131-K134 PolarHBondContact O-N 3.46Å; A131-L135 WeakPolarHBondContact O-CG 3.32Å; A131-L135 PolarHBondContact O-N 2.84Å |
| 132 | A | 90.8 | Very high | 86 | Confident | 0 Ų | 0 | 62.8 Ų | 62.8 | 0% | 0 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -64.8 | -39.7 | 172.3 | 0 | 0 | 0 | 0 | 0 | 113 | A88 T92 T128 A129 I130 K134 L135 W136 W199 | A88-A132 HydrophobicContact CB-CB 4.2Å; T92-A132 HydrophobicContact CG2-CB 3.55Å; T128-A132 WeakPolarHBondContact O-CB 3.23Å; T128-A132 PolarHBondContact O-N 3.35Å; A129-A132 PolarHBondContact O-N 3.44Å; I130-A132 VanDerWaalsContact C-N 3.32Å; I130-A132 PolarHBondContact O-N 3.49Å; A132-K134 VanDerWaalsContact C-N 3.3Å; A132-K134 PolarHBondContact O-N 3.12Å; A132-L135 PolarHBondContact O-N 3.38Å; A132-W136 WeakPolarHBondContact O-CB 3.32Å; A132-W136 PolarHBondContact O-N 2.98Å; A132-W199 HydrophobicContact CB-CD2 3.82Å; A132-W199 HydrophobicContact CB-CE3 4.08Å; A132-W199 HydrophobicContact CB-CG 4.34Å; A132-W199 HydrophobicContact CB-CH2 4.2Å; A132-W199 HydrophobicContact CB-CZ2 3.93Å; A132-W199 HydrophobicContact CB-CZ3 4.29Å |
| 133 | L | 90.3 | Very high | 84.6 | Confident | 48 Ų | 48 | 64.4 Ų | 64.4 | 25% | 0.251 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -60.6 | -39 | 172.7 | -72.1 | -174.6 | 0 | 0 | 0 | 112.4 | A129 I130 W136 N137 L196 W199 I200 L203 | A129-L133 WeakPolarHBondContact O-CG 3.46Å; A129-L133 PolarHBondContact O-N 3.5Å; I130-L133 PolarHBondContact O-N 3.35Å; L133-W136 PolarHBondContact O-N 3.34Å; L133-N137 WeakPolarHBondContact O-CB 3.49Å; L133-N137 PolarHBondContact O-N 3.07Å; L133-L196 HydrophobicContact CD2-CD1 3.41Å; L133-L196 VanDerWaalsContact CD2-CD1 3.41Å; L133-W199 HydrophobicContact CD2-CB 4.15Å; L133-I200 HydrophobicContact CD2-CG1 4.24Å; L133-L203 HydrophobicContact CD1-CD1 3.31Å; L133-L203 HydrophobicContact CG-CD1 4.16Å |
| 134 | K | 89 | Confident | 82.9 | Confident | 149 Ų | 149 | 65.9 Ų | 65.9 | 65% | 0.648 | 33% | 0.325 | S | S | * | . | H | α-helix | trans | -65.1 | -46.9 | 175.4 | -72.8 | -173.7 | 175.1 | -173.9 | 0 | 111.7 | I130 A131 A132 W136 N137 E138 | I130-K134 PolarHBondContact O-N 3.18Å; A131-K134 PolarHBondContact O-N 3.46Å; A132-K134 VanDerWaalsContact C-N 3.3Å; A132-K134 PolarHBondContact O-N 3.12Å; K134-W136 VanDerWaalsContact C-N 3.29Å; K134-W136 PolarHBondContact O-N 3.33Å; K134-N137 PolarHBondContact O-N 3.39Å; K134-E138 PolarHBondContact O-N 3.24Å; K134-E138 VanDerWaalsContact O-N 3.12Å |
| 135 | L | 86.9 | Confident | 81 | Confident | 53 Ų | 53 | 67 Ų | 67 | 28% | 0.277 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -61.8 | -39.3 | 177.2 | -71.2 | 168.5 | 0 | 0 | 0 | 111.9 | A88 W91 A131 A132 E138 D139 | A88-L135 HydrophobicContact CB-CD1 3.56Å; W91-L135 HydrophobicContact CZ2-CD1 4.25Å; A131-L135 WeakPolarHBondContact O-CG 3.32Å; A131-L135 PolarHBondContact O-N 2.84Å; A132-L135 PolarHBondContact O-N 3.38Å; L135-E138 PolarHBondContact O-N 3.27Å; L135-D139 WeakPolarHBondContact O-CB 3.31Å; L135-D139 PolarHBondContact O-N 2.97Å |
| 136 | W | 84.7 | Confident | 79.2 | Confident | 44 Ų | 44 | 69 Ų | 69 | 17% | 0.167 | 34% | 0.338 | C | S | . | . | H | α-helix | trans | -60.2 | -46.9 | 174.4 | -177.1 | 82 | 0 | 0 | 0 | 112.2 | A132 L133 K134 E138 D139 F140 L196 W199 | A132-W136 WeakPolarHBondContact O-CB 3.32Å; A132-W136 PolarHBondContact O-N 2.98Å; L133-W136 PolarHBondContact O-N 3.34Å; K134-W136 VanDerWaalsContact C-N 3.29Å; K134-W136 PolarHBondContact O-N 3.33Å; W136-E138 VanDerWaalsContact C-N 3.27Å; W136-E138 PolarHBondContact O-N 3.25Å; W136-D139 PolarHBondContact O-N 3.12Å; W136-F140 HydrophobicContact CH2-CB 4.4Å; W136-F140 HydrophobicContact CH2-CD2 4.13Å; W136-F140 HydrophobicContact CH2-CG 4.12Å; W136-F140 HydrophobicContact CZ2-CB 4.39Å; W136-F140 AromaticContact CZ2-CD2 3.83Å; W136-F140 HydrophobicContact CZ2-CD2 3.83Å; W136-F140 HydrophobicContact CZ2-CE2 4.4Å; W136-F140 HydrophobicContact CZ2-CG 4.2Å; W136-F140 WeakPolarHBondContact O-CB 3.29Å; W136-F140 PolarHBondContact O-N 2.97Å; W136-L196 HydrophobicContact CD2-CD1 3.81Å; W136-L196 HydrophobicContact CD2-CD2 4.41Å; W136-L196 HydrophobicContact CE3-CD1 3.91Å; W136-L196 HydrophobicContact CE3-CD2 4.45Å; W136-L196 HydrophobicContact CG-CD1 4.23Å; W136-L196 HydrophobicContact CH2-CD2 3.72Å; W136-L196 HydrophobicContact CZ2-CD2 3.65Å; W136-L196 HydrophobicContact CZ2-CG 4.46Å; W136-L196 HydrophobicContact CZ3-CD1 4.32Å; W136-L196 HydrophobicContact CZ3-CD2 4.12Å; W136-W199 HydrophobicContact CB-CE3 4.37Å; W136-W199 HydrophobicContact CB-CZ3 3.77Å; W136-W199 AromaticContact CD1-CZ3 3.92Å; W136-W199 HydrophobicContact CG-CZ3 4.11Å |
| 137 | N | 85 | Confident | 77.8 | Confident | 91 Ų | 91 | 73.2 Ų | 73.2 | 49% | 0.487 | 35% | 0.353 | S | S | . | . | H | α-helix | trans | -62.3 | -38.1 | -179.7 | -174.7 | 68.6 | 0 | 0 | 0 | 111.7 | L133 K134 R141 | L133-N137 WeakPolarHBondContact O-CB 3.49Å; L133-N137 PolarHBondContact O-N 3.07Å; K134-N137 PolarHBondContact O-N 3.39Å; N137-R141 PolarHBondContact O-N 2.94Å |
| 138 | E | 78.7 | Confident | 76.2 | Confident | 68 Ų | 68 | 73.8 Ų | 73.8 | 32% | 0.318 | 35% | 0.351 | S | S | . | . | H | α-helix | trans | -67.1 | -49.2 | 173.5 | -69.5 | -59.3 | 148.5 | 0 | 0 | 111.8 | L82 K134 L135 W136 F140 R141 Y142 | L82-E138 HydrophobicContact CD2-CB 4.33Å; K134-E138 PolarHBondContact O-N 3.24Å; K134-E138 VanDerWaalsContact O-N 3.12Å; L135-E138 PolarHBondContact O-N 3.27Å; W136-E138 VanDerWaalsContact C-N 3.27Å; W136-E138 PolarHBondContact O-N 3.25Å; E138-F140 VanDerWaalsContact C-N 3.28Å; E138-F140 PolarHBondContact O-N 3.2Å; E138-R141 PolarHBondContact O-N 3.4Å; E138-R141 VanDerWaalsContact O-N 3.12Å; E138-R141 IonicContact OE1-NH2 3.72Å; E138-R141 IonicContact OE2-CZ 3.45Å; E138-R141 IonicContact OE2-NE 3.52Å; E138-R141 IonicContact OE2-NH2 2.71Å; E138-R141 PolarHBondContact OE2-NH2 2.92Å; E138-Y142 VanDerWaalsContact O-CD2 3.22Å; E138-Y142 WeakPolarHBondContact O-CD2 3.32Å; E138-Y142 PolarHBondContact O-N 3.46Å; E138-Y142 VanDerWaalsContact O-N 3.07Å |
| 139 | D | 75.8 | Confident | 74.8 | Confident | 10 Ų | 10 | 76.4 Ų | 76.4 | 5% | 0.053 | 37% | 0.37 | C | S | . | . | H | α-helix | trans | -59.4 | -39.7 | 178.3 | -171.9 | 78.4 | 0 | 0 | 0 | 111.9 | L82 L83 L135 W136 R141 Y142 G143 Q192 | L82-D139 HydrophobicContact CB-CB 4.43Å; L82-D139 WeakPolarHBondContact CB-OD1 3.36Å; L82-D139 HydrophobicContact CD2-CB 4.49Å; L82-D139 PolarHBondContact N-OD1 3.5Å; L83-D139 HydrophobicContact CD1-CB 4.25Å; L83-D139 PolarHBondContact N-OD1 3.4Å; L135-D139 WeakPolarHBondContact O-CB 3.31Å; L135-D139 PolarHBondContact O-N 2.97Å; W136-D139 PolarHBondContact O-N 3.12Å; D139-R141 VanDerWaalsContact C-N 3.34Å; D139-R141 PolarHBondContact O-N 3.18Å; D139-Y142 PolarHBondContact O-N 3.49Å; D139-G143 PolarHBondContact O-N 3.32Å; D139-Q192 PolarHBondContact OD2-NE2 2.93Å; D139-Q192 VanDerWaalsContact OD2-NE2 3.08Å |
| 140 | F | 74.1 | Confident | 73.7 | Confident | 121 Ų | 121 | 79.8 Ų | 79.8 | 53% | 0.531 | 40% | 0.398 | S | S | . | . | H | α-helix | trans | -63.3 | -40 | 177 | -169.1 | -97.3 | 0 | 0 | 0 | 112 | W136 E138 G143 | W136-F140 HydrophobicContact CH2-CB 4.4Å; W136-F140 HydrophobicContact CH2-CD2 4.13Å; W136-F140 HydrophobicContact CH2-CG 4.12Å; W136-F140 HydrophobicContact CZ2-CB 4.39Å; W136-F140 AromaticContact CZ2-CD2 3.83Å; W136-F140 HydrophobicContact CZ2-CD2 3.83Å; W136-F140 HydrophobicContact CZ2-CE2 4.4Å; W136-F140 HydrophobicContact CZ2-CG 4.2Å; W136-F140 WeakPolarHBondContact O-CB 3.29Å; W136-F140 PolarHBondContact O-N 2.97Å; E138-F140 VanDerWaalsContact C-N 3.28Å; E138-F140 PolarHBondContact O-N 3.2Å; F140-G143 PolarHBondContact O-N 3.23Å |
| 141 | R | 68 | Low | 73 | Confident | 163 Ų | 163 | 77.5 Ų | 77.5 | 62% | 0.615 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -67.3 | -38.6 | 177.8 | -174.1 | 174.9 | 65.5 | 156.2 | -1.7 | 112.2 | N137 E138 D139 G143 | N137-R141 PolarHBondContact O-N 2.94Å; E138-R141 PolarHBondContact O-N 3.4Å; E138-R141 VanDerWaalsContact O-N 3.12Å; E138-R141 IonicContact OE1-NH2 3.72Å; E138-R141 IonicContact OE2-CZ 3.45Å; E138-R141 IonicContact OE2-NE 3.52Å; E138-R141 IonicContact OE2-NH2 2.71Å; E138-R141 PolarHBondContact OE2-NH2 2.92Å; D139-R141 VanDerWaalsContact C-N 3.34Å; D139-R141 PolarHBondContact O-N 3.18Å; R141-G143 PolarHBondContact O-N 3.23Å |
| 142 | Y | 63 | Low | 71.8 | Confident | 157 Ų | 157 | 83.7 Ų | 83.7 | 62% | 0.616 | 40% | 0.402 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75.1 | -4.8 | 177 | -77 | -73.5 | 0 | 0 | 0 | 113.7 | E138 D139 Y144 | E138-Y142 VanDerWaalsContact O-CD2 3.22Å; E138-Y142 WeakPolarHBondContact O-CD2 3.32Å; E138-Y142 PolarHBondContact O-N 3.46Å; E138-Y142 VanDerWaalsContact O-N 3.07Å; D139-Y142 PolarHBondContact O-N 3.49Å; Y142-Y144 PolarHBondContact O-N 2.93Å; Y142-Y144 VanDerWaalsContact O-N 3.08Å |
| 143 | G | 58.6 | Low | 70.4 | Confident | 51 Ų | 51 | 89 Ų | 89 | 53% | 0.526 | 43% | 0.429 | S | S | . | . | trans | 38.8 | 62.7 | 157.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | D139 F140 R141 S145 | D139-G143 PolarHBondContact O-N 3.32Å; F140-G143 PolarHBondContact O-N 3.23Å; R141-G143 PolarHBondContact O-N 3.23Å; G143-S145 PolarHBondContact O-N 3.45Å | ||
| 144 | Y | 56.9 | Low | 68.7 | Low | 143 Ų | 143 | 91.8 Ų | 91.8 | 56% | 0.561 | 45% | 0.453 | S | S | * | . | trans | -59 | 104.5 | -177.7 | -117.7 | -90.5 | 0 | 0 | 0 | 109.4 | Y142 Y146 | Y142-Y144 PolarHBondContact O-N 2.93Å; Y142-Y144 VanDerWaalsContact O-N 3.08Å; Y144-Y146 PolarHBondContact O-N 2.86Å; Y144-Y146 VanDerWaalsContact O-N 3.14Å | ||
| 145 | S | 54.2 | Low | 66.6 | Low | 55 Ų | 55 | 89.5 Ų | 89.5 | 39% | 0.385 | 46% | 0.456 | S | S | . | . | trans | -67.4 | 111.6 | 171.2 | -169.6 | 0 | 0 | 0 | 0 | 106.4 | G143 Y147 | G143-S145 PolarHBondContact O-N 3.45Å; S145-Y147 VanDerWaalsContact C-N 3.26Å; S145-Y147 VanDerWaalsContact O-CD2 3.27Å; S145-Y147 WeakPolarHBondContact O-CD2 3.33Å; S145-Y147 PolarHBondContact O-N 3.2Å | ||
| 146 | Y | 55.2 | Low | 64.5 | Low | 49 Ų | 49 | 90.6 Ų | 90.6 | 19% | 0.192 | 47% | 0.468 | C | S | . | . | trans | -55.9 | 104.8 | 158.5 | -126.8 | -85 | 0 | 0 | 0 | 104.9 | R78 Y144 N148 M181 L184 F188 | R78-Y146 HydrophobicContact CG-CE2 4.47Å; Y144-Y146 PolarHBondContact O-N 2.86Å; Y144-Y146 VanDerWaalsContact O-N 3.14Å; Y146-N148 PolarHBondContact O-N 2.92Å; Y146-N148 VanDerWaalsContact O-N 3.14Å; Y146-M181 HydrophobicContact CD1-CG 4.46Å; Y146-M181 HydrophobicContact CD1-SD 3.53Å; Y146-M181 VanDerWaalsContact CD1-SD 3.53Å; Y146-M181 HydrophobicContact CE1-CE 4.42Å; Y146-M181 HydrophobicContact CE1-SD 3.32Å; Y146-M181 WeakPolarHBondContact CE1-SD 3.48Å; Y146-L184 HydrophobicContact CE1-CD2 4.07Å; Y146-L184 HydrophobicContact CE2-CD2 4.23Å; Y146-L184 VanDerWaalsContact OH-CD2 3.27Å; Y146-L184 WeakPolarHBondContact OH-CD2 3.41Å; Y146-F188 HydrophobicContact CE2-CD2 4.34Å; Y146-F188 HydrophobicContact CE2-CE2 4.32Å | ||
| 147 | Y | 59.6 | Low | 62.6 | Low | 158 Ų | 158 | 92.5 Ų | 92.5 | 62% | 0.62 | 49% | 0.488 | S | S | * | . | trans | -72.2 | 118.6 | -174.9 | -74.2 | -87.3 | 0 | 0 | 0 | 107 | S145 S149 A150 | S145-Y147 VanDerWaalsContact C-N 3.26Å; S145-Y147 VanDerWaalsContact O-CD2 3.27Å; S145-Y147 WeakPolarHBondContact O-CD2 3.33Å; S145-Y147 PolarHBondContact O-N 3.2Å; Y147-S149 WeakPolarHBondContact CB-OG 3.45Å; Y147-S149 PolarHBondContact O-N 2.86Å; Y147-A150 PolarHBondContact O-N 2.84Å | ||
| 148 | N | 59.9 | Low | 61 | Low | 75 Ų | 75 | 95.9 Ų | 95.9 | 40% | 0.401 | 51% | 0.506 | S | S | . | . | G | 310 helix | trans | -54.9 | -10.4 | 163.5 | -67.7 | -16.6 | 0 | 0 | 0 | 111.5 | Y146 A150 C151 | Y146-N148 PolarHBondContact O-N 2.92Å; Y146-N148 VanDerWaalsContact O-N 3.14Å; N148-A150 PolarHBondContact O-N 3.39Å; N148-C151 WeakPolarHBondContact O-CB 3.48Å; N148-C151 PolarHBondContact O-N 3.48Å; N148-C151 VanDerWaalsContact O-N 3.11Å |
| 149 | S | 64.5 | Low | 59.5 | Low | 69 Ų | 69 | 101.9 Ų | 101.9 | 48% | 0.483 | 53% | 0.526 | S | S | . | . | G | 310 helix | trans | -59.5 | -28.6 | 168.4 | 72.3 | 0 | 0 | 0 | 0 | 113.2 | Y147 C151 R152 | Y147-S149 WeakPolarHBondContact CB-OG 3.45Å; Y147-S149 PolarHBondContact O-N 2.86Å; S149-C151 PolarHBondContact O-N 3.43Å; S149-R152 WeakPolarHBondContact O-CB 3.4Å; S149-R152 PolarHBondContact O-N 2.97Å; S149-R152 VanDerWaalsContact O-O 3.06Å |
| 150 | A | 68.6 | Low | 58.6 | Low | 72 Ų | 72 | 109.8 Ų | 109.8 | 60% | 0.595 | 57% | 0.568 | S | S | * | * | G | 310 helix | trans | -62.9 | -24.9 | 174.7 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y147 N148 R152 | Y147-A150 PolarHBondContact O-N 2.84Å; N148-A150 PolarHBondContact O-N 3.39Å; A150-R152 VanDerWaalsContact C-N 3.35Å |
| 151 | C | 75.6 | Confident | 57.6 | Low | 13 Ų | 13 | 108.7 Ų | 108.7 | 9% | 0.088 | 57% | 0.571 | C | S | . | * | G | 310 helix | trans | -80.9 | -16.8 | 174.3 | -66.3 | 0 | 0 | 0 | 0 | 113.3 | N148 S149 I153 L174 C177 | N148-C151 WeakPolarHBondContact O-CB 3.48Å; N148-C151 PolarHBondContact O-N 3.48Å; N148-C151 VanDerWaalsContact O-N 3.11Å; S149-C151 PolarHBondContact O-N 3.43Å; C151-I153 PolarHBondContact O-N 3.24Å; C151-L174 HydrophobicContact CB-CD1 3.79Å; C151-C177 WeakPolarHBondContact CA-SG 3.34Å; C151-C177 HydrophobicContact CB-CB 3.63Å; C151-C177 WeakPolarHBondContact CB-SG 3.38Å; C151-C177 WeakPolarHBondContact SG-CB 3.12Å; C151-C177 CovalentContact SG-SG 2.04Å; C151-C177 PolarHBondContact SG-SG 2.95Å |
| 152 | R | 67.8 | Low | 57.1 | Low | 169 Ų | 169 | 106.2 Ų | 106.2 | 64% | 0.638 | 58% | 0.577 | S | S | * | * | S | Bend | trans | -85.1 | 111.6 | 171.4 | -60.1 | -176.4 | 79.5 | 169.3 | 2.7 | 106.7 | S149 A150 S154 L174 | S149-R152 WeakPolarHBondContact O-CB 3.4Å; S149-R152 PolarHBondContact O-N 2.97Å; S149-R152 VanDerWaalsContact O-O 3.06Å; A150-R152 VanDerWaalsContact C-N 3.35Å; R152-S154 PolarHBondContact O-N 3.42Å; R152-L174 HydrophobicContact CG-CD1 4.26Å |
| 153 | I | 62.7 | Low | 57 | Low | 110 Ų | 110 | 102.7 Ų | 102.7 | 56% | 0.564 | 58% | 0.58 | S | S | * | * | trans | -61.5 | 114.1 | 160 | -65.1 | 163.3 | 0 | 0 | 0 | 104.9 | C151 S155 R173 | C151-I153 PolarHBondContact O-N 3.24Å; I153-S155 PolarHBondContact O-N 3.06Å; I153-R173 VanDerWaalsContact CD1-NH1 3.28Å; I153-R173 VanDerWaalsContact CD1-NH2 3.33Å | ||
| 154 | S | 53.2 | Low | 57.1 | Low | 107 Ų | 107 | 104.6 Ų | 104.6 | 75% | 0.748 | 58% | 0.583 | S | S | * | * | trans | -62.2 | 88 | 170.8 | -63.2 | 0 | 0 | 0 | 0 | 108.4 | R152 S156 | R152-S154 PolarHBondContact O-N 3.42Å; S154-S156 PolarHBondContact O-N 3.2Å | ||
| 155 | S | 46.2 | Very low | 57.5 | Low | 102 Ų | 102 | 104.6 Ų | 104.6 | 71% | 0.713 | 60% | 0.598 | S | S | * | * | trans | -80.5 | 9.1 | 163.4 | 64.9 | 0 | 0 | 0 | 0 | 111.9 | I153 | I153-S155 PolarHBondContact O-N 3.06Š| ||
| 156 | S | 42.8 | Very low | 58.2 | Low | 76 Ų | 76 | 107 Ų | 107 | 53% | 0.531 | 60% | 0.603 | S | S | . | * | trans | -127.8 | 86.7 | 179.8 | -177.4 | 0 | 0 | 0 | 0 | 108.9 | S154 D158 | S154-S156 PolarHBondContact O-N 3.2Å; S156-D158 PolarHBondContact O-N 3.22Å | ||
| 157 | S | 44.2 | Very low | 59.2 | Low | 84 Ų | 84 | 106.5 Ų | 106.5 | 59% | 0.587 | 61% | 0.607 | S | S | * | * | S | Bend | trans | -69 | 101.2 | 152.5 | 53.9 | 0 | 0 | 0 | 0 | 107.1 | W159 | S157-W159 PolarHBondContact O-N 3.22Š|
| 158 | D | 51.9 | Low | 60.3 | Low | 161 Ų | 161 | 104.4 Ų | 104.4 | 86% | 0.861 | 61% | 0.613 | S | S | * | * | S | Bend | trans | 53.4 | 5.8 | 154.8 | -63 | -40.9 | 0 | 0 | 0 | 120 | S156 | S156-D158 PolarHBondContact O-N 3.22Š|
| 159 | W | 47.8 | Very low | 61.4 | Low | 194 Ų | 194 | 108.5 Ų | 108.5 | 74% | 0.735 | 63% | 0.63 | S | S | * | * | trans | -110.3 | 134.6 | -176.4 | -66.4 | -5.2 | 0 | 0 | 0 | 111 | S157 T161 | S157-W159 PolarHBondContact O-N 3.22Å; W159-T161 PolarHBondContact O-N 3.38Å | ||
| 160 | N | 55.5 | Low | 62.1 | Low | 176 Ų | 176 | 109.9 Ų | 109.9 | 94% | 0.941 | 63% | 0.628 | S | S | * | * | trans | -62 | 25.6 | 178.5 | -78.5 | -37.7 | 0 | 0 | 0 | 114.8 | ||||
| 161 | T | 53.9 | Low | 62.8 | Low | 98 Ų | 98 | 109.9 Ų | 109.9 | 60% | 0.601 | 62% | 0.621 | S | S | * | * | P | Polyproline II helix | trans | -73.5 | 128.9 | -179.1 | -40 | 0 | 0 | 0 | 0 | 109.2 | W159 A163 | W159-T161 PolarHBondContact O-N 3.38Å; T161-A163 PolarHBondContact O-N 2.89Å |
| 162 | P | 57.1 | Low | 63.3 | Low | 112 Ų | 112 | 118.9 Ų | 118.9 | 73% | 0.727 | 65% | 0.653 | S | S | * | * | P | Polyproline II helix | trans | -53.1 | 133.7 | 174.9 | -22.4 | 31.1 | 0 | 0 | 0 | 110 | ||
| 163 | A | 60.3 | Low | 64.1 | Low | 83 Ų | 83 | 118.4 Ų | 118.4 | 69% | 0.686 | 65% | 0.651 | S | S | * | * | P | Polyproline II helix | trans | -56.8 | 128.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 109 | T161 | T161-A163 PolarHBondContact O-N 2.89Š|
| 164 | P | 61.8 | Low | 65.1 | Low | 91 Ų | 91 | 115.7 Ų | 115.7 | 59% | 0.591 | 64% | 0.638 | S | S | * | * | P | Polyproline II helix | trans | -57 | 144 | 175.8 | 21.5 | -30 | 0 | 0 | 0 | 109.5 | Q166 | P164-Q166 PolarHBondContact O-N 3.23Š|
| 165 | T | 65.5 | Low | 66.8 | Low | 143 Ų | 143 | 117.5 Ų | 117.5 | 88% | 0.877 | 63% | 0.634 | S | S | * | * | trans | -52.9 | 115.5 | 174 | -55.5 | 0 | 0 | 0 | 0 | 108.5 | S167 | T165-S167 PolarHBondContact O-N 2.82Š| ||
| 166 | Q | 68.2 | Low | 68.8 | Low | 104 Ų | 104 | 117.5 Ų | 117.5 | 49% | 0.486 | 63% | 0.625 | S | S | . | * | trans | -57.9 | 127.5 | -174.1 | -68.4 | 180 | 33.3 | 0 | 0 | 109.9 | P164 E170 V171 | P164-Q166 PolarHBondContact O-N 3.23Å; Q166-E170 WeakPolarHBondContact CA-OE2 3.22Å; Q166-V171 HydrophobicContact CB-CG2 3.81Å | ||
| 167 | S | 76.6 | Confident | 71 | Confident | 40 Ų | 40 | 115.4 Ų | 115.4 | 28% | 0.28 | 61% | 0.61 | S | S | . | * | trans | -66 | 150.6 | 174 | 71.7 | 0 | 0 | 0 | 0 | 109.4 | T165 E169 E170 V171 | T165-S167 PolarHBondContact O-N 2.82Å; S167-E169 PolarHBondContact O-N 3.49Å; S167-E169 VanDerWaalsContact O-N 3.09Å; S167-E170 PolarHBondContact N-OE2 3.12Å; S167-E170 WeakPolarHBondContact O-CB 3.49Å; S167-E170 PolarHBondContact O-N 3.02Å; S167-E170 WeakPolarHBondContact OG-CB 3.46Å; S167-E170 VanDerWaalsContact OG-CG 3.29Å; S167-E170 WeakPolarHBondContact OG-CG 3.14Å; S167-E170 PolarHBondContact OG-N 3.03Å; S167-E170 VanDerWaalsContact OG-N 3.11Å; S167-V171 PolarHBondContact O-N 3.15Å; S167-V171 VanDerWaalsContact O-N 3.08Å | ||
| 168 | P | 82.5 | Confident | 72.9 | Confident | 114 Ų | 114 | 113 Ų | 113 | 74% | 0.74 | 59% | 0.592 | S | S | * | * | H | α-helix | trans | -53.9 | -30.5 | 174.3 | -26.7 | 34.5 | 0 | 0 | 0 | 113 | R172 | P168-R172 WeakPolarHBondContact O-CB 3.25Å; P168-R172 PolarHBondContact O-N 2.67Å; P168-R172 VanDerWaalsContact O-N 3.08Å |
| 169 | E | 82.2 | Confident | 74.6 | Confident | 160 Ų | 160 | 107.8 Ų | 107.8 | 75% | 0.748 | 57% | 0.568 | S | S | * | * | H | α-helix | trans | -69.5 | -42.1 | 175.6 | -63.5 | -177 | 175.5 | 0 | 0 | 112.5 | S167 R172 R173 | S167-E169 PolarHBondContact O-N 3.49Å; S167-E169 VanDerWaalsContact O-N 3.09Å; E169-R172 PolarHBondContact O-N 2.86Å; E169-R173 WeakPolarHBondContact O-CB 3.39Å; E169-R173 PolarHBondContact O-N 3.38Å |
| 170 | E | 80.1 | Confident | 76.6 | Confident | 98 Ų | 98 | 104.3 Ų | 104.3 | 46% | 0.458 | 56% | 0.559 | S | S | . | * | H | α-helix | trans | -63.3 | -43 | 175.4 | -79.2 | 172 | 179.1 | 0 | 0 | 111.8 | Q166 S167 R172 R173 L174 | Q166-E170 WeakPolarHBondContact CA-OE2 3.22Å; S167-E170 PolarHBondContact N-OE2 3.12Å; S167-E170 WeakPolarHBondContact O-CB 3.49Å; S167-E170 PolarHBondContact O-N 3.02Å; S167-E170 WeakPolarHBondContact OG-CB 3.46Å; S167-E170 VanDerWaalsContact OG-CG 3.29Å; S167-E170 WeakPolarHBondContact OG-CG 3.14Å; S167-E170 PolarHBondContact OG-N 3.03Å; S167-E170 VanDerWaalsContact OG-N 3.11Å; E170-R172 VanDerWaalsContact C-N 3.34Å; E170-R172 PolarHBondContact O-N 3.3Å; E170-R173 PolarHBondContact O-N 2.84Å; E170-L174 WeakPolarHBondContact O-CB 3.41Å; E170-L174 PolarHBondContact O-N 3.27Å |
| 171 | V | 83 | Confident | 77.9 | Confident | 72 Ų | 72 | 97.9 Ų | 97.9 | 44% | 0.436 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -60.8 | -46.2 | 175.4 | 177.9 | 0 | 0 | 0 | 0 | 110.3 | Q166 S167 R173 L174 H175 | Q166-V171 HydrophobicContact CB-CG2 3.81Å; S167-V171 PolarHBondContact O-N 3.15Å; S167-V171 VanDerWaalsContact O-N 3.08Å; V171-R173 VanDerWaalsContact C-N 3.34Å; V171-R173 PolarHBondContact O-N 3.31Å; V171-L174 PolarHBondContact O-N 3.3Å; V171-H175 WeakPolarHBondContact O-CB 3.41Å; V171-H175 PolarHBondContact O-N 3.24Å |
| 172 | R | 85 | Confident | 79.4 | Confident | 203 Ų | 203 | 97 Ų | 97 | 77% | 0.766 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -61.3 | -42.7 | 177.8 | -173.3 | 178.7 | -176.1 | 178.6 | 1.7 | 111.6 | P168 E169 E170 L176 | P168-R172 WeakPolarHBondContact O-CB 3.25Å; P168-R172 PolarHBondContact O-N 2.67Å; P168-R172 VanDerWaalsContact O-N 3.08Å; E169-R172 PolarHBondContact O-N 2.86Å; E170-R172 VanDerWaalsContact C-N 3.34Å; E170-R172 PolarHBondContact O-N 3.3Å; R172-L176 WeakPolarHBondContact O-CB 3.37Å; R172-L176 PolarHBondContact O-N 3.05Å |
| 173 | R | 85.1 | Confident | 80.9 | Confident | 159 Ų | 159 | 96.8 Ų | 96.8 | 60% | 0.6 | 51% | 0.506 | S | S | * | . | H | α-helix | trans | -63.2 | -46.2 | 176.7 | 179.4 | -177.1 | 174.3 | 167.2 | 1.5 | 111.6 | I153 E169 E170 V171 H175 L176 C177 | I153-R173 VanDerWaalsContact CD1-NH1 3.28Å; I153-R173 VanDerWaalsContact CD1-NH2 3.33Å; E169-R173 WeakPolarHBondContact O-CB 3.39Å; E169-R173 PolarHBondContact O-N 3.38Å; E170-R173 PolarHBondContact O-N 2.84Å; V171-R173 VanDerWaalsContact C-N 3.34Å; V171-R173 PolarHBondContact O-N 3.31Å; R173-H175 VanDerWaalsContact C-N 3.34Å; R173-H175 PolarHBondContact O-N 3.44Å; R173-L176 PolarHBondContact O-N 3.12Å; R173-C177 WeakPolarHBondContact O-CB 3.28Å; R173-C177 PolarHBondContact O-N 2.96Å |
| 174 | L | 85.1 | Confident | 82 | Confident | 53 Ų | 53 | 95.7 Ų | 95.7 | 28% | 0.277 | 49% | 0.488 | S | S | . | . | H | α-helix | trans | -62.3 | -43.2 | 179.7 | -176 | 68.2 | 0 | 0 | 0 | 110.9 | C151 R152 E170 V171 C177 T178 | C151-L174 HydrophobicContact CB-CD1 3.79Å; R152-L174 HydrophobicContact CG-CD1 4.26Å; E170-L174 WeakPolarHBondContact O-CB 3.41Å; E170-L174 PolarHBondContact O-N 3.27Å; V171-L174 PolarHBondContact O-N 3.3Å; L174-C177 PolarHBondContact O-N 3.23Å; L174-T178 WeakPolarHBondContact O-CB 3.28Å; L174-T178 PolarHBondContact O-N 3.44Å; L174-T178 PolarHBondContact O-OG1 3.02Å |
| 175 | H | 87 | Confident | 83 | Confident | 144 Ų | 144 | 94.8 Ų | 94.8 | 67% | 0.667 | 48% | 0.475 | S | S | * | . | H | α-helix | trans | -62.1 | -44.9 | 176.3 | -173.4 | -79.6 | 0 | 0 | 0 | 111.8 | V171 R173 T178 S179 | V171-H175 WeakPolarHBondContact O-CB 3.41Å; V171-H175 PolarHBondContact O-N 3.24Å; R173-H175 VanDerWaalsContact C-N 3.34Å; R173-H175 PolarHBondContact O-N 3.44Å; H175-T178 PolarHBondContact O-N 3.39Å; H175-S179 WeakPolarHBondContact O-CB 3.22Å; H175-S179 PolarHBondContact O-N 3.24Å |
| 176 | L | 89.6 | Confident | 84 | Confident | 102 Ų | 102 | 90.6 Ų | 90.6 | 53% | 0.534 | 45% | 0.454 | S | S | . | . | H | α-helix | trans | -62.3 | -46.8 | 176.9 | -169 | 76.5 | 0 | 0 | 0 | 111.5 | R172 R173 S179 F180 | R172-L176 WeakPolarHBondContact O-CB 3.37Å; R172-L176 PolarHBondContact O-N 3.05Å; R173-L176 PolarHBondContact O-N 3.12Å; L176-S179 PolarHBondContact O-N 3.03Å; L176-F180 HydrophobicContact CD1-CE2 3.95Å; L176-F180 HydrophobicContact CD2-CE2 4.02Å; L176-F180 HydrophobicContact CG-CD2 3.97Å; L176-F180 HydrophobicContact CG-CE2 3.66Å; L176-F180 WeakPolarHBondContact O-CD2 3.39Å; L176-F180 PolarHBondContact O-N 2.92Å |
| 177 | C | 87.9 | Confident | 85 | Confident | 32 Ų | 32 | 90.1 Ų | 90.1 | 22% | 0.216 | 46% | 0.455 | C | S | . | . | H | α-helix | trans | -61.2 | -45.9 | 177.9 | -177.9 | 0 | 0 | 0 | 0 | 111.9 | C151 R173 L174 S179 F180 M181 | C151-C177 WeakPolarHBondContact CA-SG 3.34Å; C151-C177 HydrophobicContact CB-CB 3.63Å; C151-C177 WeakPolarHBondContact CB-SG 3.38Å; C151-C177 WeakPolarHBondContact SG-CB 3.12Å; C151-C177 CovalentContact SG-SG 2.04Å; C151-C177 PolarHBondContact SG-SG 2.95Å; R173-C177 WeakPolarHBondContact O-CB 3.28Å; R173-C177 PolarHBondContact O-N 2.96Å; L174-C177 PolarHBondContact O-N 3.23Å; C177-S179 VanDerWaalsContact C-N 3.33Å; C177-S179 PolarHBondContact O-N 3.4Å; C177-F180 PolarHBondContact O-N 3.08Å; C177-M181 WeakPolarHBondContact O-CG 3.44Å; C177-M181 PolarHBondContact O-N 3.42Å |
| 178 | T | 84.9 | Confident | 85.3 | Confident | 33 Ų | 33 | 88.8 Ų | 88.8 | 20% | 0.202 | 44% | 0.444 | C | S | . | . | H | α-helix | trans | -60.7 | -44.5 | 178.8 | -54.2 | 0 | 0 | 0 | 0 | 110.7 | L174 H175 F180 M181 D182 | L174-T178 WeakPolarHBondContact O-CB 3.28Å; L174-T178 PolarHBondContact O-N 3.44Å; L174-T178 PolarHBondContact O-OG1 3.02Å; H175-T178 PolarHBondContact O-N 3.39Å; T178-F180 PolarHBondContact O-N 2.92Å; T178-M181 PolarHBondContact O-N 3.48Å; T178-M181 VanDerWaalsContact O-N 3.17Å; T178-D182 PolarHBondContact O-N 2.88Å |
| 179 | S | 88.2 | Confident | 85.3 | Confident | 52 Ų | 52 | 90.9 Ų | 90.9 | 36% | 0.364 | 44% | 0.437 | S | S | . | . | H | α-helix | trans | -57.8 | -44.7 | 174.8 | 179.8 | 0 | 0 | 0 | 0 | 112.6 | H175 L176 C177 D182 M183 | H175-S179 WeakPolarHBondContact O-CB 3.22Å; H175-S179 PolarHBondContact O-N 3.24Å; L176-S179 PolarHBondContact O-N 3.03Å; C177-S179 VanDerWaalsContact C-N 3.33Å; C177-S179 PolarHBondContact O-N 3.4Å; S179-D182 PolarHBondContact O-N 3.1Å; S179-M183 WeakPolarHBondContact O-CG 3.45Å; S179-M183 PolarHBondContact O-N 3.35Å |
| 180 | F | 88.1 | Confident | 85.7 | Confident | 122 Ų | 122 | 86.8 Ų | 86.8 | 54% | 0.535 | 42% | 0.423 | S | S | . | . | H | α-helix | trans | -63.7 | -41.5 | 174.7 | -80 | -63.3 | 0 | 0 | 0 | 113 | L176 C177 T178 D182 M183 L184 | L176-F180 HydrophobicContact CD1-CE2 3.95Å; L176-F180 HydrophobicContact CD2-CE2 4.02Å; L176-F180 HydrophobicContact CG-CD2 3.97Å; L176-F180 HydrophobicContact CG-CE2 3.66Å; L176-F180 WeakPolarHBondContact O-CD2 3.39Å; L176-F180 PolarHBondContact O-N 2.92Å; C177-F180 PolarHBondContact O-N 3.08Å; T178-F180 PolarHBondContact O-N 2.92Å; F180-D182 VanDerWaalsContact C-N 3.35Å; F180-M183 HydrophobicContact CD1-CE 3.47Å; F180-M183 VanDerWaalsContact CD1-CE 3.47Å; F180-M183 HydrophobicContact CE1-CE 3.85Å; F180-M183 HydrophobicContact CG-CE 4.15Å; F180-M183 PolarHBondContact O-N 2.93Å; F180-L184 WeakPolarHBondContact O-CB 3.37Å; F180-L184 PolarHBondContact O-N 3.32Å |
| 181 | M | 84 | Confident | 86.1 | Confident | 40 Ų | 40 | 83.3 Ų | 83.3 | 20% | 0.197 | 41% | 0.408 | C | S | . | . | H | α-helix | trans | -65.4 | -38.4 | 177.6 | -68.8 | -58.9 | 166.9 | 0 | 0 | 112 | Y146 C177 T178 L184 K185 | Y146-M181 HydrophobicContact CD1-CG 4.46Å; Y146-M181 HydrophobicContact CD1-SD 3.53Å; Y146-M181 VanDerWaalsContact CD1-SD 3.53Å; Y146-M181 HydrophobicContact CE1-CE 4.42Å; Y146-M181 HydrophobicContact CE1-SD 3.32Å; Y146-M181 WeakPolarHBondContact CE1-SD 3.48Å; C177-M181 WeakPolarHBondContact O-CG 3.44Å; C177-M181 PolarHBondContact O-N 3.42Å; T178-M181 PolarHBondContact O-N 3.48Å; T178-M181 VanDerWaalsContact O-N 3.17Å; M181-L184 PolarHBondContact O-N 3.08Å; M181-L184 HydrophobicContact SD-CD2 4.49Å; M181-K185 VanDerWaalsContact O-CB 3.25Å; M181-K185 WeakPolarHBondContact O-CB 3.08Å; M181-K185 PolarHBondContact O-N 3.1Å |
| 182 | D | 85 | Confident | 86.3 | Confident | 81 Ų | 81 | 81 Ų | 81 | 43% | 0.433 | 39% | 0.392 | S | S | . | . | H | α-helix | trans | -65.2 | -43.4 | 175.2 | -76.4 | -30.5 | 0 | 0 | 0 | 111.6 | T178 S179 F180 L184 K185 A186 | T178-D182 PolarHBondContact O-N 2.88Å; S179-D182 PolarHBondContact O-N 3.1Å; F180-D182 VanDerWaalsContact C-N 3.35Å; D182-L184 PolarHBondContact O-N 3.42Å; D182-K185 PolarHBondContact O-N 3.38Å; D182-A186 WeakPolarHBondContact O-CB 3.26Å; D182-A186 PolarHBondContact O-N 2.97Å |
| 183 | M | 88.3 | Confident | 86.5 | Confident | 106 Ų | 106 | 74.3 Ų | 74.3 | 52% | 0.522 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -60.8 | -44.3 | 173.4 | -73.7 | -171.8 | -72.1 | 0 | 0 | 111.8 | S179 F180 A186 L187 | S179-M183 WeakPolarHBondContact O-CG 3.45Å; S179-M183 PolarHBondContact O-N 3.35Å; F180-M183 HydrophobicContact CD1-CE 3.47Å; F180-M183 VanDerWaalsContact CD1-CE 3.47Å; F180-M183 HydrophobicContact CE1-CE 3.85Å; F180-M183 HydrophobicContact CG-CE 4.15Å; F180-M183 PolarHBondContact O-N 2.93Å; M183-A186 PolarHBondContact O-N 2.88Å; M183-L187 WeakPolarHBondContact O-CB 3.35Å; M183-L187 PolarHBondContact O-N 3.43Å |
| 184 | L | 84.4 | Confident | 86.9 | Confident | 60 Ų | 60 | 71.8 Ų | 71.8 | 31% | 0.314 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -64.6 | -41.9 | 178.8 | -172.5 | 61.7 | 0 | 0 | 0 | 111.6 | Y146 F180 M181 D182 A186 L187 F188 | Y146-L184 HydrophobicContact CE1-CD2 4.07Å; Y146-L184 HydrophobicContact CE2-CD2 4.23Å; Y146-L184 VanDerWaalsContact OH-CD2 3.27Å; Y146-L184 WeakPolarHBondContact OH-CD2 3.41Å; F180-L184 WeakPolarHBondContact O-CB 3.37Å; F180-L184 PolarHBondContact O-N 3.32Å; M181-L184 PolarHBondContact O-N 3.08Å; M181-L184 HydrophobicContact SD-CD2 4.49Å; D182-L184 PolarHBondContact O-N 3.42Å; L184-A186 PolarHBondContact O-N 3.49Å; L184-L187 PolarHBondContact O-N 2.82Å; L184-F188 HydrophobicContact CD1-CD2 3.97Å; L184-F188 HydrophobicContact CD1-CE2 3.44Å; L184-F188 VanDerWaalsContact CD1-CE2 3.44Å; L184-F188 HydrophobicContact CD1-CZ 4.21Å; L184-F188 HydrophobicContact CD2-CE2 4.1Å; L184-F188 HydrophobicContact CG-CD2 3.83Å; L184-F188 HydrophobicContact CG-CE2 3.53Å; L184-F188 WeakPolarHBondContact O-CD2 3.21Å; L184-F188 PolarHBondContact O-N 3.12Å |
| 185 | K | 82.6 | Confident | 87.2 | Confident | 72 Ų | 72 | 69.2 Ų | 69.2 | 31% | 0.313 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -60.6 | -43.7 | 174.1 | -177.6 | 178.7 | -178.5 | 176.3 | 0 | 111.7 | M181 D182 R189 | M181-K185 VanDerWaalsContact O-CB 3.25Å; M181-K185 WeakPolarHBondContact O-CB 3.08Å; M181-K185 PolarHBondContact O-N 3.1Å; D182-K185 PolarHBondContact O-N 3.38Å; K185-R189 WeakPolarHBondContact O-CB 3.32Å; K185-R189 PolarHBondContact O-N 3.48Å |
| 186 | A | 86.6 | Confident | 87.4 | Confident | 55 Ų | 55 | 64.1 Ų | 64.1 | 46% | 0.455 | 34% | 0.34 | S | S | . | . | H | α-helix | trans | -63.5 | -41.7 | 176 | 0 | 0 | 0 | 0 | 0 | 111.9 | D182 M183 L184 R189 T190 | D182-A186 WeakPolarHBondContact O-CB 3.26Å; D182-A186 PolarHBondContact O-N 2.97Å; M183-A186 PolarHBondContact O-N 2.88Å; L184-A186 PolarHBondContact O-N 3.49Å; A186-R189 PolarHBondContact O-N 3.41Å; A186-T190 WeakPolarHBondContact O-CB 3.22Å; A186-T190 PolarHBondContact O-N 3.42Å; A186-T190 PolarHBondContact O-OG1 3.07Å |
| 187 | L | 88.1 | Confident | 87.6 | Confident | 95 Ų | 95 | 60.6 Ų | 60.6 | 50% | 0.497 | 33% | 0.329 | S | S | . | . | H | α-helix | trans | -60.9 | -50.5 | 176 | -178.6 | 145.6 | 0 | 0 | 0 | 111.5 | M183 L184 R189 T190 L191 | M183-L187 WeakPolarHBondContact O-CB 3.35Å; M183-L187 PolarHBondContact O-N 3.43Å; L184-L187 PolarHBondContact O-N 2.82Å; L187-R189 PolarHBondContact O-N 2.84Å; L187-T190 WeakPolarHBondContact O-CB 3.49Å; L187-T190 PolarHBondContact O-N 2.88Å; L187-T190 VanDerWaalsContact O-N 3.16Å; L187-L191 HydrophobicContact CD2-CD1 3.63Å; L187-L191 HydrophobicContact CD2-CG 4.32Å; L187-L191 WeakPolarHBondContact O-CG 3.36Å; L187-L191 PolarHBondContact O-N 3.49Å |
| 188 | F | 82.9 | Confident | 88 | Confident | 12 Ų | 12 | 59.6 Ų | 59.6 | 5% | 0.053 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -63.9 | -40.5 | 179.3 | -79 | -62.2 | 0 | 0 | 0 | 112.9 | F75 R78 Y146 L184 T190 L191 Q192 | F75-F188 AromaticContact CD1-CD1 4Å; F75-F188 HydrophobicContact CD1-CD1 4Å; F75-F188 HydrophobicContact CD1-CE1 4.42Å; F75-F188 AromaticContact CE1-CD1 3.95Å; F75-F188 HydrophobicContact CE1-CD1 3.95Å; R78-F188 HydrophobicContact CB-CE1 3.9Å; R78-F188 HydrophobicContact CB-CE2 4.35Å; R78-F188 HydrophobicContact CB-CZ 3.71Å; R78-F188 HydrophobicContact CG-CE1 4.36Å; R78-F188 HydrophobicContact CG-CE2 4.14Å; R78-F188 HydrophobicContact CG-CZ 4.01Å; Y146-F188 HydrophobicContact CE2-CD2 4.34Å; Y146-F188 HydrophobicContact CE2-CE2 4.32Å; L184-F188 HydrophobicContact CD1-CD2 3.97Å; L184-F188 HydrophobicContact CD1-CE2 3.44Å; L184-F188 VanDerWaalsContact CD1-CE2 3.44Å; L184-F188 HydrophobicContact CD1-CZ 4.21Å; L184-F188 HydrophobicContact CD2-CE2 4.1Å; L184-F188 HydrophobicContact CG-CD2 3.83Å; L184-F188 HydrophobicContact CG-CE2 3.53Å; L184-F188 WeakPolarHBondContact O-CD2 3.21Å; L184-F188 PolarHBondContact O-N 3.12Å; F188-T190 VanDerWaalsContact C-N 3.25Å; F188-T190 PolarHBondContact O-N 3.16Å; F188-L191 HydrophobicContact CD1-CD1 4.33Å; F188-L191 PolarHBondContact O-N 3.02Å; F188-Q192 WeakPolarHBondContact O-CG 3.39Å; F188-Q192 PolarHBondContact O-N 3.44Å |
| 189 | R | 84.2 | Confident | 88.4 | Confident | 158 Ų | 158 | 58 Ų | 58 | 60% | 0.596 | 31% | 0.312 | S | S | * | . | H | α-helix | trans | -59.9 | -39.9 | 174.6 | -176.3 | 178.8 | -66.8 | -174.1 | -4.3 | 111.5 | K185 A186 L187 Q192 A193 | K185-R189 WeakPolarHBondContact O-CB 3.32Å; K185-R189 PolarHBondContact O-N 3.48Å; A186-R189 PolarHBondContact O-N 3.41Å; L187-R189 PolarHBondContact O-N 2.84Å; R189-Q192 PolarHBondContact O-N 3.34Å; R189-A193 PolarHBondContact O-N 3.28Å |
| 190 | T | 89.2 | Confident | 88.6 | Confident | 73 Ų | 73 | 59.3 Ų | 59.3 | 45% | 0.448 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -65.9 | -46.2 | 177.1 | -57.4 | 0 | 0 | 0 | 0 | 111.2 | A186 L187 F188 Q192 A193 M194 | A186-T190 WeakPolarHBondContact O-CB 3.22Å; A186-T190 PolarHBondContact O-N 3.42Å; A186-T190 PolarHBondContact O-OG1 3.07Å; L187-T190 WeakPolarHBondContact O-CB 3.49Å; L187-T190 PolarHBondContact O-N 2.88Å; L187-T190 VanDerWaalsContact O-N 3.16Å; F188-T190 VanDerWaalsContact C-N 3.25Å; F188-T190 PolarHBondContact O-N 3.16Å; T190-Q192 VanDerWaalsContact C-N 3.26Å; T190-Q192 PolarHBondContact O-N 3.33Å; T190-A193 PolarHBondContact O-N 3.16Å; T190-M194 HydrophobicContact CG2-CE 3.71Å; T190-M194 HydrophobicContact CG2-SD 4.34Å; T190-M194 WeakPolarHBondContact O-CG 3.46Å; T190-M194 PolarHBondContact O-N 3.38Å |
| 191 | L | 88.8 | Confident | 88.9 | Confident | 26 Ų | 26 | 57.4 Ų | 57.4 | 14% | 0.136 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -59 | -37.7 | 173.9 | -69 | 175.4 | 0 | 0 | 0 | 112 | L71 F74 F75 L187 F188 M194 L195 | L71-L191 HydrophobicContact CD2-CD2 3.66Å; F74-L191 HydrophobicContact CB-CD1 4.01Å; F75-L191 HydrophobicContact CE1-CB 4.3Å; F75-L191 HydrophobicContact CE2-CB 4.07Å; F75-L191 HydrophobicContact CZ-CB 3.59Å; L187-L191 HydrophobicContact CD2-CD1 3.63Å; L187-L191 HydrophobicContact CD2-CG 4.32Å; L187-L191 WeakPolarHBondContact O-CG 3.36Å; L187-L191 PolarHBondContact O-N 3.49Å; F188-L191 HydrophobicContact CD1-CD1 4.33Å; F188-L191 PolarHBondContact O-N 3.02Å; L191-M194 HydrophobicContact CD2-SD 4.45Å; L191-M194 PolarHBondContact O-N 2.86Å; L191-L195 WeakPolarHBondContact O-CB 3.45Å; L191-L195 PolarHBondContact O-N 2.82Å |
| 192 | Q | 86.8 | Confident | 89.3 | Confident | 24 Ų | 24 | 55.9 Ų | 55.9 | 11% | 0.112 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -67.2 | -42.7 | 178.9 | -77.1 | -176.5 | -35.8 | 0 | 0 | 110.8 | F75 D139 F188 R189 T190 L195 L196 | F75-Q192 HydrophobicContact CE1-CG 3.48Å; F75-Q192 VanDerWaalsContact CE1-CG 3.48Å; F75-Q192 HydrophobicContact CZ-CB 4.15Å; F75-Q192 HydrophobicContact CZ-CG 3.39Å; D139-Q192 PolarHBondContact OD2-NE2 2.93Å; D139-Q192 VanDerWaalsContact OD2-NE2 3.08Å; F188-Q192 WeakPolarHBondContact O-CG 3.39Å; F188-Q192 PolarHBondContact O-N 3.44Å; R189-Q192 PolarHBondContact O-N 3.34Å; T190-Q192 VanDerWaalsContact C-N 3.26Å; T190-Q192 PolarHBondContact O-N 3.33Å; Q192-L195 PolarHBondContact O-N 2.9Å; Q192-L196 WeakPolarHBondContact O-CB 3.38Å; Q192-L196 PolarHBondContact O-N 3.06Å |
| 193 | A | 89.9 | Confident | 89.6 | Confident | 61 Ų | 61 | 53.1 Ų | 53.1 | 50% | 0.504 | 29% | 0.287 | S | S | . | . | H | α-helix | trans | -64.2 | -40.7 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | R189 T190 L196 G197 | R189-A193 PolarHBondContact O-N 3.28Å; T190-A193 PolarHBondContact O-N 3.16Å; A193-L196 PolarHBondContact O-N 3.27Å; A193-G197 PolarHBondContact O-N 3Å |
| 194 | M | 93.2 | Very high | 89.7 | Confident | 106 Ų | 106 | 51.9 Ų | 51.9 | 52% | 0.522 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -60.8 | -48.3 | 174.4 | -71.8 | 174.3 | 175.9 | 0 | 0 | 111.2 | L71 T190 L191 L196 G197 V198 | L71-M194 HydrophobicContact CD1-CB 4.13Å; T190-M194 HydrophobicContact CG2-CE 3.71Å; T190-M194 HydrophobicContact CG2-SD 4.34Å; T190-M194 WeakPolarHBondContact O-CG 3.46Å; T190-M194 PolarHBondContact O-N 3.38Å; L191-M194 HydrophobicContact CD2-SD 4.45Å; L191-M194 PolarHBondContact O-N 2.86Å; M194-L196 VanDerWaalsContact C-N 3.34Å; M194-L196 PolarHBondContact O-N 3.4Å; M194-G197 WeakPolarHBondContact O-CA 3.49Å; M194-G197 PolarHBondContact O-N 3.26Å; M194-G197 VanDerWaalsContact O-N 3.1Å; M194-V198 WeakPolarHBondContact O-CG2 3.27Å; M194-V198 PolarHBondContact O-N 3.3Å |
| 195 | L | 91.1 | Very high | 89.9 | Confident | 0 Ų | 0 | 49.5 Ų | 49.5 | 0% | 0 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -62.5 | -40.2 | 179.6 | -175.4 | 61.2 | 0 | 0 | 0 | 112.2 | L71 F75 L83 A89 L191 Q192 G197 V198 W199 | L71-L195 HydrophobicContact CB-CD1 4.11Å; L71-L195 HydrophobicContact CD1-CB 4.34Å; L71-L195 HydrophobicContact CD1-CD1 4.38Å; F75-L195 HydrophobicContact CD2-CD2 4.24Å; F75-L195 HydrophobicContact CE2-CD2 3.84Å; L83-L195 HydrophobicContact CD2-CD2 4.04Å; A89-L195 HydrophobicContact CB-CD1 4.24Å; A89-L195 HydrophobicContact CB-CD2 4.01Å; L191-L195 WeakPolarHBondContact O-CB 3.45Å; L191-L195 PolarHBondContact O-N 2.82Å; Q192-L195 PolarHBondContact O-N 2.9Å; L195-G197 VanDerWaalsContact C-N 3.33Å; L195-G197 PolarHBondContact O-N 3.14Å; L195-V198 WeakPolarHBondContact O-CB 3.37Å; L195-V198 PolarHBondContact O-N 3.43Å; L195-W199 HydrophobicContact CD1-CD2 4.47Å; L195-W199 HydrophobicContact CD1-CZ2 3.95Å; L195-W199 HydrophobicContact CD2-CH2 3.56Å; L195-W199 HydrophobicContact CD2-CZ2 3.54Å; L195-W199 HydrophobicContact CD2-CZ3 4.22Å; L195-W199 HydrophobicContact CG-CD2 4.13Å; L195-W199 HydrophobicContact CG-CE3 4.31Å; L195-W199 HydrophobicContact CG-CH2 3.81Å; L195-W199 HydrophobicContact CG-CZ2 3.6Å; L195-W199 HydrophobicContact CG-CZ3 4.12Å; L195-W199 PolarHBondContact O-N 3.13Å |
| 196 | L | 92 | Very high | 90.1 | Very high | 36 Ų | 36 | 46.2 Ų | 46.2 | 19% | 0.188 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -56.9 | -47.7 | 171 | 176.7 | 68.5 | 0 | 0 | 0 | 111.3 | L133 W136 Q192 A193 M194 V198 W199 I200 | L133-L196 HydrophobicContact CD2-CD1 3.41Å; L133-L196 VanDerWaalsContact CD2-CD1 3.41Å; W136-L196 HydrophobicContact CD2-CD1 3.81Å; W136-L196 HydrophobicContact CD2-CD2 4.41Å; W136-L196 HydrophobicContact CE3-CD1 3.91Å; W136-L196 HydrophobicContact CE3-CD2 4.45Å; W136-L196 HydrophobicContact CG-CD1 4.23Å; W136-L196 HydrophobicContact CH2-CD2 3.72Å; W136-L196 HydrophobicContact CZ2-CD2 3.65Å; W136-L196 HydrophobicContact CZ2-CG 4.46Å; W136-L196 HydrophobicContact CZ3-CD1 4.32Å; W136-L196 HydrophobicContact CZ3-CD2 4.12Å; Q192-L196 WeakPolarHBondContact O-CB 3.38Å; Q192-L196 PolarHBondContact O-N 3.06Å; A193-L196 PolarHBondContact O-N 3.27Å; M194-L196 VanDerWaalsContact C-N 3.34Å; M194-L196 PolarHBondContact O-N 3.4Å; L196-V198 VanDerWaalsContact C-N 3.3Å; L196-V198 PolarHBondContact O-N 3.27Å; L196-W199 PolarHBondContact O-N 3.42Å; L196-I200 HydrophobicContact CD1-CD1 4.23Å; L196-I200 HydrophobicContact CD1-CG1 4.49Å; L196-I200 HydrophobicContact CG-CD1 3.98Å; L196-I200 WeakPolarHBondContact O-CG1 3.18Å; L196-I200 PolarHBondContact O-N 2.78Å |
| 197 | G | 94.5 | Very high | 90.1 | Very high | 29 Ų | 29 | 45.4 Ų | 45.4 | 30% | 0.299 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -56.8 | -43.6 | 175.2 | 0 | 0 | 0 | 0 | 0 | 112.3 | A193 M194 L195 I200 L201 | A193-G197 PolarHBondContact O-N 3Å; M194-G197 WeakPolarHBondContact O-CA 3.49Å; M194-G197 PolarHBondContact O-N 3.26Å; M194-G197 VanDerWaalsContact O-N 3.1Å; L195-G197 VanDerWaalsContact C-N 3.33Å; L195-G197 PolarHBondContact O-N 3.14Å; G197-I200 PolarHBondContact O-N 3.29Å; G197-L201 WeakPolarHBondContact O-CB 3.35Å; G197-L201 VanDerWaalsContact O-CG 3.29Å; G197-L201 WeakPolarHBondContact O-CG 3.41Å; G197-L201 PolarHBondContact O-N 2.85Å |
| 198 | V | 94.4 | Very high | 89.9 | Confident | 11 Ų | 11 | 42.6 Ų | 42.6 | 7% | 0.067 | 23% | 0.231 | C | C | . | . | H | α-helix | trans | -60.1 | -46.4 | 175.4 | 175.5 | 0 | 0 | 0 | 0 | 111.3 | L64 L67 L71 M194 L195 L196 I200 L201 L202 | L64-V198 HydrophobicContact CB-CG1 4.05Å; L64-V198 HydrophobicContact CD2-CG1 4.13Å; L64-V198 VanDerWaalsContact O-CG1 3.25Å; L64-V198 WeakPolarHBondContact O-CG1 3.34Å; L67-V198 HydrophobicContact CB-CG2 4.29Å; L71-V198 HydrophobicContact CD1-CG2 3.97Å; M194-V198 WeakPolarHBondContact O-CG2 3.27Å; M194-V198 PolarHBondContact O-N 3.3Å; L195-V198 WeakPolarHBondContact O-CB 3.37Å; L195-V198 PolarHBondContact O-N 3.43Å; L196-V198 VanDerWaalsContact C-N 3.3Å; L196-V198 PolarHBondContact O-N 3.27Å; V198-I200 PolarHBondContact O-N 2.93Å; V198-L201 PolarHBondContact O-N 2.93Å; V198-L202 HydrophobicContact CG1-CD1 4.15Å; V198-L202 HydrophobicContact CG1-CG 4.47Å; V198-L202 WeakPolarHBondContact O-CG 3.39Å; V198-L202 PolarHBondContact O-N 3.37Å |
| 199 | W | 93.5 | Very high | 89.7 | Confident | 0 Ų | 0 | 43.4 Ų | 43.4 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -65.3 | -38.8 | 179.3 | -67.5 | -26.6 | 0 | 0 | 0 | 113.3 | S68 L83 A89 T92 A132 L133 W136 L195 L196 L202 L203 | S68-W199 PolarHBondContact OG-NE1 2.93Å; L83-W199 HydrophobicContact CD1-CH2 4Å; L83-W199 HydrophobicContact CD1-CZ3 4.44Å; L83-W199 HydrophobicContact CD2-CH2 4.15Å; L83-W199 HydrophobicContact CG-CH2 4.23Å; A89-W199 HydrophobicContact CB-CZ2 4.22Å; T92-W199 PolarHBondContact OG1-NE1 3.28Å; A132-W199 HydrophobicContact CB-CD2 3.82Å; A132-W199 HydrophobicContact CB-CE3 4.08Å; A132-W199 HydrophobicContact CB-CG 4.34Å; A132-W199 HydrophobicContact CB-CH2 4.2Å; A132-W199 HydrophobicContact CB-CZ2 3.93Å; A132-W199 HydrophobicContact CB-CZ3 4.29Å; L133-W199 HydrophobicContact CD2-CB 4.15Å; W136-W199 HydrophobicContact CB-CE3 4.37Å; W136-W199 HydrophobicContact CB-CZ3 3.77Å; W136-W199 AromaticContact CD1-CZ3 3.92Å; W136-W199 HydrophobicContact CG-CZ3 4.11Å; L195-W199 HydrophobicContact CD1-CD2 4.47Å; L195-W199 HydrophobicContact CD1-CZ2 3.95Å; L195-W199 HydrophobicContact CD2-CH2 3.56Å; L195-W199 HydrophobicContact CD2-CZ2 3.54Å; L195-W199 HydrophobicContact CD2-CZ3 4.22Å; L195-W199 HydrophobicContact CG-CD2 4.13Å; L195-W199 HydrophobicContact CG-CE3 4.31Å; L195-W199 HydrophobicContact CG-CH2 3.81Å; L195-W199 HydrophobicContact CG-CZ2 3.6Å; L195-W199 HydrophobicContact CG-CZ3 4.12Å; L195-W199 PolarHBondContact O-N 3.13Å; L196-W199 PolarHBondContact O-N 3.42Å; W199-L202 PolarHBondContact O-N 3.05Å; W199-L203 PolarHBondContact O-N 3.03Å |
| 200 | I | 94.1 | Very high | 89.4 | Confident | 78 Ų | 78 | 40.4 Ų | 40.4 | 40% | 0.4 | 23% | 0.233 | S | C | . | . | H | α-helix | trans | -62.4 | -45 | 173.2 | -66.6 | 168.2 | 0 | 0 | 0 | 110.2 | L133 L196 G197 V198 L202 L203 L204 | L133-I200 HydrophobicContact CD2-CG1 4.24Å; L196-I200 HydrophobicContact CD1-CD1 4.23Å; L196-I200 HydrophobicContact CD1-CG1 4.49Å; L196-I200 HydrophobicContact CG-CD1 3.98Å; L196-I200 WeakPolarHBondContact O-CG1 3.18Å; L196-I200 PolarHBondContact O-N 2.78Å; G197-I200 PolarHBondContact O-N 3.29Å; V198-I200 PolarHBondContact O-N 2.93Å; I200-L202 VanDerWaalsContact C-N 3.32Å; I200-L202 PolarHBondContact O-N 3.49Å; I200-L203 WeakPolarHBondContact O-CB 3.26Å; I200-L203 PolarHBondContact O-N 3.14Å; I200-L204 HydrophobicContact CG2-CD1 4.28Å; I200-L204 WeakPolarHBondContact O-CG 3.43Å; I200-L204 PolarHBondContact O-N 2.95Å |
| 201 | L | 94.3 | Very high | 88.8 | Confident | 83 Ų | 83 | 41.5 Ų | 41.5 | 44% | 0.435 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -64.7 | -35.6 | 177.3 | -71 | 170.2 | 0 | 0 | 0 | 112.3 | L64 G197 V198 L204 A205 | L64-L201 HydrophobicContact CD1-CB 3.63Å; L64-L201 HydrophobicContact CD2-CB 4.03Å; L64-L201 HydrophobicContact CD2-CD1 4.01Å; G197-L201 WeakPolarHBondContact O-CB 3.35Å; G197-L201 VanDerWaalsContact O-CG 3.29Å; G197-L201 WeakPolarHBondContact O-CG 3.41Å; G197-L201 PolarHBondContact O-N 2.85Å; V198-L201 PolarHBondContact O-N 2.93Å; L201-L204 PolarHBondContact O-N 3.38Å; L201-A205 VanDerWaalsContact O-CB 3.29Å; L201-A205 WeakPolarHBondContact O-CB 3.43Å; L201-A205 PolarHBondContact O-N 3.11Å |
| 202 | L | 92.4 | Very high | 88.2 | Confident | 8 Ų | 8 | 40.9 Ų | 40.9 | 4% | 0.042 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -63.2 | -41.9 | 173.3 | -79 | 171.9 | 0 | 0 | 0 | 111.9 | L64 A96 V198 W199 I200 A205 S206 | L64-L202 HydrophobicContact CB-CD1 4.46Å; L64-L202 HydrophobicContact CB-CD2 3.51Å; L64-L202 HydrophobicContact CB-CG 3.77Å; L64-L202 HydrophobicContact CD1-CD2 4.13Å; L64-L202 HydrophobicContact CD1-CG 4.26Å; L64-L202 HydrophobicContact CG-CD2 4.49Å; A96-L202 HydrophobicContact CB-CD1 4.2Å; A96-L202 HydrophobicContact CB-CD2 3.53Å; V198-L202 HydrophobicContact CG1-CD1 4.15Å; V198-L202 HydrophobicContact CG1-CG 4.47Å; V198-L202 WeakPolarHBondContact O-CG 3.39Å; V198-L202 PolarHBondContact O-N 3.37Å; W199-L202 PolarHBondContact O-N 3.05Å; I200-L202 VanDerWaalsContact C-N 3.32Å; I200-L202 PolarHBondContact O-N 3.49Å; L202-A205 PolarHBondContact O-N 3.37Å; L202-S206 WeakPolarHBondContact O-CB 3.45Å; L202-S206 PolarHBondContact O-N 3.37Å; L202-S206 PolarHBondContact O-OG 2.9Å |
| 203 | L | 91.4 | Very high | 87.6 | Confident | 23 Ų | 23 | 46.5 Ų | 46.5 | 12% | 0.12 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -59.1 | -50.2 | 173.3 | -73.7 | 168.1 | 0 | 0 | 0 | 111.1 | F126 A129 I130 L133 W199 I200 A205 S206 L207 | F126-L203 HydrophobicContact CD2-CD2 3.8Å; F126-L203 HydrophobicContact CE2-CD2 4.09Å; F126-L203 WeakPolarHBondContact O-CD2 3.25Å; A129-L203 HydrophobicContact CB-CD1 4.39Å; A129-L203 HydrophobicContact CB-CD2 3.54Å; A129-L203 HydrophobicContact CB-CG 3.6Å; I130-L203 HydrophobicContact CG1-CD2 3.79Å; L133-L203 HydrophobicContact CD1-CD1 3.31Å; L133-L203 HydrophobicContact CG-CD1 4.16Å; W199-L203 PolarHBondContact O-N 3.03Å; I200-L203 WeakPolarHBondContact O-CB 3.26Å; I200-L203 PolarHBondContact O-N 3.14Å; L203-A205 VanDerWaalsContact C-N 3.32Å; L203-A205 PolarHBondContact O-N 3.5Å; L203-S206 PolarHBondContact O-N 3.17Å; L203-S206 PolarHBondContact O-OG 3.41Å; L203-L207 WeakPolarHBondContact O-CG 3.05Å; L203-L207 PolarHBondContact O-N 2.92Å |
| 204 | L | 90.6 | Very high | 86.7 | Confident | 80 Ų | 80 | 44.6 Ų | 44.6 | 42% | 0.419 | 23% | 0.23 | S | C | . | . | H | α-helix | trans | -60.5 | -41.7 | 178.3 | -65.8 | 174.2 | 0 | 0 | 0 | 111.9 | I200 L201 L207 T208 W211 | I200-L204 HydrophobicContact CG2-CD1 4.28Å; I200-L204 WeakPolarHBondContact O-CG 3.43Å; I200-L204 PolarHBondContact O-N 2.95Å; L201-L204 PolarHBondContact O-N 3.38Å; L204-L207 PolarHBondContact O-N 2.9Å; L204-T208 PolarHBondContact O-N 3.04Å; L204-T208 VanDerWaalsContact O-N 3.11Å; L204-T208 PolarHBondContact O-OG1 3.22Å; L204-W211 HydrophobicContact CD2-CH2 4.38Å |
| 205 | A | 88.4 | Confident | 85.7 | Confident | 9 Ų | 9 | 44.8 Ų | 44.8 | 7% | 0.074 | 23% | 0.225 | C | C | . | . | H | α-helix | trans | -64.6 | -40.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | S57 Q61 L201 L202 L203 L207 T208 P209 | S57-A205 PolarHBondContact OG-O 2.86Å; S57-A205 VanDerWaalsContact OG-O 3.06Å; Q61-A205 HydrophobicContact CG-CB 4.12Å; L201-A205 VanDerWaalsContact O-CB 3.29Å; L201-A205 WeakPolarHBondContact O-CB 3.43Å; L201-A205 PolarHBondContact O-N 3.11Å; L202-A205 PolarHBondContact O-N 3.37Å; L203-A205 VanDerWaalsContact C-N 3.32Å; L203-A205 PolarHBondContact O-N 3.5Å; A205-L207 VanDerWaalsContact C-N 3.35Å; A205-T208 WeakPolarHBondContact O-CB 3.2Å; A205-T208 PolarHBondContact O-N 2.95Å; A205-P209 WeakPolarHBondContact O-CD 3.32Å |
| 206 | S | 86.8 | Confident | 84.7 | Confident | 3 Ų | 3 | 52 Ų | 52 | 2% | 0.021 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -69.4 | -29.4 | 176.8 | 69.7 | 0 | 0 | 0 | 0 | 113.4 | T122 L202 L203 P209 | T122-S206 WeakPolarHBondContact CG2-O 3.41Å; L202-S206 WeakPolarHBondContact O-CB 3.45Å; L202-S206 PolarHBondContact O-N 3.37Å; L202-S206 PolarHBondContact O-OG 2.9Å; L203-S206 PolarHBondContact O-N 3.17Å; L203-S206 PolarHBondContact O-OG 3.41Å; S206-P209 WeakPolarHBondContact O-CD 3.46Å |
| 207 | L | 86.9 | Confident | 83.4 | Confident | 38 Ų | 38 | 54.1 Ų | 54.1 | 20% | 0.199 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -78.9 | -21.8 | 175.4 | -71.4 | 174.9 | 0 | 0 | 0 | 113.3 | F126 L203 L204 A205 L210 W211 | F126-L207 HydrophobicContact CD2-CD2 4.01Å; F126-L207 HydrophobicContact CD2-CG 4.23Å; F126-L207 HydrophobicContact CE2-CD1 4.31Å; F126-L207 HydrophobicContact CE2-CD2 3.69Å; F126-L207 HydrophobicContact CE2-CG 4.06Å; F126-L207 HydrophobicContact CZ-CD2 4.48Å; L203-L207 WeakPolarHBondContact O-CG 3.05Å; L203-L207 PolarHBondContact O-N 2.92Å; L204-L207 PolarHBondContact O-N 2.9Å; A205-L207 VanDerWaalsContact C-N 3.35Å; L207-L210 HydrophobicContact CD2-CD1 4.15Å; L207-L210 WeakPolarHBondContact O-CB 3.48Å; L207-L210 PolarHBondContact O-N 2.76Å; L207-W211 HydrophobicContact CD1-CZ2 4.32Å; L207-W211 PolarHBondContact O-N 3.31Å |
| 208 | T | 83.6 | Confident | 81.7 | Confident | 36 Ų | 36 | 57 Ų | 57 | 22% | 0.221 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -55 | -45.8 | -175.4 | -61.7 | 0 | 0 | 0 | 0 | 113.4 | L204 A205 L210 W211 L212 | L204-T208 PolarHBondContact O-N 3.04Å; L204-T208 VanDerWaalsContact O-N 3.11Å; L204-T208 PolarHBondContact O-OG1 3.22Å; A205-T208 WeakPolarHBondContact O-CB 3.2Å; A205-T208 PolarHBondContact O-N 2.95Å; T208-L210 VanDerWaalsContact C-N 3.34Å; T208-L210 PolarHBondContact O-N 2.7Å; T208-W211 PolarHBondContact O-N 3.41Å; T208-L212 HydrophobicContact CG2-CD1 4.02Å; T208-L212 HydrophobicContact CG2-CG 4.42Å; T208-L212 WeakPolarHBondContact O-CB 3.34Å; T208-L212 VanDerWaalsContact O-CG 3.3Å; T208-L212 WeakPolarHBondContact O-CG 3.27Å; T208-L212 PolarHBondContact O-N 3.45Å |
| 209 | P | 77.9 | Confident | 80 | Confident | 29 Ų | 29 | 60.1 Ų | 60.1 | 19% | 0.188 | 29% | 0.287 | C | S | . | . | H | α-helix | trans | -62.6 | -37 | 175.5 | -22 | 33.6 | 0 | 0 | 0 | 113.5 | L54 A205 S206 Y213 | L54-P209 HydrophobicContact CD2-CB 4.31Å; L54-P209 HydrophobicContact CD2-CG 4.49Å; A205-P209 WeakPolarHBondContact O-CD 3.32Å; S206-P209 WeakPolarHBondContact O-CD 3.46Å; P209-Y213 VanDerWaalsContact O-CB 3.3Å; P209-Y213 WeakPolarHBondContact O-CB 3.37Å; P209-Y213 PolarHBondContact O-N 3.41Å |
| 210 | L | 78.4 | Confident | 78 | Confident | 96 Ų | 96 | 63.3 Ų | 63.3 | 50% | 0.503 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -67.8 | -43 | 177.2 | -67.7 | 172.5 | 0 | 0 | 0 | 110.9 | L207 T208 Y213 C214 | L207-L210 HydrophobicContact CD2-CD1 4.15Å; L207-L210 WeakPolarHBondContact O-CB 3.48Å; L207-L210 PolarHBondContact O-N 2.76Å; T208-L210 VanDerWaalsContact C-N 3.34Å; T208-L210 PolarHBondContact O-N 2.7Å; L210-Y213 PolarHBondContact O-N 2.04Å; L210-C214 WeakPolarHBondContact O-CB 3.46Å; L210-C214 PolarHBondContact O-N 3.19Å |
| 211 | W | 77.1 | Confident | 76 | Confident | 96 Ų | 96 | 67.7 Ų | 67.7 | 36% | 0.364 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -62.3 | -45.2 | 175.8 | -70.7 | 10.3 | 0 | 0 | 0 | 111 | L204 L207 T208 Y213 C214 W215 | L204-W211 HydrophobicContact CD2-CH2 4.38Å; L207-W211 HydrophobicContact CD1-CZ2 4.32Å; L207-W211 PolarHBondContact O-N 3.31Å; T208-W211 PolarHBondContact O-N 3.41Å; W211-Y213 PolarHBondContact O-N 2.73Å; W211-C214 PolarHBondContact O-N 2.88Å; W211-W215 HydrophobicContact CB-CZ2 4.38Å; W211-W215 HydrophobicContact CE3-CZ2 4.39Å; W211-W215 WeakPolarHBondContact O-CB 3.37Å; W211-W215 PolarHBondContact O-N 2.98Å |
| 212 | L | 74.8 | Confident | 73.9 | Confident | 12 Ų | 12 | 66.5 Ų | 66.5 | 6% | 0.063 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -63 | -41.1 | 175.3 | -72.4 | 171.7 | 0 | 0 | 0 | 112.6 | L53 L54 T208 W215 R216 | L53-L212 HydrophobicContact CB-CD1 4.04Å; L53-L212 HydrophobicContact CD1-CD2 3.98Å; L54-L212 HydrophobicContact CD2-CD1 3.77Å; L54-L212 HydrophobicContact CG-CD1 3.75Å; T208-L212 HydrophobicContact CG2-CD1 4.02Å; T208-L212 HydrophobicContact CG2-CG 4.42Å; T208-L212 WeakPolarHBondContact O-CB 3.34Å; T208-L212 VanDerWaalsContact O-CG 3.3Å; T208-L212 WeakPolarHBondContact O-CG 3.27Å; T208-L212 PolarHBondContact O-N 3.45Å; L212-W215 HydrophobicContact CD2-CE3 3.69Å; L212-W215 HydrophobicContact CD2-CZ3 3.78Å; L212-W215 HydrophobicContact CG-CE3 4.46Å; L212-W215 PolarHBondContact O-N 2.9Å; L212-R216 WeakPolarHBondContact O-CG 3.43Å; L212-R216 PolarHBondContact O-N 3.33Å |
| 213 | Y | 73.8 | Confident | 72 | Confident | 143 Ų | 143 | 73.7 Ų | 73.7 | 56% | 0.561 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -61.8 | -48.6 | 176.3 | 176.5 | -102.1 | 0 | 0 | 0 | 111.1 | P209 L210 W211 R216 M217 | P209-Y213 VanDerWaalsContact O-CB 3.3Å; P209-Y213 WeakPolarHBondContact O-CB 3.37Å; P209-Y213 PolarHBondContact O-N 3.41Å; L210-Y213 PolarHBondContact O-N 2.04Å; W211-Y213 PolarHBondContact O-N 2.73Å; Y213-R216 PolarHBondContact O-N 3.46Å; Y213-M217 HydrophobicContact CD1-CE 4.39Å; Y213-M217 HydrophobicContact CE1-CE 3.39Å; Y213-M217 HydrophobicContact CE2-CE 4.18Å; Y213-M217 PolarHBondContact O-N 2.76Å; Y213-M217 VanDerWaalsContact O-N 3.1Å; Y213-M217 WeakPolarHBondContact OH-CE 3.39Å |
| 214 | C | 72.9 | Confident | 70.2 | Confident | 20 Ų | 20 | 79.9 Ų | 79.9 | 14% | 0.135 | 38% | 0.383 | C | S | . | . | H | α-helix | trans | -58.7 | -49 | 174.2 | -82.6 | 0 | 0 | 0 | 0 | 111.7 | C37 L210 W211 R216 M217 F218 | C37-C214 HydrophobicContact CB-CB 3.45Å; C37-C214 VanDerWaalsContact CB-CB 3.45Å; C37-C214 WeakPolarHBondContact CB-SG 3.16Å; C37-C214 WeakPolarHBondContact SG-CB 3.31Å; C37-C214 CovalentContact SG-SG 2.01Å; C37-C214 PolarHBondContact SG-SG 3.44Å; L210-C214 WeakPolarHBondContact O-CB 3.46Å; L210-C214 PolarHBondContact O-N 3.19Å; W211-C214 PolarHBondContact O-N 2.88Å; C214-R216 PolarHBondContact O-N 3.03Å; C214-R216 VanDerWaalsContact O-N 3.16Å; C214-M217 PolarHBondContact O-N 3.43Å; C214-F218 WeakPolarHBondContact O-CD2 3.36Å; C214-F218 PolarHBondContact O-N 3.36Å |
| 215 | W | 71.4 | Confident | 68.5 | Low | 110 Ų | 110 | 80.4 Ų | 80.4 | 42% | 0.417 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -57.4 | -32.6 | 176.7 | -67.1 | -16.7 | 0 | 0 | 0 | 113.7 | W211 L212 P219 | W211-W215 HydrophobicContact CB-CZ2 4.38Å; W211-W215 HydrophobicContact CE3-CZ2 4.39Å; W211-W215 WeakPolarHBondContact O-CB 3.37Å; W211-W215 PolarHBondContact O-N 2.98Å; L212-W215 HydrophobicContact CD2-CE3 3.69Å; L212-W215 HydrophobicContact CD2-CZ3 3.78Å; L212-W215 HydrophobicContact CG-CE3 4.46Å; L212-W215 PolarHBondContact O-N 2.9Å; W215-P219 VanDerWaalsContact O-CD 3.32Å; W215-P219 WeakPolarHBondContact O-CD 3.21Å; W215-P219 WeakPolarHBondContact O-CG 3.06Å |
| 216 | R | 69 | Low | 66.8 | Low | 151 Ų | 151 | 85.8 Ų | 85.8 | 57% | 0.57 | 41% | 0.41 | S | S | * | . | H | α-helix | trans | -78.4 | -24.5 | 176.9 | -76.6 | -175.1 | -176.7 | -178.8 | 3.4 | 114.3 | S50 L212 Y213 C214 P219 | S50-R216 PolarHBondContact OG-NH2 3.45Å; L212-R216 WeakPolarHBondContact O-CG 3.43Å; L212-R216 PolarHBondContact O-N 3.33Å; Y213-R216 PolarHBondContact O-N 3.46Å; C214-R216 PolarHBondContact O-N 3.03Å; C214-R216 VanDerWaalsContact O-N 3.16Å; R216-P219 WeakPolarHBondContact O-CD 2.96Å |
| 217 | M | 65 | Low | 65.4 | Low | 82 Ų | 82 | 92.3 Ų | 92.3 | 40% | 0.404 | 44% | 0.438 | S | S | . | . | H | α-helix | trans | -80.8 | -32 | -179.7 | -164.9 | -177.9 | -73.6 | 0 | 0 | 112.2 | Y213 C214 T220 | Y213-M217 HydrophobicContact CD1-CE 4.39Å; Y213-M217 HydrophobicContact CE1-CE 3.39Å; Y213-M217 HydrophobicContact CE2-CE 4.18Å; Y213-M217 PolarHBondContact O-N 2.76Å; Y213-M217 VanDerWaalsContact O-N 3.1Å; Y213-M217 WeakPolarHBondContact OH-CE 3.39Å; C214-M217 PolarHBondContact O-N 3.43Å; M217-T220 PolarHBondContact O-OG1 3.49Å |
| 218 | F | 60 | Low | 64.1 | Low | 88 Ų | 88 | 96.3 Ų | 96.3 | 39% | 0.386 | 46% | 0.456 | S | S | . | . | G | 310 helix | trans | -79.9 | -4.3 | -178.5 | -72.6 | -77.4 | 0 | 0 | 0 | 119.3 | L34 C37 C214 T220 | L34-F218 HydrophobicContact CD2-CE1 4.32Å; L34-F218 HydrophobicContact CD2-CZ 3.94Å; L34-F218 HydrophobicContact CG-CZ 4.26Å; C37-F218 HydrophobicContact CB-CD2 4.19Å; C37-F218 HydrophobicContact CB-CE2 3.39Å; C37-F218 HydrophobicContact CB-CZ 4.11Å; C214-F218 WeakPolarHBondContact O-CD2 3.36Å; C214-F218 PolarHBondContact O-N 3.36Å; F218-T220 VanDerWaalsContact C-N 3.31Å; F218-T220 PolarHBondContact O-N 3.08Å |
| 219 | P | 57.7 | Low | 62.8 | Low | 78 Ų | 78 | 101.4 Ų | 101.4 | 51% | 0.506 | 48% | 0.478 | S | S | . | . | G | 310 helix | trans | -76.4 | -7.6 | 172.5 | -11.4 | 27.9 | 0 | 0 | 0 | 115 | W215 R216 | W215-P219 VanDerWaalsContact O-CD 3.32Å; W215-P219 WeakPolarHBondContact O-CD 3.21Å; W215-P219 WeakPolarHBondContact O-CG 3.06Å; R216-P219 WeakPolarHBondContact O-CD 2.96Å |
| 220 | T | 52.5 | Low | 62.2 | Low | 66 Ų | 66 | 105 Ų | 105 | 41% | 0.405 | 50% | 0.496 | S | S | . | . | G | 310 helix | trans | -100.7 | 7.6 | -165.1 | 46.4 | 0 | 0 | 0 | 0 | 116.2 | M217 F218 R224 | M217-T220 PolarHBondContact O-OG1 3.49Å; F218-T220 VanDerWaalsContact C-N 3.31Å; F218-T220 PolarHBondContact O-N 3.08Å; T220-R224 PolarHBondContact O-NE 3.32Å; T220-R224 VanDerWaalsContact O-NE 3.15Å |
| 221 | K | 51.8 | Low | 61.6 | Low | 170 Ų | 170 | 107.4 Ų | 107.4 | 74% | 0.739 | 50% | 0.504 | S | S | * | . | S | Bend | trans | -81.4 | -49.2 | 167.1 | -95.5 | -175.7 | 172.2 | -176.4 | 0 | 112.1 | K223 R224 D225 | K221-K223 VanDerWaalsContact C-N 3.29Å; K221-K223 PolarHBondContact O-N 2.84Å; K221-K223 VanDerWaalsContact O-N 3.17Å; K221-R224 PolarHBondContact O-N 3.29Å; K221-D225 PolarHBondContact O-N 3.5Å |
| 222 | G | 50.5 | Low | 61.1 | Low | 58 Ų | 58 | 109 Ų | 109 | 60% | 0.598 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -67.9 | -19.2 | -177.1 | 0 | 0 | 0 | 0 | 0 | 116.3 | ||
| 223 | K | 51.9 | Low | 60.8 | Low | 160 Ų | 160 | 112.3 Ų | 112.3 | 70% | 0.696 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -93.8 | -21.4 | 177.7 | -80.6 | -170.3 | 175.7 | -172.5 | 0 | 114.4 | K221 K227 | K221-K223 VanDerWaalsContact C-N 3.29Å; K221-K223 PolarHBondContact O-N 2.84Å; K221-K223 VanDerWaalsContact O-N 3.17Å; K223-K227 WeakPolarHBondContact O-CB 3.37Å; K223-K227 PolarHBondContact O-N 2.95Å |
| 224 | R | 54.3 | Low | 59.9 | Low | 152 Ų | 152 | 108.9 Ų | 108.9 | 57% | 0.574 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -76.7 | -41.8 | 175.2 | -92.7 | -175.2 | -79.7 | -169.1 | -4.1 | 110.7 | T220 K221 Q226 K227 E228 | T220-R224 PolarHBondContact O-NE 3.32Å; T220-R224 VanDerWaalsContact O-NE 3.15Å; K221-R224 PolarHBondContact O-N 3.29Å; R224-Q226 VanDerWaalsContact C-N 3.29Å; R224-Q226 PolarHBondContact O-N 3.45Å; R224-K227 PolarHBondContact O-N 3.33Å; R224-K227 VanDerWaalsContact O-N 3.16Å; R224-E228 WeakPolarHBondContact O-CB 3.42Å; R224-E228 PolarHBondContact O-N 2.87Å |
| 225 | D | 54.7 | Low | 58.5 | Low | 91 Ų | 91 | 118.2 Ų | 118.2 | 49% | 0.487 | 60% | 0.603 | S | S | . | * | H | α-helix | trans | -62.9 | -36.8 | 175.3 | -56.1 | -20.9 | 0 | 0 | 0 | 111.5 | K221 M229 | K221-D225 PolarHBondContact O-N 3.5Å; D225-M229 VanDerWaalsContact O-CB 3.26Å; D225-M229 WeakPolarHBondContact O-CB 3.34Å; D225-M229 WeakPolarHBondContact O-CG 3.44Å; D225-M229 PolarHBondContact O-N 3.03Å |
| 226 | Q | 52.7 | Low | 57.9 | Low | 123 Ų | 123 | 118.6 Ų | 118.6 | 58% | 0.575 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -71.6 | -35 | 176 | -168.7 | 174.4 | 31.5 | 0 | 0 | 113 | R224 L230 | R224-Q226 VanDerWaalsContact C-N 3.29Å; R224-Q226 PolarHBondContact O-N 3.45Å; Q226-L230 HydrophobicContact CG-CD1 4.14Å; Q226-L230 WeakPolarHBondContact O-CB 3.48Å; Q226-L230 WeakPolarHBondContact O-CD1 3.49Å; Q226-L230 VanDerWaalsContact O-CG 3.29Å; Q226-L230 WeakPolarHBondContact O-CG 3.29Å; Q226-L230 PolarHBondContact O-N 3.27Å |
| 227 | K | 57.3 | Low | 57.3 | Low | 139 Ų | 139 | 116.9 Ų | 116.9 | 60% | 0.604 | 61% | 0.614 | S | S | * | * | H | α-helix | trans | -74.4 | -40.4 | 177.9 | -163.2 | -177.9 | 177.4 | -163.4 | 0 | 111.1 | K223 R224 L230 E231 | K223-K227 WeakPolarHBondContact O-CB 3.37Å; K223-K227 PolarHBondContact O-N 2.95Å; R224-K227 PolarHBondContact O-N 3.33Å; R224-K227 VanDerWaalsContact O-N 3.16Å; K227-L230 PolarHBondContact O-N 3.03Å; K227-E231 WeakPolarHBondContact O-CB 3.38Å; K227-E231 PolarHBondContact O-N 3.09Å |
| 228 | E | 60 | Low | 56.9 | Low | 123 Ų | 123 | 118.8 Ų | 118.8 | 58% | 0.575 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -66.3 | -36.7 | 173.4 | -72.5 | -175.8 | -176.4 | 0 | 0 | 111.6 | R224 V232 | R224-E228 WeakPolarHBondContact O-CB 3.42Å; R224-E228 PolarHBondContact O-N 2.87Å; E228-V232 VanDerWaalsContact O-CB 3.32Å; E228-V232 WeakPolarHBondContact O-CB 3.47Å; E228-V232 WeakPolarHBondContact O-CG2 3.43Å; E228-V232 PolarHBondContact O-N 3.08Å |
| 229 | M | 56.3 | Low | 56.7 | Low | 142 Ų | 142 | 120.6 Ų | 120.6 | 70% | 0.7 | 64% | 0.64 | S | S | * | * | H | α-helix | trans | -67.8 | -32.4 | 172.6 | -75.5 | -175.9 | 179.3 | 0 | 0 | 113.4 | D225 S233 | D225-M229 VanDerWaalsContact O-CB 3.26Å; D225-M229 WeakPolarHBondContact O-CB 3.34Å; D225-M229 WeakPolarHBondContact O-CG 3.44Å; D225-M229 PolarHBondContact O-N 3.03Å; M229-S233 VanDerWaalsContact O-CB 3.23Å; M229-S233 WeakPolarHBondContact O-CB 3.48Å; M229-S233 PolarHBondContact O-N 3.01Å; M229-S233 VanDerWaalsContact O-N 3.17Å |
| 230 | L | 64.6 | Low | 56.6 | Low | 106 Ų | 106 | 123.3 Ų | 123.3 | 56% | 0.555 | 65% | 0.648 | S | S | * | * | H | α-helix | trans | -77.3 | -36.1 | 176.2 | -76.1 | 164.5 | 0 | 0 | 0 | 112.4 | Q226 K227 S233 G234 | Q226-L230 HydrophobicContact CG-CD1 4.14Å; Q226-L230 WeakPolarHBondContact O-CB 3.48Å; Q226-L230 WeakPolarHBondContact O-CD1 3.49Å; Q226-L230 VanDerWaalsContact O-CG 3.29Å; Q226-L230 WeakPolarHBondContact O-CG 3.29Å; Q226-L230 PolarHBondContact O-N 3.27Å; K227-L230 PolarHBondContact O-N 3.03Å; L230-S233 PolarHBondContact O-N 3.33Å; L230-G234 PolarHBondContact O-N 3.25Å |
| 231 | E | 65.8 | Low | 56.9 | Low | 146 Ų | 146 | 127.1 Ų | 127.1 | 68% | 0.682 | 66% | 0.664 | S | S | * | * | H | α-helix | trans | -70 | -34.5 | 174.3 | -118.9 | 166.9 | 164.1 | 0 | 0 | 112 | K227 S233 | K227-E231 WeakPolarHBondContact O-CB 3.38Å; K227-E231 PolarHBondContact O-N 3.09Å; E231-S233 VanDerWaalsContact C-N 3.3Å |
| 232 | V | 67.3 | Low | 57.3 | Low | 130 Ų | 130 | 124.1 Ų | 124.1 | 79% | 0.788 | 66% | 0.659 | S | S | * | * | H | α-helix | trans | -73.7 | -22.1 | 172.9 | 171.9 | 0 | 0 | 0 | 0 | 112.1 | E228 | E228-V232 VanDerWaalsContact O-CB 3.32Å; E228-V232 WeakPolarHBondContact O-CB 3.47Å; E228-V232 WeakPolarHBondContact O-CG2 3.43Å; E228-V232 PolarHBondContact O-N 3.08Å |
| 233 | S | 66.7 | Low | 57.8 | Low | 81 Ų | 81 | 129.2 Ų | 129.2 | 57% | 0.566 | 66% | 0.664 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.2 | 4.7 | -179.1 | -159.3 | 0 | 0 | 0 | 0 | 114.9 | M229 L230 E231 I235 | M229-S233 VanDerWaalsContact O-CB 3.23Å; M229-S233 WeakPolarHBondContact O-CB 3.48Å; M229-S233 PolarHBondContact O-N 3.01Å; M229-S233 VanDerWaalsContact O-N 3.17Å; L230-S233 PolarHBondContact O-N 3.33Å; E231-S233 VanDerWaalsContact C-N 3.3Å; S233-I235 PolarHBondContact O-N 3.11Å |
| 234 | G | 55.1 | Low | 58.3 | Low | 70 Ų | 70 | 126.6 Ų | 126.6 | 72% | 0.722 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 57.7 | 45.1 | 161.4 | 0 | 0 | 0 | 0 | 0 | 116.3 | L230 | L230-G234 PolarHBondContact O-N 3.25Š|
| 235 | I | 44.8 | Very low | 58.7 | Low | 216 Ų | 216 | 124.3 Ų | 124.3 | 100% | 1.108 | 67% | 0.669 | S | S | * | * | trans | -110.2 | 0 | 164.8 | -56.4 | 178.4 | 0 | 0 | 0 | 109.2 | S233 | S233-I235 PolarHBondContact O-N 3.11Š|
Retrieved 235 of 235 residues in 64.5 ms
(Link to these results)