| 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 | 30.5 | Very low | 31.7 | Very low | 244 Ų | 244 | 125.5 Ų | 125.5 | 100% | 1.202 | 70% | 0.7 | S | S | * | * | 0 | 94 | 0 | -87.1 | 174.7 | 177.4 | 0 | 0 | 108.5 | |||||
| 2 | T | 22.5 | Very low | 31.9 | Very low | 131 Ų | 131 | 123.9 Ų | 123.9 | 80% | 0.804 | 69% | 0.689 | S | S | * | * | trans | -144.7 | 88.7 | 165.3 | 37.9 | 0 | 0 | 0 | 0 | 105.3 | F4 | T2-F4 PolarHBondContact O-N 3.45Š| ||
| 3 | G | 25.9 | Very low | 31.6 | Very low | 70 Ų | 70 | 127.5 Ų | 127.5 | 72% | 0.722 | 70% | 0.698 | S | S | * | * | trans | -68.7 | 118.8 | 175.2 | 0 | 0 | 0 | 0 | 0 | 108.5 | T5 | G3-T5 PolarHBondContact O-N 3.34Š| ||
| 4 | F | 26.9 | Very low | 31.6 | Very low | 195 Ų | 195 | 126.1 Ų | 126.1 | 86% | 0.855 | 70% | 0.698 | S | S | * | * | trans | -60.9 | 98.2 | 170.6 | -89.2 | -91.5 | 0 | 0 | 0 | 109.7 | T2 N6 | T2-F4 PolarHBondContact O-N 3.45Å; F4-N6 PolarHBondContact O-N 3.15Å; F4-N6 VanDerWaalsContact O-N 3.15Å | ||
| 5 | T | 33.3 | Very low | 31.7 | Very low | 130 Ų | 130 | 126.9 Ų | 126.9 | 80% | 0.798 | 71% | 0.707 | S | S | * | * | trans | -72.9 | 96.1 | 161.1 | 39.3 | 0 | 0 | 0 | 0 | 107.9 | G3 A7 | G3-T5 PolarHBondContact O-N 3.34Å; T5-A7 VanDerWaalsContact C-N 3.29Å; T5-A7 PolarHBondContact O-N 3.31Å | ||
| 6 | N | 33.2 | Very low | 31.3 | Very low | 102 Ų | 102 | 130.4 Ų | 130.4 | 55% | 0.545 | 71% | 0.713 | S | S | . | * | trans | -72.4 | 84.7 | 171.7 | -101.9 | -34.1 | 0 | 0 | 0 | 109.7 | F4 G8 | F4-N6 PolarHBondContact O-N 3.15Å; F4-N6 VanDerWaalsContact O-N 3.15Å; N6-G8 PolarHBondContact O-N 3.05Å; N6-G8 VanDerWaalsContact O-N 3.09Å | ||
| 7 | A | 34.3 | Very low | 31.3 | Very low | 54 Ų | 54 | 128.1 Ų | 128.1 | 45% | 0.446 | 71% | 0.705 | S | S | . | * | trans | -82.6 | 44 | -177.8 | 0 | 0 | 0 | 0 | 0 | 113.6 | T5 K489 | T5-A7 VanDerWaalsContact C-N 3.29Å; T5-A7 PolarHBondContact O-N 3.31Å; A7-K489 PolarHBondContact O-NZ 3.43Å | ||
| 8 | G | 32.3 | Very low | 31.2 | Very low | 26 Ų | 26 | 131.7 Ų | 131.7 | 27% | 0.268 | 71% | 0.713 | S | S | . | * | trans | -97.1 | 5.7 | -176 | 0 | 0 | 0 | 0 | 0 | 115.9 | N6 | N6-G8 PolarHBondContact O-N 3.05Å; N6-G8 VanDerWaalsContact O-N 3.09Å | ||
| 9 | F | 40.8 | Very low | 31.2 | Very low | 140 Ų | 140 | 130.8 Ų | 130.8 | 61% | 0.614 | 73% | 0.725 | S | S | * | * | trans | -138.6 | 71.3 | -175.5 | -72.5 | -84.1 | 0 | 0 | 0 | 110.9 | ||||
| 10 | E | 37.2 | Very low | 31.3 | Very low | 142 Ų | 142 | 128.3 Ų | 128.3 | 66% | 0.664 | 73% | 0.73 | S | S | * | * | trans | -105.9 | -7.6 | 172.8 | -100.7 | 169.2 | 155.1 | 0 | 0 | 113.7 | K489 | E10-K489 IonicContact OE2-NZ 3.68Š| ||
| 11 | N | 32.2 | Very low | 31.5 | Very low | 146 Ų | 146 | 129.4 Ų | 129.4 | 78% | 0.781 | 73% | 0.727 | S | S | * | * | trans | -107.3 | 19.3 | -169.9 | -65.8 | 2.6 | 0 | 0 | 0 | 115.5 | ||||
| 12 | D | 33.6 | Very low | 31.5 | Very low | 107 Ų | 107 | 126.1 Ų | 126.1 | 57% | 0.572 | 71% | 0.709 | S | S | * | * | S | Bend | trans | -93.1 | 103.4 | 151.6 | -83.5 | -13.6 | 0 | 0 | 0 | 105 | R424 | D12-R424 IonicContact OD2-CZ 3.79Å; D12-R424 IonicContact OD2-NH1 3.55Å; D12-R424 PolarHBondContact OD2-NH1 3.05Å |
| 13 | E | 28.2 | Very low | 32.2 | Very low | 171 Ų | 171 | 124 Ų | 124 | 80% | 0.799 | 70% | 0.697 | S | S | * | * | trans | -41.8 | 132.5 | 176.2 | -74.5 | -170.8 | 162.7 | 0 | 0 | 110.1 | V15 | E13-V15 PolarHBondContact O-N 3.32Š| ||
| 14 | P | 31.4 | Very low | 33 | Very low | 108 Ų | 108 | 124.1 Ų | 124.1 | 70% | 0.701 | 68% | 0.681 | S | S | * | * | trans | -61.3 | 108.6 | 170.4 | 25.7 | -30.2 | 0 | 0 | 0 | 106.2 | K16 | P14-K16 PolarHBondContact O-N 3.49Š| ||
| 15 | V | 32.9 | Very low | 33.6 | Very low | 138 Ų | 138 | 119 Ų | 119 | 84% | 0.836 | 67% | 0.666 | S | S | * | * | trans | -55.7 | 103 | 155.4 | 177 | 0 | 0 | 0 | 0 | 104 | E13 P17 | E13-V15 PolarHBondContact O-N 3.32Å; V15-P17 VanDerWaalsContact O-N 3.15Å | ||
| 16 | K | 25.4 | Very low | 33.8 | Very low | 183 Ų | 183 | 115.2 Ų | 115.2 | 80% | 0.796 | 65% | 0.648 | S | S | * | * | P | Polyproline II helix | trans | -47.7 | 126.8 | 177.1 | -83.5 | -179.8 | 176.4 | 176.5 | 0 | 106.1 | P14 K18 | P14-K16 PolarHBondContact O-N 3.49Å; K16-K18 PolarHBondContact O-N 3.03Å |
| 17 | P | 31.1 | Very low | 34.2 | Very low | 90 Ų | 90 | 112.8 Ų | 112.8 | 58% | 0.584 | 64% | 0.639 | S | S | * | * | P | Polyproline II helix | trans | -50 | 134 | 165.4 | -15.7 | 26.1 | 0 | 0 | 0 | 106.5 | V15 A19 F21 | V15-P17 VanDerWaalsContact O-N 3.15Å; P17-A19 PolarHBondContact O-N 3.45Å; P17-A19 VanDerWaalsContact O-N 3.12Å; P17-F21 HydrophobicContact CB-CB 3.86Å |
| 18 | K | 30.2 | Very low | 34.6 | Very low | 194 Ų | 194 | 112.8 Ų | 112.8 | 84% | 0.843 | 63% | 0.631 | S | S | * | * | P | Polyproline II helix | trans | -46.3 | 128.7 | 169.4 | -76.2 | -177.1 | 174.1 | -177.1 | 0 | 107.1 | K16 G20 F21 | K16-K18 PolarHBondContact O-N 3.03Å; K18-G20 PolarHBondContact O-N 3.48Å; K18-F21 PolarHBondContact O-N 3.29Å |
| 19 | A | 31.6 | Very low | 35.1 | Very low | 114 Ų | 114 | 121.9 Ų | 121.9 | 94% | 0.942 | 66% | 0.657 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -48.6 | 113.6 | 178.9 | 0 | 0 | 0 | 0 | 0 | 108.3 | P17 | P17-A19 PolarHBondContact O-N 3.45Å; P17-A19 VanDerWaalsContact O-N 3.12Å |
| 20 | G | 33 | Very low | 35.2 | Very low | 80 Ų | 80 | 122.3 Ų | 122.3 | 83% | 0.825 | 66% | 0.661 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 132.6 | -5.4 | -168.2 | 0 | 0 | 0 | 0 | 0 | 115.8 | K18 | K18-G20 PolarHBondContact O-N 3.48Š|
| 21 | F | 36.1 | Very low | 35.8 | Very low | 152 Ų | 152 | 122.8 Ų | 122.8 | 67% | 0.667 | 66% | 0.661 | S | S | * | * | trans | -108.2 | 66.1 | 175.6 | -138.4 | -89 | 0 | 0 | 0 | 111.8 | P17 K18 | P17-F21 HydrophobicContact CB-CB 3.86Å; K18-F21 PolarHBondContact O-N 3.29Å | ||
| 22 | E | 30.5 | Very low | 36.8 | Very low | 176 Ų | 176 | 117.9 Ų | 117.9 | 82% | 0.822 | 64% | 0.636 | S | S | * | * | trans | -72.5 | 127.9 | 150.5 | -79.6 | -174.1 | 147.5 | 0 | 0 | 106.9 | D24 | E22-D24 PolarHBondContact O-N 3.27Š| ||
| 23 | P | 36.6 | Very low | 37.9 | Very low | 85 Ų | 85 | 118.3 Ų | 118.3 | 55% | 0.552 | 64% | 0.643 | S | S | * | * | trans | -60.8 | 111.9 | 166.9 | 24.9 | -28.8 | 0 | 0 | 0 | 106 | T25 | P23-T25 HydrophobicContact CB-CG2 4.41Å; P23-T25 PolarHBondContact O-N 3.09Å; P23-T25 PolarHBondContact O-OG1 2.92Å | ||
| 24 | D | 41.5 | Very low | 39.6 | Very low | 73 Ų | 73 | 114.1 Ų | 114.1 | 39% | 0.39 | 63% | 0.625 | S | S | . | * | trans | -64.6 | 71 | 178.1 | -175.6 | 17.4 | 0 | 0 | 0 | 110.1 | E22 A26 S27 N280 | E22-D24 PolarHBondContact O-N 3.27Å; D24-A26 PolarHBondContact OD1-N 3.42Å; D24-S27 PolarHBondContact O-OG 3.15Å; D24-S27 PolarHBondContact OD1-N 2.9Å; D24-S27 PolarHBondContact OD1-OG 3.23Å; D24-S27 WeakPolarHBondContact OD2-CB 3.48Å; D24-S27 PolarHBondContact OD2-OG 3.01Å; D24-N280 VanDerWaalsContact C-ND2 3.3Å; D24-N280 PolarHBondContact N-ND2 2.84Å; D24-N280 PolarHBondContact O-ND2 3.32Å | ||
| 25 | T | 40.9 | Very low | 41.4 | Very low | 88 Ų | 88 | 113.6 Ų | 113.6 | 54% | 0.54 | 62% | 0.617 | S | S | . | * | trans | -77.1 | -13.5 | 169.3 | 49.2 | 0 | 0 | 0 | 0 | 109.7 | P23 R29 | P23-T25 HydrophobicContact CB-CG2 4.41Å; P23-T25 PolarHBondContact O-N 3.09Å; P23-T25 PolarHBondContact O-OG1 2.92Å; T25-R29 PolarHBondContact O-N 3Å | ||
| 26 | A | 37.7 | Very low | 43 | Very low | 51 Ų | 51 | 112.6 Ų | 112.6 | 42% | 0.421 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -73 | -33.7 | 174.6 | 0 | 0 | 0 | 0 | 0 | 113 | D24 L28 R29 | D24-A26 PolarHBondContact OD1-N 3.42Å; A26-L28 VanDerWaalsContact C-N 3.35Å; A26-L28 PolarHBondContact O-N 2.94Å; A26-R29 WeakPolarHBondContact O-CB 3.31Å; A26-R29 PolarHBondContact O-N 3.09Å; A26-R29 VanDerWaalsContact O-N 3.13Å |
| 27 | S | 40.8 | Very low | 45.7 | Very low | 50 Ų | 50 | 106.1 Ų | 106.1 | 35% | 0.35 | 60% | 0.598 | S | S | . | * | H | α-helix | trans | -75.9 | -20.2 | 175.4 | 64 | 0 | 0 | 0 | 0 | 114.6 | D24 | D24-S27 PolarHBondContact O-OG 3.15Å; D24-S27 PolarHBondContact OD1-N 2.9Å; D24-S27 PolarHBondContact OD1-OG 3.23Å; D24-S27 WeakPolarHBondContact OD2-CB 3.48Å; D24-S27 PolarHBondContact OD2-OG 3.01Å |
| 28 | L | 43.5 | Very low | 48.3 | Very low | 55 Ų | 55 | 102 Ų | 102 | 29% | 0.288 | 57% | 0.571 | S | S | . | * | H | α-helix | trans | -77.2 | -25.2 | 166 | -85.7 | 161.6 | 0 | 0 | 0 | 112.4 | A26 E30 | A26-L28 VanDerWaalsContact C-N 3.35Å; A26-L28 PolarHBondContact O-N 2.94Å; L28-E30 VanDerWaalsContact C-N 3.26Å; L28-E30 PolarHBondContact O-N 3.38Å |
| 29 | R | 43 | Very low | 51.1 | Low | 216 Ų | 216 | 96.6 Ų | 96.6 | 82% | 0.815 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -63.6 | -28.1 | -178.9 | -110.2 | 178.2 | -174.9 | 177.6 | 0.3 | 112.7 | T25 A26 | T25-R29 PolarHBondContact O-N 3Å; A26-R29 WeakPolarHBondContact O-CB 3.31Å; A26-R29 PolarHBondContact O-N 3.09Å; A26-R29 VanDerWaalsContact O-N 3.13Å |
| 30 | E | 42.3 | Very low | 53.9 | Low | 150 Ų | 150 | 100 Ų | 100 | 70% | 0.701 | 54% | 0.536 | S | S | * | . | S | Bend | trans | -90.5 | -27.5 | -157.9 | -122.1 | -177.4 | -162.5 | 0 | 0 | 116.1 | L28 | L28-E30 VanDerWaalsContact C-N 3.26Å; L28-E30 PolarHBondContact O-N 3.38Å |
| 31 | K | 48.8 | Very low | 56.7 | Low | 151 Ų | 151 | 100.5 Ų | 100.5 | 66% | 0.657 | 51% | 0.513 | S | S | * | . | S | Bend | trans | -150.9 | 39.5 | -167.4 | -61.3 | -176.9 | -171.6 | 175.9 | 0 | 117 | ||
| 32 | V | 54.4 | Low | 59.4 | Low | 43 Ų | 43 | 93.2 Ų | 93.2 | 26% | 0.261 | 48% | 0.481 | S | S | . | . | trans | -107 | 106.4 | 157.8 | -174.5 | 0 | 0 | 0 | 0 | 106.6 | L34 | V32-L34 VanDerWaalsContact C-N 3.35Å; V32-L34 HydrophobicContact CB-CD2 4.32Å; V32-L34 HydrophobicContact CB-CG 4.43Å; V32-L34 HydrophobicContact CG1-CD2 3.59Å; V32-L34 HydrophobicContact CG1-CG 4.1Å; V32-L34 PolarHBondContact O-N 3.5Å | ||
| 33 | V | 56 | Low | 62.5 | Low | 117 Ų | 117 | 87.2 Ų | 87.2 | 71% | 0.709 | 45% | 0.454 | S | S | * | . | trans | -70.2 | 97.4 | 172.6 | -177.7 | 0 | 0 | 0 | 0 | 106.9 | N35 | V33-N35 PolarHBondContact O-N 3Š| ||
| 34 | L | 64.6 | Low | 65.3 | Low | 83 Ų | 83 | 87.4 Ų | 87.4 | 44% | 0.435 | 45% | 0.446 | S | S | . | . | trans | -82.8 | 88.1 | -177.5 | -65.1 | 168.7 | 0 | 0 | 0 | 108.9 | V32 E38 V159 I163 | V32-L34 VanDerWaalsContact C-N 3.35Å; V32-L34 HydrophobicContact CB-CD2 4.32Å; V32-L34 HydrophobicContact CB-CG 4.43Å; V32-L34 HydrophobicContact CG1-CD2 3.59Å; V32-L34 HydrophobicContact CG1-CG 4.1Å; V32-L34 PolarHBondContact O-N 3.5Å; L34-E38 HydrophobicContact CD2-CG 4.47Å; L34-V159 HydrophobicContact CD2-CG1 3.96Å; L34-I163 HydrophobicContact CB-CG1 4.49Å; L34-I163 HydrophobicContact CD1-CG1 4.09Å; L34-I163 HydrophobicContact CD2-CD1 3.86Å; L34-I163 HydrophobicContact CD2-CG1 3.83Å; L34-I163 HydrophobicContact CG-CG1 4.35Å | ||
| 35 | N | 68.8 | Low | 67.9 | Low | 96 Ų | 96 | 83.9 Ų | 83.9 | 51% | 0.513 | 43% | 0.428 | S | S | . | . | trans | -70.2 | 153.4 | 172.4 | -83.5 | 4.1 | 0 | 0 | 0 | 111 | V33 G37 E38 | V33-N35 PolarHBondContact O-N 3Å; N35-G37 PolarHBondContact O-N 3.35Å; N35-G37 VanDerWaalsContact O-N 3.1Å; N35-E38 WeakPolarHBondContact O-CB 3.46Å; N35-E38 PolarHBondContact O-N 3.4Å | ||
| 36 | P | 67.5 | Low | 70.4 | Confident | 118 Ų | 118 | 80 Ų | 80 | 77% | 0.766 | 40% | 0.403 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -54.7 | -30.8 | 174.6 | -25.4 | 33.3 | 0 | 0 | 0 | 113.8 | E38 | P36-E38 PolarHBondContact O-N 2.97Š|
| 37 | G | 80.6 | Confident | 73.2 | Confident | 46 Ų | 46 | 79.7 Ų | 79.7 | 47% | 0.474 | 40% | 0.398 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.6 | -11.5 | 175.2 | 0 | 0 | 0 | 0 | 0 | 115.1 | N35 K39 W40 R41 | N35-G37 PolarHBondContact O-N 3.35Å; N35-G37 VanDerWaalsContact O-N 3.1Å; G37-K39 VanDerWaalsContact C-N 3.29Å; G37-K39 PolarHBondContact O-N 3.04Å; G37-W40 PolarHBondContact O-N 3.22Å; G37-R41 PolarHBondContact O-N 3.09Å; G37-R41 VanDerWaalsContact O-N 3.09Å |
| 38 | E | 86.7 | Confident | 75.9 | Confident | 4 Ų | 4 | 78.2 Ų | 78.2 | 2% | 0.019 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -66.7 | -34 | -178.4 | -161 | 62.4 | -157.2 | 0 | 0 | 111.8 | L34 N35 P36 W40 R41 I42 I163 R271 Y272 | L34-E38 HydrophobicContact CD2-CG 4.47Å; N35-E38 WeakPolarHBondContact O-CB 3.46Å; N35-E38 PolarHBondContact O-N 3.4Å; P36-E38 PolarHBondContact O-N 2.97Å; E38-W40 PolarHBondContact O-N 2.92Å; E38-R41 PolarHBondContact O-N 2.89Å; E38-I42 HydrophobicContact CG-CD1 4.44Å; E38-I42 WeakPolarHBondContact O-CG1 3.48Å; E38-I42 PolarHBondContact O-N 3.32Å; E38-I163 HydrophobicContact CB-CD1 4.14Å; E38-I163 HydrophobicContact CG-CD1 4.11Å; E38-R271 IonicContact OE1-CZ 2.88Å; E38-R271 IonicContact OE1-NH1 2.68Å; E38-R271 PolarHBondContact OE1-NH1 3.07Å; E38-R271 IonicContact OE2-CZ 3.44Å; E38-R271 IonicContact OE2-NH1 2.73Å; E38-R271 PolarHBondContact OE2-NH1 3.31Å; E38-R271 IonicContact OE2-NH2 3.72Å; E38-R271 PolarHBondContact OE2-NH2 3.01Å; E38-R271 VanDerWaalsContact OE2-NH2 3.07Å; E38-Y272 VanDerWaalsContact OE1-CE1 3.26Å; E38-Y272 WeakPolarHBondContact OE1-CE1 3.38Å; E38-Y272 VanDerWaalsContact OE1-CZ 3.28Å; E38-Y272 PolarHBondContact OE1-OH 3.09Å |
| 39 | K | 89.3 | Confident | 78.5 | Confident | 80 Ų | 80 | 75.6 Ų | 75.6 | 35% | 0.348 | 37% | 0.373 | S | S | . | . | H | α-helix | trans | -55.1 | -51.6 | 173.6 | -175.1 | -172.9 | 175.4 | -178.8 | 0 | 111.1 | G37 R41 I42 L43 Y160 T164 | G37-K39 VanDerWaalsContact C-N 3.29Å; G37-K39 PolarHBondContact O-N 3.04Å; K39-R41 VanDerWaalsContact C-N 3.33Å; K39-R41 PolarHBondContact O-N 3.41Å; K39-I42 PolarHBondContact O-N 3.08Å; K39-L43 HydrophobicContact CG-CD1 4.49Å; K39-L43 WeakPolarHBondContact O-CG 3.13Å; K39-L43 PolarHBondContact O-N 2.88Å; K39-Y160 HydrophobicContact CB-CE2 4.45Å; K39-Y160 HydrophobicContact CD-CE2 4.34Å; K39-Y160 WeakPolarHBondContact CE-OH 3.38Å; K39-Y160 HydrophobicContact CG-CD2 4.15Å; K39-Y160 HydrophobicContact CG-CE2 3.4Å; K39-T164 HydrophobicContact CD-CG2 4.41Å |
| 40 | W | 90.3 | Very high | 81 | Confident | 187 Ų | 187 | 65.3 Ų | 65.3 | 71% | 0.708 | 33% | 0.334 | S | S | * | . | H | α-helix | trans | -66.1 | -36.5 | -179.9 | -73.3 | 108.3 | 0 | 0 | 0 | 112.2 | G37 E38 L43 K44 | G37-W40 PolarHBondContact O-N 3.22Å; E38-W40 PolarHBondContact O-N 2.92Å; W40-L43 HydrophobicContact CE3-CD1 4.46Å; W40-L43 PolarHBondContact O-N 3.06Å; W40-K44 VanDerWaalsContact O-CB 3.31Å; W40-K44 WeakPolarHBondContact O-CB 3.36Å; W40-K44 PolarHBondContact O-N 3.23Å |
| 41 | R | 91.8 | Very high | 83.6 | Confident | 89 Ų | 89 | 62.1 Ų | 62.1 | 34% | 0.336 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -64.2 | -42.7 | 175.6 | -165.5 | 177.2 | -175 | 154.3 | 6.2 | 112.2 | G37 E38 K39 K44 N45 D267 | G37-R41 PolarHBondContact O-N 3.09Å; G37-R41 VanDerWaalsContact O-N 3.09Å; E38-R41 PolarHBondContact O-N 2.89Å; K39-R41 VanDerWaalsContact C-N 3.33Å; K39-R41 PolarHBondContact O-N 3.41Å; R41-K44 WeakPolarHBondContact O-CB 3.29Å; R41-K44 PolarHBondContact O-N 3.06Å; R41-N45 VanDerWaalsContact O-CG 3.32Å; R41-N45 PolarHBondContact O-N 3.02Å; R41-N45 PolarHBondContact O-ND2 2.79Å; R41-D267 VanDerWaalsContact CG-OD2 3.29Å; R41-D267 WeakPolarHBondContact CG-OD2 3.42Å; R41-D267 IonicContact CZ-OD1 3.09Å; R41-D267 IonicContact CZ-OD2 3.55Å; R41-D267 VanDerWaalsContact NE-CG 3.25Å; R41-D267 IonicContact NE-OD1 3.65Å; R41-D267 IonicContact NE-OD2 3.91Å; R41-D267 PolarHBondContact NE-OD2 2.75Å; R41-D267 IonicContact NH2-OD1 3.75Å; R41-D267 PolarHBondContact NH2-OD1 3.12Å; R41-D267 IonicContact NH2-OD2 3.93Å |
| 42 | I | 92.8 | Very high | 86 | Confident | 0 Ų | 0 | 54.9 Ų | 54.9 | 0% | 0 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -61.9 | -48.1 | 175.3 | -69.5 | 167.9 | 0 | 0 | 0 | 110.5 | E38 K39 K44 N45 I46 V156 V159 Y160 I163 F175 | E38-I42 HydrophobicContact CG-CD1 4.44Å; E38-I42 WeakPolarHBondContact O-CG1 3.48Å; E38-I42 PolarHBondContact O-N 3.32Å; K39-I42 PolarHBondContact O-N 3.08Å; I42-K44 VanDerWaalsContact C-N 3.33Å; I42-K44 PolarHBondContact O-N 3.37Å; I42-N45 PolarHBondContact O-N 3.46Å; I42-N45 VanDerWaalsContact O-N 3.15Å; I42-I46 HydrophobicContact CG2-CD1 3.61Å; I42-I46 HydrophobicContact CG2-CG1 4.44Å; I42-I46 WeakPolarHBondContact O-CD1 3.49Å; I42-I46 WeakPolarHBondContact O-CG1 3.49Å; I42-I46 PolarHBondContact O-N 3.04Å; I42-V156 HydrophobicContact CG1-CB 4.43Å; I42-V156 HydrophobicContact CG2-CB 3.84Å; I42-V156 HydrophobicContact CG2-CG2 4.01Å; I42-V159 HydrophobicContact CD1-CB 4.23Å; I42-V159 HydrophobicContact CD1-CG1 3.93Å; I42-Y160 HydrophobicContact CB-CD2 4.24Å; I42-Y160 HydrophobicContact CD1-CD2 4.43Å; I42-Y160 HydrophobicContact CG2-CD2 3.95Å; I42-Y160 HydrophobicContact CG2-CG 4.45Å; I42-I163 HydrophobicContact CD1-CD1 4.02Å; I42-F175 HydrophobicContact CG2-CE2 4.06Å; I42-F175 HydrophobicContact CG2-CZ 4.27Å |
| 43 | L | 94.3 | Very high | 88 | Confident | 49 Ų | 49 | 52.9 Ų | 52.9 | 26% | 0.257 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -60.1 | -43.3 | 177.5 | -66.8 | 175.9 | 0 | 0 | 0 | 111.7 | K39 W40 N45 I46 S47 Y160 F175 | K39-L43 HydrophobicContact CG-CD1 4.49Å; K39-L43 WeakPolarHBondContact O-CG 3.13Å; K39-L43 PolarHBondContact O-N 2.88Å; W40-L43 HydrophobicContact CE3-CD1 4.46Å; W40-L43 PolarHBondContact O-N 3.06Å; L43-N45 PolarHBondContact O-N 3.15Å; L43-I46 PolarHBondContact O-N 3.06Å; L43-S47 PolarHBondContact O-N 3.22Å; L43-S47 PolarHBondContact O-OG 3.22Å; L43-Y160 HydrophobicContact CD1-CE2 4.21Å; L43-Y160 HydrophobicContact CD2-CE2 3.86Å; L43-Y160 HydrophobicContact CG-CE2 3.88Å; L43-F175 HydrophobicContact CD2-CE1 4.05Å; L43-F175 HydrophobicContact CD2-CZ 4.27Å |
| 44 | K | 95.6 | Very high | 89.9 | Confident | 89 Ų | 89 | 49.3 Ų | 49.3 | 39% | 0.387 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -54.9 | -49.1 | 172.8 | -176.5 | -153.5 | 65 | 167.6 | 0 | 111.1 | W40 R41 I42 I46 S47 I48 D267 | W40-K44 VanDerWaalsContact O-CB 3.31Å; W40-K44 WeakPolarHBondContact O-CB 3.36Å; W40-K44 PolarHBondContact O-N 3.23Å; R41-K44 WeakPolarHBondContact O-CB 3.29Å; R41-K44 PolarHBondContact O-N 3.06Å; I42-K44 VanDerWaalsContact C-N 3.33Å; I42-K44 PolarHBondContact O-N 3.37Å; K44-I46 PolarHBondContact O-N 2.75Å; K44-S47 PolarHBondContact O-N 3.27Å; K44-I48 HydrophobicContact CD-CD1 4.02Å; K44-I48 HydrophobicContact CG-CD1 3.75Å; K44-I48 HydrophobicContact CG-CG1 4.49Å; K44-I48 WeakPolarHBondContact O-CB 3.26Å; K44-I48 WeakPolarHBondContact O-CD1 3.33Å; K44-I48 WeakPolarHBondContact O-CG1 3.25Å; K44-I48 PolarHBondContact O-N 3.04Å; K44-D267 IonicContact NZ-OD1 3.96Å; K44-D267 IonicContact NZ-OD2 2.73Å; K44-D267 PolarHBondContact NZ-OD2 3.3Å |
| 45 | N | 95.8 | Very high | 91.5 | Very high | 0 Ų | 0 | 46.8 Ų | 46.8 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -65.2 | -37.2 | -178.9 | -72 | -36.8 | 0 | 0 | 0 | 113 | R41 I42 L43 I48 I49 Y152 L266 D267 | R41-N45 VanDerWaalsContact O-CG 3.32Å; R41-N45 PolarHBondContact O-N 3.02Å; R41-N45 PolarHBondContact O-ND2 2.79Å; I42-N45 PolarHBondContact O-N 3.46Å; I42-N45 VanDerWaalsContact O-N 3.15Å; L43-N45 PolarHBondContact O-N 3.15Å; N45-I48 PolarHBondContact O-N 3.46Å; N45-I49 WeakPolarHBondContact O-CG1 3.33Å; N45-I49 PolarHBondContact O-N 3.3Å; N45-Y152 HydrophobicContact CB-CE1 3.98Å; N45-Y152 WeakPolarHBondContact CB-OH 3.26Å; N45-Y152 PolarHBondContact ND2-OH 3.31Å; N45-L266 HydrophobicContact CB-CD1 3.85Å; N45-D267 WeakPolarHBondContact ND2-CB 3.44Å; N45-D267 PolarHBondContact ND2-OD2 2.85Å; N45-D267 PolarHBondContact OD1-N 3.26Å; N45-D267 VanDerWaalsContact OD1-N 3.15Å; N45-D267 PolarHBondContact OD1-OD2 3.28Å |
| 46 | I | 94.6 | Very high | 92.9 | Very high | 5 Ų | 5 | 42.2 Ų | 42.2 | 3% | 0.026 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -65.2 | -43.8 | 175.1 | -66.9 | 157.4 | 0 | 0 | 0 | 110.4 | I42 L43 K44 I49 S50 V156 F175 F178 | I42-I46 HydrophobicContact CG2-CD1 3.61Å; I42-I46 HydrophobicContact CG2-CG1 4.44Å; I42-I46 WeakPolarHBondContact O-CD1 3.49Å; I42-I46 WeakPolarHBondContact O-CG1 3.49Å; I42-I46 PolarHBondContact O-N 3.04Å; L43-I46 PolarHBondContact O-N 3.06Å; K44-I46 PolarHBondContact O-N 2.75Å; I46-I49 PolarHBondContact O-N 2.89Å; I46-S50 WeakPolarHBondContact O-CB 3.35Å; I46-S50 PolarHBondContact O-N 3.46Å; I46-S50 PolarHBondContact O-OG 3.34Å; I46-V156 HydrophobicContact CD1-CG2 4.13Å; I46-V156 HydrophobicContact CG1-CG2 4Å; I46-F175 HydrophobicContact CD1-CB 4.42Å; I46-F175 HydrophobicContact CD1-CD1 3.75Å; I46-F175 HydrophobicContact CD1-CD2 3.3Å; I46-F175 HydrophobicContact CD1-CE1 3.65Å; I46-F175 HydrophobicContact CD1-CE2 3.18Å; I46-F175 HydrophobicContact CD1-CG 3.58Å; I46-F175 HydrophobicContact CD1-CZ 3.36Å; I46-F175 HydrophobicContact CG1-CD2 4.27Å; I46-F175 HydrophobicContact CG1-CE2 4.46Å; I46-F175 HydrophobicContact CG1-CG 4.47Å; I46-F178 HydrophobicContact CG2-CD1 3.93Å; I46-F178 HydrophobicContact CG2-CE1 4.44Å |
| 47 | S | 96.3 | Very high | 94.2 | Very high | 45 Ų | 45 | 37 Ų | 37 | 32% | 0.315 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -61.3 | -44 | 174.5 | -61.2 | 0 | 0 | 0 | 0 | 111.9 | L43 K44 I49 S50 I51 | L43-S47 PolarHBondContact O-N 3.22Å; L43-S47 PolarHBondContact O-OG 3.22Å; K44-S47 PolarHBondContact O-N 3.27Å; S47-I49 PolarHBondContact O-N 3.24Å; S47-S50 PolarHBondContact O-N 3.4Å; S47-I51 WeakPolarHBondContact O-CB 3.48Å; S47-I51 VanDerWaalsContact O-CG1 3.27Å; S47-I51 WeakPolarHBondContact O-CG1 3.13Å; S47-I51 PolarHBondContact O-N 3.48Å |
| 48 | I | 97.8 | Very high | 95 | Very high | 20 Ų | 20 | 35.2 Ų | 35.2 | 10% | 0.103 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -58.8 | -49.2 | 177.3 | -72.3 | 163.7 | 0 | 0 | 0 | 111.3 | K44 N45 S50 A52 I261 I262 F265 L266 | K44-I48 HydrophobicContact CD-CD1 4.02Å; K44-I48 HydrophobicContact CG-CD1 3.75Å; K44-I48 HydrophobicContact CG-CG1 4.49Å; K44-I48 WeakPolarHBondContact O-CB 3.26Å; K44-I48 WeakPolarHBondContact O-CD1 3.33Å; K44-I48 WeakPolarHBondContact O-CG1 3.25Å; K44-I48 PolarHBondContact O-N 3.04Å; N45-I48 PolarHBondContact O-N 3.46Å; I48-S50 VanDerWaalsContact C-N 3.33Å; I48-S50 PolarHBondContact O-N 3.29Å; I48-A52 VanDerWaalsContact O-CB 3.3Å; I48-A52 WeakPolarHBondContact O-CB 3.13Å; I48-A52 PolarHBondContact O-N 3.33Å; I48-I261 HydrophobicContact CG2-CG2 3.74Å; I48-I262 HydrophobicContact CG2-CD1 4.4Å; I48-F265 HydrophobicContact CD1-CB 3.73Å; I48-F265 WeakPolarHBondContact CD1-O 3.39Å; I48-F265 HydrophobicContact CG1-CB 4.28Å; I48-F265 HydrophobicContact CG2-CB 4.27Å; I48-L266 HydrophobicContact CG2-CB 4.12Å; I48-L266 HydrophobicContact CG2-CD1 4.24Å |
| 49 | I | 96.8 | Very high | 95.4 | Very high | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -61.7 | -44 | 177.6 | -70.4 | 175.2 | 0 | 0 | 0 | 110.8 | N45 I46 S47 A52 F53 K149 Y152 L153 F179 I262 L266 | N45-I49 WeakPolarHBondContact O-CG1 3.33Å; N45-I49 PolarHBondContact O-N 3.3Å; I46-I49 PolarHBondContact O-N 2.89Å; S47-I49 PolarHBondContact O-N 3.24Å; I49-A52 PolarHBondContact O-N 2.87Å; I49-F53 HydrophobicContact CG2-CD2 3.94Å; I49-F53 HydrophobicContact CG2-CE2 4.06Å; I49-F53 VanDerWaalsContact O-CD2 3.3Å; I49-F53 WeakPolarHBondContact O-CD2 3.35Å; I49-F53 PolarHBondContact O-N 3.1Å; I49-K149 HydrophobicContact CG2-CG 3.79Å; I49-Y152 HydrophobicContact CD1-CD1 3.19Å; I49-Y152 HydrophobicContact CD1-CD2 3.94Å; I49-Y152 HydrophobicContact CD1-CE1 3.59Å; I49-Y152 HydrophobicContact CD1-CE2 4.29Å; I49-Y152 HydrophobicContact CD1-CG 3.41Å; I49-Y152 VanDerWaalsContact CD1-CG 3.41Å; I49-L153 HydrophobicContact CD1-CD1 4.34Å; I49-L153 HydrophobicContact CG2-CD1 4.09Å; I49-F179 HydrophobicContact CG2-CD2 4.08Å; I49-F179 HydrophobicContact CG2-CE2 4.09Å; I49-I262 HydrophobicContact CG1-CD1 4.09Å; I49-L266 HydrophobicContact CD1-CD1 3.82Å; I49-L266 HydrophobicContact CD1-CD2 3.94Å; I49-L266 HydrophobicContact CG1-CD1 3.6Å; I49-L266 HydrophobicContact CG1-CD2 3.84Å; I49-L266 HydrophobicContact CG1-CG 4.36Å |
| 50 | S | 96.1 | Very high | 95.7 | Very high | 0 Ų | 0 | 31.9 Ų | 31.9 | 0% | 0 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -64.7 | -44.2 | -177.2 | -54.1 | 0 | 0 | 0 | 0 | 111.6 | I46 S47 I48 M54 F179 | I46-S50 WeakPolarHBondContact O-CB 3.35Å; I46-S50 PolarHBondContact O-N 3.46Å; I46-S50 PolarHBondContact O-OG 3.34Å; S47-S50 PolarHBondContact O-N 3.4Å; I48-S50 VanDerWaalsContact C-N 3.33Å; I48-S50 PolarHBondContact O-N 3.29Å; S50-M54 WeakPolarHBondContact O-CB 3.47Å; S50-M54 PolarHBondContact O-N 3.18Å; S50-F179 WeakPolarHBondContact OG-CA 3.49Å |
| 51 | I | 97.3 | Very high | 95.8 | Very high | 82 Ų | 82 | 24 Ų | 24 | 42% | 0.421 | 12% | 0.118 | S | C | . | . | H | α-helix | trans | -66.4 | -44.2 | 176.7 | -67.8 | 165.9 | 0 | 0 | 0 | 110.8 | S47 F53 M54 V55 I261 | S47-I51 WeakPolarHBondContact O-CB 3.48Å; S47-I51 VanDerWaalsContact O-CG1 3.27Å; S47-I51 WeakPolarHBondContact O-CG1 3.13Å; S47-I51 PolarHBondContact O-N 3.48Å; I51-F53 VanDerWaalsContact C-N 3.34Å; I51-F53 PolarHBondContact O-N 3.48Å; I51-M54 HydrophobicContact CG2-CE 4.5Å; I51-M54 WeakPolarHBondContact O-CB 3.27Å; I51-M54 PolarHBondContact O-N 2.92Å; I51-V55 HydrophobicContact CG2-CG2 4.31Å; I51-V55 WeakPolarHBondContact O-CG2 3.24Å; I51-V55 PolarHBondContact O-N 3.41Å; I51-I261 HydrophobicContact CG2-CD1 4.4Å |
| 52 | A | 98 | Very high | 95.9 | Very high | 0 Ų | 0 | 19.7 Ų | 19.7 | 0% | 0 | 10% | 0.102 | C | C | . | . | H | α-helix | trans | -61.8 | -42.7 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112 | I48 I49 V55 Q56 M113 A258 I261 I262 | I48-A52 VanDerWaalsContact O-CB 3.3Å; I48-A52 WeakPolarHBondContact O-CB 3.13Å; I48-A52 PolarHBondContact O-N 3.33Å; I49-A52 PolarHBondContact O-N 2.87Å; A52-V55 PolarHBondContact O-N 3.45Å; A52-Q56 VanDerWaalsContact O-CB 3.27Å; A52-Q56 WeakPolarHBondContact O-CB 3.33Å; A52-Q56 PolarHBondContact O-N 3.24Å; A52-M113 HydrophobicContact CB-CE 4.23Å; A52-A258 VanDerWaalsContact O-CB 3.3Å; A52-A258 WeakPolarHBondContact O-CB 3.31Å; A52-I261 HydrophobicContact CB-CB 4.24Å; A52-I261 HydrophobicContact CB-CG2 3.86Å; A52-I262 HydrophobicContact CB-CD1 3.55Å; A52-I262 HydrophobicContact CB-CG1 3.59Å |
| 53 | F | 97.1 | Very high | 96 | Very high | 0 Ų | 0 | 20 Ų | 20 | 0% | 0 | 10% | 0.104 | C | C | . | . | H | α-helix | trans | -66.8 | -40.6 | 174.7 | -89.5 | -110.8 | 0 | 0 | 0 | 111.9 | I49 I51 Q56 F57 L109 M113 M145 W146 K149 F179 | I49-F53 HydrophobicContact CG2-CD2 3.94Å; I49-F53 HydrophobicContact CG2-CE2 4.06Å; I49-F53 VanDerWaalsContact O-CD2 3.3Å; I49-F53 WeakPolarHBondContact O-CD2 3.35Å; I49-F53 PolarHBondContact O-N 3.1Å; I51-F53 VanDerWaalsContact C-N 3.34Å; I51-F53 PolarHBondContact O-N 3.48Å; F53-Q56 PolarHBondContact O-N 2.96Å; F53-F57 HydrophobicContact CD1-CD2 4.12Å; F53-F57 AromaticContact CD1-CE2 3.72Å; F53-F57 HydrophobicContact CD1-CE2 3.72Å; F53-F57 HydrophobicContact CE1-CE2 4.2Å; F53-F57 WeakPolarHBondContact O-CB 3.38Å; F53-F57 VanDerWaalsContact O-CD2 3.31Å; F53-F57 WeakPolarHBondContact O-CD2 3.37Å; F53-F57 PolarHBondContact O-N 3.31Å; F53-L109 HydrophobicContact CE2-CD2 3.88Å; F53-L109 HydrophobicContact CZ-CD2 3.9Å; F53-M113 HydrophobicContact CE2-SD 4.42Å; F53-M145 HydrophobicContact CE1-CE 4.14Å; F53-M145 HydrophobicContact CE1-CG 3.88Å; F53-M145 HydrophobicContact CE1-SD 4.16Å; F53-M145 HydrophobicContact CE2-CG 4.45Å; F53-M145 HydrophobicContact CZ-CG 3.52Å; F53-M145 HydrophobicContact CZ-SD 4.2Å; F53-W146 HydrophobicContact CE1-CE3 4.49Å; F53-K149 HydrophobicContact CE1-CB 4.29Å; F53-K149 HydrophobicContact CE1-CD 4.32Å; F53-K149 HydrophobicContact CE1-CG 4.25Å; F53-K149 HydrophobicContact CE2-CB 4.07Å; F53-K149 HydrophobicContact CE2-CG 3.94Å; F53-K149 HydrophobicContact CZ-CB 3.59Å; F53-K149 HydrophobicContact CZ-CD 4.32Å; F53-K149 HydrophobicContact CZ-CG 3.75Å; F53-F179 HydrophobicContact CB-CE2 3.57Å; F53-F179 HydrophobicContact CB-CZ 3.9Å; F53-F179 AromaticContact CD1-CE2 3.74Å; F53-F179 HydrophobicContact CD1-CE2 3.74Å; F53-F179 AromaticContact CD1-CZ 3.45Å; F53-F179 HydrophobicContact CD1-CZ 3.45Å; F53-F179 VanDerWaalsContact CD1-CZ 3.45Å; F53-F179 AromaticContact CD2-CE2 3.89Å; F53-F179 HydrophobicContact CD2-CE2 3.89Å; F53-F179 HydrophobicContact CD2-CZ 4.45Å; F53-F179 HydrophobicContact CE1-CE2 4.37Å; F53-F179 HydrophobicContact CE1-CZ 4.03Å; F53-F179 AromaticContact CG-CE2 3.46Å; F53-F179 HydrophobicContact CG-CE2 3.46Å; F53-F179 VanDerWaalsContact CG-CE2 3.46Å; F53-F179 AromaticContact CG-CZ 3.68Å; F53-F179 HydrophobicContact CG-CZ 3.68Å |
| 54 | M | 96.5 | Very high | 95.9 | Very high | 43 Ų | 43 | 18.3 Ų | 18.3 | 21% | 0.212 | 10% | 0.097 | C | C | . | . | H | α-helix | trans | -55.4 | -54.1 | 173.9 | 179.7 | -172.2 | 77 | 0 | 0 | 110.5 | S50 I51 Q56 F57 T58 A182 S185 A186 | S50-M54 WeakPolarHBondContact O-CB 3.47Å; S50-M54 PolarHBondContact O-N 3.18Å; I51-M54 HydrophobicContact CG2-CE 4.5Å; I51-M54 WeakPolarHBondContact O-CB 3.27Å; I51-M54 PolarHBondContact O-N 2.92Å; M54-Q56 PolarHBondContact O-N 3.49Å; M54-F57 PolarHBondContact O-N 3.27Å; M54-T58 PolarHBondContact O-N 3Å; M54-T58 PolarHBondContact O-OG1 3.3Å; M54-A182 HydrophobicContact CB-CB 4.47Å; M54-A182 WeakPolarHBondContact CG-O 3.35Å; M54-S185 PolarHBondContact SD-OG 3.32Å; M54-S185 VanDerWaalsContact SD-OG 3.39Å; M54-A186 HydrophobicContact CG-CB 4.4Å; M54-A186 VanDerWaalsContact O-CB 3.31Å; M54-A186 WeakPolarHBondContact O-CB 3.21Å |
| 55 | V | 97.7 | Very high | 95.8 | Very high | 29 Ų | 29 | 14.7 Ų | 14.7 | 18% | 0.176 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -62.2 | -41.1 | -179.4 | 176.8 | 0 | 0 | 0 | 0 | 112.2 | I51 A52 T58 C254 A258 | I51-V55 HydrophobicContact CG2-CG2 4.31Å; I51-V55 WeakPolarHBondContact O-CG2 3.24Å; I51-V55 PolarHBondContact O-N 3.41Å; A52-V55 PolarHBondContact O-N 3.45Å; V55-T58 WeakPolarHBondContact O-CB 3.48Å; V55-T58 PolarHBondContact O-N 3Å; V55-C254 HydrophobicContact CG1-CB 3.75Å; V55-C254 VanDerWaalsContact CG1-O 3.29Å; V55-C254 WeakPolarHBondContact CG1-O 3.27Å; V55-A258 HydrophobicContact CB-CB 4.28Å; V55-A258 HydrophobicContact CG1-CB 4.23Å |
| 56 | Q | 97.8 | Very high | 95.6 | Very high | 0 Ų | 0 | 14.9 Ų | 14.9 | 0% | 0 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -60.8 | -47.9 | 175.9 | 179.4 | 81.5 | 7.6 | 0 | 0 | 111.8 | A52 F53 M54 T58 A59 F60 M113 I255 A258 | A52-Q56 VanDerWaalsContact O-CB 3.27Å; A52-Q56 WeakPolarHBondContact O-CB 3.33Å; A52-Q56 PolarHBondContact O-N 3.24Å; F53-Q56 PolarHBondContact O-N 2.96Å; M54-Q56 PolarHBondContact O-N 3.49Å; Q56-T58 VanDerWaalsContact C-N 3.34Å; Q56-A59 PolarHBondContact O-N 3.36Å; Q56-F60 PolarHBondContact O-N 3.43Å; Q56-F60 VanDerWaalsContact O-N 3.14Å; Q56-M113 HydrophobicContact CB-CE 3.68Å; Q56-M113 HydrophobicContact CG-CE 3.93Å; Q56-M113 PolarHBondContact NE2-O 3.09Å; Q56-I255 HydrophobicContact CG-CD1 4.1Å; Q56-A258 HydrophobicContact CB-CB 3.95Å |
| 57 | F | 95.6 | Very high | 95.5 | Very high | 9 Ų | 9 | 14.6 Ų | 14.6 | 4% | 0.039 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -77.3 | -22 | -176.6 | -82.7 | -89.5 | 0 | 0 | 0 | 112.4 | F53 M54 A59 F60 Q61 M145 W146 W183 A186 | F53-F57 HydrophobicContact CD1-CD2 4.12Å; F53-F57 AromaticContact CD1-CE2 3.72Å; F53-F57 HydrophobicContact CD1-CE2 3.72Å; F53-F57 HydrophobicContact CE1-CE2 4.2Å; F53-F57 WeakPolarHBondContact O-CB 3.38Å; F53-F57 VanDerWaalsContact O-CD2 3.31Å; F53-F57 WeakPolarHBondContact O-CD2 3.37Å; F53-F57 PolarHBondContact O-N 3.31Å; M54-F57 PolarHBondContact O-N 3.27Å; F57-A59 PolarHBondContact O-N 3.49Å; F57-F60 HydrophobicContact CD1-CB 4.47Å; F57-F60 HydrophobicContact CD1-CD1 4.03Å; F57-F60 HydrophobicContact CE1-CD1 4.01Å; F57-F60 PolarHBondContact O-N 3.39Å; F57-Q61 HydrophobicContact CD1-CG 4.44Å; F57-Q61 VanDerWaalsContact O-CB 3.32Å; F57-Q61 WeakPolarHBondContact O-CB 3.45Å; F57-Q61 PolarHBondContact O-N 3.01Å; F57-Q61 PolarHBondContact O-OE1 3.06Å; F57-M145 HydrophobicContact CE2-CE 3.68Å; F57-M145 HydrophobicContact CZ-CE 3.66Å; F57-W146 HydrophobicContact CE1-CZ2 4.04Å; F57-W146 HydrophobicContact CE2-CH2 4.49Å; F57-W146 AromaticContact CE2-CZ2 3.91Å; F57-W146 HydrophobicContact CE2-CZ2 3.91Å; F57-W146 AromaticContact CZ-CE2 3.87Å; F57-W146 HydrophobicContact CZ-CH2 4.32Å; F57-W146 AromaticContact CZ-CZ2 3.39Å; F57-W146 HydrophobicContact CZ-CZ2 3.39Å; F57-W146 AromaticContact CZ-NE1 3.98Å; F57-W183 AromaticContact CD1-NE1 3.27Å; F57-W183 VanDerWaalsContact CD1-NE1 3.27Å; F57-W183 AromaticContact CD2-CD1 3.46Å; F57-W183 VanDerWaalsContact CD2-CD1 3.46Å; F57-W183 AromaticContact CD2-NE1 3.37Å; F57-W183 AromaticContact CE1-NE1 3.6Å; F57-W183 AromaticContact CE2-NE1 3.69Å; F57-W183 AromaticContact CG-CD1 3.52Å; F57-W183 AromaticContact CG-NE1 3.14Å; F57-W183 AromaticContact CZ-NE1 3.8Å; F57-A186 HydrophobicContact CB-CB 3.72Å |
| 58 | T | 96.3 | Very high | 95.2 | Very high | 8 Ų | 8 | 12.5 Ų | 12.5 | 5% | 0.049 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -55.1 | -46.4 | 168.8 | -69.3 | 0 | 0 | 0 | 0 | 109.6 | M54 V55 Q56 G62 W189 G190 I193 | M54-T58 PolarHBondContact O-N 3Å; M54-T58 PolarHBondContact O-OG1 3.3Å; V55-T58 WeakPolarHBondContact O-CB 3.48Å; V55-T58 PolarHBondContact O-N 3Å; Q56-T58 VanDerWaalsContact C-N 3.34Å; T58-G62 PolarHBondContact O-N 3.37Å; T58-W189 HydrophobicContact CG2-CB 3.77Å; T58-G190 WeakPolarHBondContact O-CA 3.3Å; T58-I193 HydrophobicContact CG2-CD1 3.69Å |
| 59 | A | 96.7 | Very high | 94.8 | Very high | 0 Ų | 0 | 11.7 Ų | 11.7 | 0% | 0 | 6% | 0.063 | C | C | . | . | H | α-helix | trans | -68.6 | -48 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q56 F57 T63 Y251 C254 I255 | Q56-A59 PolarHBondContact O-N 3.36Å; F57-A59 PolarHBondContact O-N 3.49Å; A59-T63 VanDerWaalsContact O-CB 3.26Å; A59-T63 WeakPolarHBondContact O-CB 3.36Å; A59-T63 PolarHBondContact O-N 2.77Å; A59-T63 PolarHBondContact O-OG1 3.14Å; A59-Y251 HydrophobicContact CB-CD1 4.05Å; A59-Y251 HydrophobicContact CB-CG 3.98Å; A59-Y251 WeakPolarHBondContact CB-O 3.2Å; A59-C254 HydrophobicContact CB-CB 4.03Å; A59-I255 HydrophobicContact CB-CD1 3.73Å; A59-I255 HydrophobicContact CB-CG1 3.94Å |
| 60 | F | 95.4 | Very high | 94.5 | Very high | 15 Ų | 15 | 12.5 Ų | 12.5 | 7% | 0.066 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -68 | -48.9 | -174 | -177.9 | -107.4 | 0 | 0 | 0 | 113.4 | Q56 F57 T63 A64 I84 Y116 Y119 V138 | Q56-F60 PolarHBondContact O-N 3.43Å; Q56-F60 VanDerWaalsContact O-N 3.14Å; F57-F60 HydrophobicContact CD1-CB 4.47Å; F57-F60 HydrophobicContact CD1-CD1 4.03Å; F57-F60 HydrophobicContact CE1-CD1 4.01Å; F57-F60 PolarHBondContact O-N 3.39Å; F60-T63 PolarHBondContact O-N 3.47Å; F60-A64 VanDerWaalsContact O-CB 3.23Å; F60-A64 WeakPolarHBondContact O-CB 3.33Å; F60-A64 PolarHBondContact O-N 2.92Å; F60-I84 HydrophobicContact CE2-CD1 3.95Å; F60-I84 HydrophobicContact CZ-CD1 4.15Å; F60-Y116 HydrophobicContact CB-CD1 4.14Å; F60-Y116 HydrophobicContact CB-CE1 4.22Å; F60-Y116 HydrophobicContact CD1-CE1 4.23Å; F60-Y116 AromaticContact CD2-CD1 3.61Å; F60-Y116 HydrophobicContact CD2-CD1 3.61Å; F60-Y116 AromaticContact CD2-CE1 3.61Å; F60-Y116 HydrophobicContact CD2-CE1 3.61Å; F60-Y116 HydrophobicContact CE2-CD1 4.25Å; F60-Y116 HydrophobicContact CE2-CE1 4Å; F60-Y116 AromaticContact CG-CD1 3.96Å; F60-Y116 HydrophobicContact CG-CD1 3.96Å; F60-Y116 AromaticContact CG-CE1 3.73Å; F60-Y116 HydrophobicContact CG-CE1 3.73Å; F60-Y116 HydrophobicContact CZ-CE1 4.46Å; F60-Y119 HydrophobicContact CE2-CE1 4.39Å; F60-V138 HydrophobicContact CE2-CG1 4.03Å; F60-V138 HydrophobicContact CZ-CG1 4.5Å |
| 61 | Q | 92.9 | Very high | 94.2 | Very high | 20 Ų | 20 | 13 Ų | 13 | 9% | 0.093 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -66.7 | -44.6 | -179.8 | -78.7 | 158.4 | -22.8 | 0 | 0 | 111.7 | F57 T63 A64 N65 E187 | F57-Q61 HydrophobicContact CD1-CG 4.44Å; F57-Q61 VanDerWaalsContact O-CB 3.32Å; F57-Q61 WeakPolarHBondContact O-CB 3.45Å; F57-Q61 PolarHBondContact O-N 3.01Å; F57-Q61 PolarHBondContact O-OE1 3.06Å; Q61-T63 VanDerWaalsContact C-N 3.28Å; Q61-T63 PolarHBondContact O-N 2.95Å; Q61-A64 PolarHBondContact O-N 3.2Å; Q61-A64 VanDerWaalsContact O-N 3.16Å; Q61-N65 PolarHBondContact O-N 3.43Å; Q61-E187 WeakPolarHBondContact CB-OE2 3.38Å; Q61-E187 WeakPolarHBondContact CG-OE2 3.34Å; Q61-E187 PolarHBondContact NE2-OE2 3.18Å; Q61-E187 PolarHBondContact OE1-OE2 3.08Å |
| 62 | G | 93.1 | Very high | 93.6 | Very high | 0 Ų | 0 | 9.4 Ų | 9.4 | 0% | 0 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -58.3 | -41.1 | 174.8 | 0 | 0 | 0 | 0 | 0 | 112.4 | T58 L66 Y251 | T58-G62 PolarHBondContact O-N 3.37Å; G62-L66 WeakPolarHBondContact O-CG 3.43Å; G62-Y251 WeakPolarHBondContact CA-OH 3.32Å |
| 63 | T | 94.4 | Very high | 92.8 | Very high | 7 Ų | 7 | 16.8 Ų | 16.8 | 4% | 0.043 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -68.2 | -43.6 | 174.3 | -59.1 | 0 | 0 | 0 | 0 | 112.4 | A59 F60 Q61 L66 Q67 Y119 I120 Q123 Y251 | A59-T63 VanDerWaalsContact O-CB 3.26Å; A59-T63 WeakPolarHBondContact O-CB 3.36Å; A59-T63 PolarHBondContact O-N 2.77Å; A59-T63 PolarHBondContact O-OG1 3.14Å; F60-T63 PolarHBondContact O-N 3.47Å; Q61-T63 VanDerWaalsContact C-N 3.28Å; Q61-T63 PolarHBondContact O-N 2.95Å; T63-L66 PolarHBondContact O-N 3.26Å; T63-Q67 VanDerWaalsContact CG2-NE2 3.25Å; T63-Q67 VanDerWaalsContact O-CG 3.32Å; T63-Q67 WeakPolarHBondContact O-CG 3.44Å; T63-Q67 PolarHBondContact O-N 2.94Å; T63-Q67 PolarHBondContact O-NE2 3.32Å; T63-Q67 VanDerWaalsContact O-NE2 3.09Å; T63-Y119 HydrophobicContact CG2-CE1 4.35Å; T63-I120 HydrophobicContact CG2-CD1 3.88Å; T63-I120 WeakPolarHBondContact OG1-CD1 3.42Å; T63-Q123 HydrophobicContact CG2-CG 4.34Å; T63-Y251 WeakPolarHBondContact OG1-CD2 3.33Å; T63-Y251 WeakPolarHBondContact OG1-CE2 3.48Å |
| 64 | A | 92.8 | Very high | 92.1 | Very high | 13 Ų | 13 | 22.4 Ų | 22.4 | 11% | 0.107 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -61.7 | -47 | -175.7 | 0 | 0 | 0 | 0 | 0 | 112.1 | F60 Q61 L66 Q67 L81 | F60-A64 VanDerWaalsContact O-CB 3.23Å; F60-A64 WeakPolarHBondContact O-CB 3.33Å; F60-A64 PolarHBondContact O-N 2.92Å; Q61-A64 PolarHBondContact O-N 3.2Å; Q61-A64 VanDerWaalsContact O-N 3.16Å; A64-L66 PolarHBondContact O-N 3.41Å; A64-Q67 WeakPolarHBondContact O-CB 3.34Å; A64-Q67 PolarHBondContact O-N 3.47Å; A64-Q67 VanDerWaalsContact O-N 3.09Å; A64-L81 HydrophobicContact CB-CD2 4.11Å |
| 65 | N | 93.1 | Very high | 91.6 | Very high | 12 Ų | 12 | 20.5 Ų | 20.5 | 6% | 0.064 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -64.4 | -26.1 | -179.4 | -68.8 | -17.2 | 0 | 0 | 0 | 113.3 | Q61 E187 N191 T325 I338 M342 | Q61-N65 PolarHBondContact O-N 3.43Å; N65-E187 PolarHBondContact ND2-OE1 2.89Å; N65-N191 PolarHBondContact ND2-ND2 3.16Å; N65-N191 VanDerWaalsContact ND2-ND2 3.16Å; N65-N191 PolarHBondContact ND2-OD1 2.78Å; N65-T325 PolarHBondContact O-OG1 3.49Å; N65-I338 HydrophobicContact CB-CG2 4.43Å; N65-M342 HydrophobicContact CB-CG 4.47Å |
| 66 | L | 92.1 | Very high | 91.2 | Very high | 4 Ų | 4 | 19.7 Ų | 19.7 | 2% | 0.021 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -84.3 | -22.1 | 176.4 | -70.2 | -179.1 | 0 | 0 | 0 | 113.2 | G62 T63 A64 S68 S69 I70 L198 V335 I338 | G62-L66 WeakPolarHBondContact O-CG 3.43Å; T63-L66 PolarHBondContact O-N 3.26Å; A64-L66 PolarHBondContact O-N 3.41Å; L66-S68 PolarHBondContact O-N 3.29Å; L66-S69 PolarHBondContact O-N 3.28Å; L66-I70 HydrophobicContact CB-CD1 4.12Å; L66-I70 HydrophobicContact CB-CG1 4.43Å; L66-I70 HydrophobicContact CB-CG2 4.08Å; L66-I70 WeakPolarHBondContact O-CG1 3.43Å; L66-I70 PolarHBondContact O-N 3.05Å; L66-L198 HydrophobicContact CD1-CD1 4.36Å; L66-L198 HydrophobicContact CD2-CD1 4.15Å; L66-V335 HydrophobicContact CD2-CG1 4.06Å; L66-I338 HydrophobicContact CD2-CB 4.12Å; L66-I338 HydrophobicContact CD2-CD1 3.94Å; L66-I338 HydrophobicContact CD2-CG2 4.2Å |
| 67 | Q | 92.6 | Very high | 90.9 | Very high | 0 Ų | 0 | 19.7 Ų | 19.7 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -56 | -46.5 | -166.7 | -78.4 | -48.8 | -71.7 | 0 | 0 | 113.9 | T63 A64 S69 N71 L81 | T63-Q67 VanDerWaalsContact CG2-NE2 3.25Å; T63-Q67 VanDerWaalsContact O-CG 3.32Å; T63-Q67 WeakPolarHBondContact O-CG 3.44Å; T63-Q67 PolarHBondContact O-N 2.94Å; T63-Q67 PolarHBondContact O-NE2 3.32Å; T63-Q67 VanDerWaalsContact O-NE2 3.09Å; A64-Q67 WeakPolarHBondContact O-CB 3.34Å; A64-Q67 PolarHBondContact O-N 3.47Å; A64-Q67 VanDerWaalsContact O-N 3.09Å; Q67-S69 PolarHBondContact O-N 3.2Å; Q67-N71 WeakPolarHBondContact O-CB 3.27Å; Q67-N71 PolarHBondContact O-N 2.91Å; Q67-N71 VanDerWaalsContact O-N 3.11Å; Q67-N71 PolarHBondContact OE1-ND2 3.15Å; Q67-L81 HydrophobicContact CB-CD1 3.81Å; Q67-L81 HydrophobicContact CB-CG 4.16Å; Q67-L81 HydrophobicContact CG-CD1 4.29Å; Q67-L81 HydrophobicContact CG-CD2 4.28Å; Q67-L81 HydrophobicContact CG-CG 4.19Å |
| 68 | S | 89.6 | Confident | 90.7 | Very high | 1 Ų | 1 | 19.5 Ų | 19.5 | 1% | 0.007 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -61.4 | -27.4 | -179.3 | 57.4 | 0 | 0 | 0 | 0 | 112.5 | L66 A72 A322 T325 Q326 | L66-S68 PolarHBondContact O-N 3.29Å; S68-A72 WeakPolarHBondContact O-CA 3.39Å; S68-A72 VanDerWaalsContact O-CB 3.29Å; S68-A72 WeakPolarHBondContact O-CB 3.31Å; S68-A322 WeakPolarHBondContact CB-O 3.2Å; S68-A322 WeakPolarHBondContact OG-CA 3.01Å; S68-A322 PolarHBondContact OG-O 3.4Å; S68-T325 PolarHBondContact OG-OG1 2.82Å; S68-Q326 VanDerWaalsContact O-CD 3.22Å; S68-Q326 PolarHBondContact O-NE2 3.07Å; S68-Q326 PolarHBondContact O-OE1 3.28Å |
| 69 | S | 89.6 | Confident | 90.5 | Very high | 3 Ų | 3 | 21.4 Ų | 21.4 | 2% | 0.021 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -96.3 | -47.3 | -174.4 | -56.4 | 0 | 0 | 0 | 0 | 112.5 | L66 Q67 I338 | L66-S69 PolarHBondContact O-N 3.28Å; Q67-S69 PolarHBondContact O-N 3.2Å; S69-I338 WeakPolarHBondContact OG-CD1 3.38Å |
| 70 | I | 89.8 | Confident | 90.4 | Very high | 17 Ų | 17 | 21.4 Ų | 21.4 | 9% | 0.087 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -76.1 | -30.2 | -178.4 | 70.2 | 178.7 | 0 | 0 | 0 | 113 | L66 P239 V335 | L66-I70 HydrophobicContact CB-CD1 4.12Å; L66-I70 HydrophobicContact CB-CG1 4.43Å; L66-I70 HydrophobicContact CB-CG2 4.08Å; L66-I70 WeakPolarHBondContact O-CG1 3.43Å; L66-I70 PolarHBondContact O-N 3.05Å; I70-P239 HydrophobicContact CG2-CG 4.19Å; I70-V335 HydrophobicContact CG2-CG1 3.84Å |
| 71 | N | 89.7 | Confident | 90.3 | Very high | 9 Ų | 9 | 20.7 Ų | 20.7 | 5% | 0.048 | 11% | 0.109 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -115 | 40.2 | 180 | -67.5 | -39.7 | 0 | 0 | 0 | 110.3 | Q67 K73 L76 G77 Q123 P126 | Q67-N71 WeakPolarHBondContact O-CB 3.27Å; Q67-N71 PolarHBondContact O-N 2.91Å; Q67-N71 VanDerWaalsContact O-N 3.11Å; Q67-N71 PolarHBondContact OE1-ND2 3.15Å; N71-K73 VanDerWaalsContact C-N 3.33Å; N71-K73 PolarHBondContact O-N 2.93Å; N71-L76 PolarHBondContact O-N 3.37Å; N71-G77 PolarHBondContact O-N 2.63Å; N71-Q123 PolarHBondContact ND2-OE1 2.88Å; N71-P126 VanDerWaalsContact OD1-CB 3.23Å; N71-P126 WeakPolarHBondContact OD1-CB 3.45Å |
| 72 | A | 84.8 | Confident | 90.3 | Very high | 8 Ų | 8 | 20.8 Ų | 20.8 | 7% | 0.066 | 11% | 0.111 | C | C | . | . | trans | -68.2 | -29.5 | -175.3 | 0 | 0 | 0 | 0 | 0 | 113.3 | S68 D74 G75 H233 L236 | S68-A72 WeakPolarHBondContact O-CA 3.39Å; S68-A72 VanDerWaalsContact O-CB 3.29Å; S68-A72 WeakPolarHBondContact O-CB 3.31Å; A72-D74 PolarHBondContact O-N 3.41Å; A72-G75 PolarHBondContact O-N 3.39Å; A72-H233 PolarHBondContact O-CE1 3.28Å; A72-L236 HydrophobicContact CB-CD1 4.02Å | ||
| 73 | K | 82.4 | Confident | 90.3 | Very high | 155 Ų | 155 | 21.4 Ų | 21.4 | 67% | 0.674 | 12% | 0.117 | S | C | * | . | G | 310 helix | trans | -55.9 | 126.7 | -177.3 | -175.8 | 175.9 | 178.6 | 171.9 | 0 | 111.1 | N71 G75 L76 | N71-K73 VanDerWaalsContact C-N 3.33Å; N71-K73 PolarHBondContact O-N 2.93Å; K73-G75 PolarHBondContact O-N 3.23Å; K73-L76 PolarHBondContact O-N 3.01Å; K73-L76 VanDerWaalsContact O-N 3.13Å |
| 74 | D | 82.3 | Confident | 90.3 | Very high | 117 Ų | 117 | 21.3 Ų | 21.3 | 63% | 0.626 | 12% | 0.116 | S | C | * | . | G | 310 helix | trans | 55.1 | 14.6 | -176.6 | -51.9 | -45.9 | 0 | 0 | 0 | 113.9 | A72 L76 F128 | A72-D74 PolarHBondContact O-N 3.41Å; D74-L76 VanDerWaalsContact C-N 3.32Å; D74-L76 PolarHBondContact O-N 2.93Å; D74-F128 HydrophobicContact CB-CE2 3.88Å; D74-F128 HydrophobicContact CB-CZ 3.93Å |
| 75 | G | 84.9 | Confident | 90.3 | Very high | 3 Ų | 3 | 22.5 Ų | 22.5 | 3% | 0.031 | 12% | 0.118 | C | C | . | . | G | 310 helix | trans | 68.8 | 22.9 | -175.1 | 0 | 0 | 0 | 0 | 0 | 115.3 | A72 K73 G77 T78 V79 | A72-G75 PolarHBondContact O-N 3.39Å; K73-G75 PolarHBondContact O-N 3.23Å; G75-G77 VanDerWaalsContact C-N 3.29Å; G75-G77 PolarHBondContact O-N 3.4Å; G75-T78 PolarHBondContact O-N 3.29Å; G75-T78 PolarHBondContact O-OG1 2.93Å; G75-V79 WeakPolarHBondContact O-CB 3.29Å; G75-V79 VanDerWaalsContact O-CG2 3.29Å; G75-V79 WeakPolarHBondContact O-CG2 3.29Å; G75-V79 PolarHBondContact O-N 3.35Å |
| 76 | L | 90.4 | Very high | 90.2 | Very high | 12 Ų | 12 | 23.8 Ų | 23.8 | 6% | 0.063 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -52.4 | -44.7 | -176.5 | 174.3 | 60.8 | 0 | 0 | 0 | 113.1 | N71 K73 D74 V79 S80 P126 F128 L131 | N71-L76 PolarHBondContact O-N 3.37Å; K73-L76 PolarHBondContact O-N 3.01Å; K73-L76 VanDerWaalsContact O-N 3.13Å; D74-L76 VanDerWaalsContact C-N 3.32Å; D74-L76 PolarHBondContact O-N 2.93Å; L76-V79 PolarHBondContact O-N 2.83Å; L76-S80 WeakPolarHBondContact O-CB 3.26Å; L76-S80 PolarHBondContact O-N 3.33Å; L76-P126 VanDerWaalsContact CD2-C 3.49Å; L76-P126 HydrophobicContact CD2-CB 4.01Å; L76-P126 WeakPolarHBondContact CD2-O 3.36Å; L76-F128 HydrophobicContact CB-CE1 4.37Å; L76-F128 HydrophobicContact CB-CE2 4.27Å; L76-F128 HydrophobicContact CB-CZ 4.04Å; L76-F128 HydrophobicContact CD1-CB 4.21Å; L76-F128 HydrophobicContact CD1-CD1 3.61Å; L76-F128 HydrophobicContact CD1-CD2 4.02Å; L76-F128 HydrophobicContact CD1-CE1 3.87Å; L76-F128 HydrophobicContact CD1-CE2 4.25Å; L76-F128 HydrophobicContact CD1-CG 3.68Å; L76-F128 HydrophobicContact CD1-CZ 4.19Å; L76-L131 HydrophobicContact CD1-CB 4.39Å; L76-L131 HydrophobicContact CD1-CD1 4.43Å; L76-L131 HydrophobicContact CD2-CD1 3.95Å; L76-L131 HydrophobicContact CG-CD1 4.01Å |
| 77 | G | 90.4 | Very high | 90.2 | Very high | 0 Ų | 0 | 24.1 Ų | 24.1 | 0% | 0 | 13% | 0.133 | C | C | . | . | H | α-helix | trans | -58.9 | -52.8 | -179.4 | 0 | 0 | 0 | 0 | 0 | 112.8 | N71 G75 S80 L81 | N71-G77 PolarHBondContact O-N 2.63Å; G75-G77 VanDerWaalsContact C-N 3.29Å; G75-G77 PolarHBondContact O-N 3.4Å; G77-S80 PolarHBondContact O-N 3.49Å; G77-S80 PolarHBondContact O-OG 2.9Å; G77-L81 PolarHBondContact O-N 3.43Å |
| 78 | T | 90.8 | Very high | 90.1 | Very high | 5 Ų | 5 | 24.5 Ų | 24.5 | 3% | 0.031 | 14% | 0.135 | C | C | . | . | H | α-helix | trans | -67.3 | -37.4 | -179.8 | 55.4 | 0 | 0 | 0 | 0 | 112.3 | G75 S80 L81 S82 A322 A448 | G75-T78 PolarHBondContact O-N 3.29Å; G75-T78 PolarHBondContact O-OG1 2.93Å; T78-S80 VanDerWaalsContact C-N 3.34Å; T78-S80 PolarHBondContact O-N 3.18Å; T78-L81 PolarHBondContact O-N 3.4Å; T78-S82 PolarHBondContact O-N 3.3Å; T78-A322 HydrophobicContact CG2-CB 4.29Å; T78-A448 HydrophobicContact CG2-CB 4.28Å |
| 79 | V | 92.8 | Very high | 89.8 | Confident | 49 Ų | 49 | 26 Ų | 26 | 30% | 0.297 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -62.8 | -42 | 174.4 | 172.3 | 0 | 0 | 0 | 0 | 110.9 | G75 L76 S82 A83 F128 V132 | G75-V79 WeakPolarHBondContact O-CB 3.29Å; G75-V79 VanDerWaalsContact O-CG2 3.29Å; G75-V79 WeakPolarHBondContact O-CG2 3.29Å; G75-V79 PolarHBondContact O-N 3.35Å; L76-V79 PolarHBondContact O-N 2.83Å; V79-S82 WeakPolarHBondContact O-CB 3.49Å; V79-S82 PolarHBondContact O-N 2.98Å; V79-A83 PolarHBondContact O-N 3.29Å; V79-F128 HydrophobicContact CB-CE1 4.18Å; V79-F128 HydrophobicContact CG1-CD1 4.37Å; V79-F128 HydrophobicContact CG1-CE1 4.1Å; V79-F128 HydrophobicContact CG2-CE1 4.32Å; V79-V132 HydrophobicContact CG1-CG2 3.97Å |
| 80 | S | 94.5 | Very high | 89.5 | Confident | 0 Ų | 0 | 30 Ų | 30 | 0% | 0 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -64.6 | -40 | 176.8 | 83 | 0 | 0 | 0 | 0 | 112.3 | L76 G77 T78 A83 I84 Y119 | L76-S80 WeakPolarHBondContact O-CB 3.26Å; L76-S80 PolarHBondContact O-N 3.33Å; G77-S80 PolarHBondContact O-N 3.49Å; G77-S80 PolarHBondContact O-OG 2.9Å; T78-S80 VanDerWaalsContact C-N 3.34Å; T78-S80 PolarHBondContact O-N 3.18Å; S80-A83 WeakPolarHBondContact O-CB 3.47Å; S80-A83 PolarHBondContact O-N 3.43Å; S80-I84 WeakPolarHBondContact O-CG1 3.43Å; S80-I84 PolarHBondContact O-N 3.49Å; S80-Y119 PolarHBondContact OG-OH 3.11Å |
| 81 | L | 92.9 | Very high | 89.4 | Confident | 0 Ų | 0 | 29.2 Ų | 29.2 | 0% | 0 | 16% | 0.164 | C | C | . | . | H | α-helix | trans | -63.2 | -45 | 173.5 | -73.1 | 171.6 | 0 | 0 | 0 | 111.2 | A64 Q67 G77 T78 A83 I84 Y85 Y445 | A64-L81 HydrophobicContact CB-CD2 4.11Å; Q67-L81 HydrophobicContact CB-CD1 3.81Å; Q67-L81 HydrophobicContact CB-CG 4.16Å; Q67-L81 HydrophobicContact CG-CD1 4.29Å; Q67-L81 HydrophobicContact CG-CD2 4.28Å; Q67-L81 HydrophobicContact CG-CG 4.19Å; G77-L81 PolarHBondContact O-N 3.43Å; T78-L81 PolarHBondContact O-N 3.4Å; L81-A83 VanDerWaalsContact C-N 3.27Å; L81-A83 PolarHBondContact O-N 3.42Å; L81-I84 HydrophobicContact CD2-CD1 4.25Å; L81-I84 WeakPolarHBondContact O-CB 3.32Å; L81-I84 PolarHBondContact O-N 2.84Å; L81-I84 VanDerWaalsContact O-N 3.09Å; L81-Y85 VanDerWaalsContact O-CD2 3.24Å; L81-Y85 WeakPolarHBondContact O-CD2 3.47Å; L81-Y85 PolarHBondContact O-N 3.18Å; L81-Y445 HydrophobicContact CB-CD2 4.09Å; L81-Y445 HydrophobicContact CB-CE1 4.42Å; L81-Y445 HydrophobicContact CB-CE2 3.82Å; L81-Y445 HydrophobicContact CB-CG 4.49Å; L81-Y445 HydrophobicContact CD1-CE1 4.23Å |
| 82 | S | 92.7 | Very high | 88.8 | Confident | 21 Ų | 21 | 31 Ų | 31 | 15% | 0.147 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -54.1 | -45 | 174.5 | -166.3 | 0 | 0 | 0 | 0 | 112 | T78 V79 I84 Y85 A86 | T78-S82 PolarHBondContact O-N 3.3Å; V79-S82 WeakPolarHBondContact O-CB 3.49Å; V79-S82 PolarHBondContact O-N 2.98Å; S82-I84 VanDerWaalsContact C-N 3.3Å; S82-I84 PolarHBondContact O-N 3.06Å; S82-Y85 PolarHBondContact O-N 3.43Å; S82-A86 WeakPolarHBondContact O-CB 3.48Å; S82-A86 PolarHBondContact O-N 3.37Å |
| 83 | A | 94.4 | Very high | 88.2 | Confident | 14 Ų | 14 | 33 Ų | 33 | 12% | 0.116 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -62.1 | -35.2 | 179.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | V79 S80 L81 A87 V132 I136 | V79-A83 PolarHBondContact O-N 3.29Å; S80-A83 WeakPolarHBondContact O-CB 3.47Å; S80-A83 PolarHBondContact O-N 3.43Å; L81-A83 VanDerWaalsContact C-N 3.27Å; L81-A83 PolarHBondContact O-N 3.42Å; A83-A87 WeakPolarHBondContact O-CB 3.22Å; A83-A87 PolarHBondContact O-N 3.4Å; A83-V132 HydrophobicContact CB-CG1 3.89Å; A83-I136 HydrophobicContact CB-CG1 4.02Å |
| 84 | I | 94.5 | Very high | 87.7 | Confident | 4 Ų | 4 | 30.1 Ų | 30.1 | 2% | 0.021 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -59.7 | -54.6 | 173.6 | -65.1 | 168.8 | 0 | 0 | 0 | 110.6 | F60 S80 L81 S82 A87 L88 Y119 G135 V138 G139 | F60-I84 HydrophobicContact CE2-CD1 3.95Å; F60-I84 HydrophobicContact CZ-CD1 4.15Å; S80-I84 WeakPolarHBondContact O-CG1 3.43Å; S80-I84 PolarHBondContact O-N 3.49Å; L81-I84 HydrophobicContact CD2-CD1 4.25Å; L81-I84 WeakPolarHBondContact O-CB 3.32Å; L81-I84 PolarHBondContact O-N 2.84Å; L81-I84 VanDerWaalsContact O-N 3.09Å; S82-I84 VanDerWaalsContact C-N 3.3Å; S82-I84 PolarHBondContact O-N 3.06Å; I84-A87 PolarHBondContact O-N 2.97Å; I84-L88 WeakPolarHBondContact O-CB 3.38Å; I84-L88 PolarHBondContact O-N 3.15Å; I84-Y119 HydrophobicContact CD1-CD1 4.45Å; I84-Y119 HydrophobicContact CD1-CD2 4.48Å; I84-Y119 HydrophobicContact CD1-CE1 3.93Å; I84-Y119 HydrophobicContact CD1-CE2 3.98Å; I84-G135 WeakPolarHBondContact CA-O 3.29Å; I84-G135 VanDerWaalsContact CG1-O 3.27Å; I84-G135 WeakPolarHBondContact CG1-O 3.34Å; I84-V138 HydrophobicContact CD1-CB 4.46Å; I84-V138 HydrophobicContact CD1-CG1 4.24Å; I84-V138 HydrophobicContact CG1-CB 4.14Å; I84-V138 HydrophobicContact CG1-CG1 4.21Å; I84-V138 HydrophobicContact CG2-CB 4.37Å; I84-V138 HydrophobicContact CG2-CG1 3.76Å; I84-G139 VanDerWaalsContact O-CA 3.25Å; I84-G139 WeakPolarHBondContact O-CA 3.24Å |
| 85 | Y | 91.7 | Very high | 87.3 | Confident | 39 Ų | 39 | 26.2 Ų | 26.2 | 15% | 0.153 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -71.1 | -34.4 | -174.9 | -68.5 | -81.9 | 0 | 0 | 0 | 112.1 | L81 S82 L88 V89 F441 Y445 | L81-Y85 VanDerWaalsContact O-CD2 3.24Å; L81-Y85 WeakPolarHBondContact O-CD2 3.47Å; L81-Y85 PolarHBondContact O-N 3.18Å; S82-Y85 PolarHBondContact O-N 3.43Å; Y85-L88 WeakPolarHBondContact O-CB 3.39Å; Y85-L88 PolarHBondContact O-N 2.86Å; Y85-V89 WeakPolarHBondContact O-CG2 3.45Å; Y85-V89 PolarHBondContact O-N 3.13Å; Y85-F441 HydrophobicContact CD1-CB 3.84Å; Y85-F441 HydrophobicContact CD1-CD1 4.27Å; Y85-F441 AromaticContact CD1-CD2 3.83Å; Y85-F441 HydrophobicContact CD1-CD2 3.83Å; Y85-F441 HydrophobicContact CD1-CE2 4.4Å; Y85-F441 AromaticContact CD1-CG 3.73Å; Y85-F441 HydrophobicContact CD1-CG 3.73Å; Y85-F441 HydrophobicContact CD2-CB 3.91Å; Y85-F441 HydrophobicContact CD2-CD1 4.09Å; Y85-F441 HydrophobicContact CD2-CG 4.11Å; Y85-F441 HydrophobicContact CE1-CB 4.32Å; Y85-F441 AromaticContact CE1-CD1 3.9Å; Y85-F441 HydrophobicContact CE1-CD1 3.9Å; Y85-F441 AromaticContact CE1-CD2 3.72Å; Y85-F441 HydrophobicContact CE1-CD2 3.72Å; Y85-F441 HydrophobicContact CE1-CE1 4.03Å; Y85-F441 AromaticContact CE1-CE2 3.85Å; Y85-F441 HydrophobicContact CE1-CE2 3.85Å; Y85-F441 AromaticContact CE1-CG 3.73Å; Y85-F441 HydrophobicContact CE1-CG 3.73Å; Y85-F441 AromaticContact CE1-CZ 3.97Å; Y85-F441 HydrophobicContact CE1-CZ 3.97Å; Y85-F441 HydrophobicContact CE2-CB 4.43Å; Y85-F441 AromaticContact CE2-CD1 3.76Å; Y85-F441 HydrophobicContact CE2-CD1 3.76Å; Y85-F441 HydrophobicContact CE2-CE1 4.16Å; Y85-F441 HydrophobicContact CE2-CG 4.16Å; Y85-F441 HydrophobicContact CG-CB 3.59Å; Y85-F441 HydrophobicContact CG-CD1 4.35Å; Y85-F441 HydrophobicContact CG-CD2 4.45Å; Y85-F441 AromaticContact CG-CG 3.92Å; Y85-F441 HydrophobicContact CG-CG 3.92Å; Y85-F441 AromaticContact CZ-CD1 3.62Å; Y85-F441 AromaticContact CZ-CE1 3.66Å; Y85-F441 AromaticContact CZ-CG 3.95Å; Y85-F441 AromaticContact CZ-CZ 3.99Å; Y85-Y445 HydrophobicContact CD2-CD2 4.16Å; Y85-Y445 AromaticContact CD2-CE2 3.66Å; Y85-Y445 HydrophobicContact CD2-CE2 3.66Å; Y85-Y445 AromaticContact CE2-CE2 3.68Å; Y85-Y445 HydrophobicContact CE2-CE2 3.68Å |
| 86 | A | 91.7 | Very high | 86.6 | Confident | 38 Ų | 38 | 26.9 Ų | 26.9 | 31% | 0.314 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -62.9 | -46 | 172.9 | 0 | 0 | 0 | 0 | 0 | 111.5 | S82 L88 V89 V90 V442 | S82-A86 WeakPolarHBondContact O-CB 3.48Å; S82-A86 PolarHBondContact O-N 3.37Å; A86-L88 VanDerWaalsContact C-N 3.33Å; A86-L88 PolarHBondContact O-N 2.85Å; A86-V89 PolarHBondContact O-N 3.09Å; A86-V90 PolarHBondContact O-N 3.25Å; A86-V442 HydrophobicContact CB-CG2 3.94Å; A86-V442 VanDerWaalsContact N-CG2 3.34Å |
| 87 | A | 92.7 | Very high | 85.6 | Confident | 11 Ų | 11 | 28.2 Ų | 28.2 | 9% | 0.091 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -66.7 | -34 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.3 | A83 I84 V90 S91 I136 M140 | A83-A87 WeakPolarHBondContact O-CB 3.22Å; A83-A87 PolarHBondContact O-N 3.4Å; I84-A87 PolarHBondContact O-N 2.97Å; A87-V90 PolarHBondContact O-N 3.48Å; A87-S91 WeakPolarHBondContact O-CB 3.16Å; A87-S91 PolarHBondContact O-N 3.39Å; A87-I136 HydrophobicContact CB-CB 4.29Å; A87-I136 HydrophobicContact CB-CG2 4Å; A87-I136 WeakPolarHBondContact CB-O 3.36Å; A87-M140 HydrophobicContact CB-CG 4.45Å |
| 88 | L | 88.9 | Confident | 84.6 | Confident | 9 Ų | 9 | 33.4 Ų | 33.4 | 5% | 0.047 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -61.9 | -44.4 | 174.2 | -177 | 156.8 | 0 | 0 | 0 | 111.5 | I84 Y85 A86 V90 S91 C92 G139 A142 S438 | I84-L88 WeakPolarHBondContact O-CB 3.38Å; I84-L88 PolarHBondContact O-N 3.15Å; Y85-L88 WeakPolarHBondContact O-CB 3.39Å; Y85-L88 PolarHBondContact O-N 2.86Å; A86-L88 VanDerWaalsContact C-N 3.33Å; A86-L88 PolarHBondContact O-N 2.85Å; L88-V90 VanDerWaalsContact C-N 3.34Å; L88-V90 PolarHBondContact O-N 2.94Å; L88-S91 WeakPolarHBondContact O-CB 3.34Å; L88-S91 PolarHBondContact O-N 3.07Å; L88-C92 PolarHBondContact O-N 2.96Å; L88-C92 PolarHBondContact O-SG 2.56Å; L88-C92 VanDerWaalsContact O-SG 3.38Å; L88-G139 WeakPolarHBondContact CA-O 3.2Å; L88-A142 HydrophobicContact CD1-CB 3.71Å; L88-A142 HydrophobicContact CG-CB 4.27Å; L88-S438 VanDerWaalsContact CD2-OG 3.3Å; L88-S438 WeakPolarHBondContact CD2-OG 3.45Å |
| 89 | V | 83.8 | Confident | 83.9 | Confident | 31 Ų | 31 | 35.4 Ų | 35.4 | 19% | 0.188 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -56.3 | -49.1 | 175.5 | 165.3 | 0 | 0 | 0 | 0 | 111 | Y85 A86 S91 L435 S438 | Y85-V89 WeakPolarHBondContact O-CG2 3.45Å; Y85-V89 PolarHBondContact O-N 3.13Å; A86-V89 PolarHBondContact O-N 3.09Å; V89-S91 VanDerWaalsContact C-N 3.33Å; V89-S91 PolarHBondContact O-N 2.67Å; V89-L435 HydrophobicContact CB-CD1 4.48Å; V89-L435 HydrophobicContact CG1-CD1 3.59Å; V89-L435 HydrophobicContact CG2-CD1 4.4Å; V89-S438 VanDerWaalsContact CG2-CB 3.43Å |
| 90 | V | 84.4 | Confident | 83 | Confident | 87 Ų | 87 | 34.1 Ų | 34.1 | 53% | 0.527 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -64.7 | -41.2 | 177.8 | 178.2 | 0 | 0 | 0 | 0 | 110.8 | A86 A87 L88 I93 | A86-V90 PolarHBondContact O-N 3.25Å; A87-V90 PolarHBondContact O-N 3.48Å; L88-V90 VanDerWaalsContact C-N 3.34Å; L88-V90 PolarHBondContact O-N 2.94Å; V90-I93 PolarHBondContact O-N 2.92Å |
| 91 | S | 86.7 | Confident | 81.8 | Confident | 1 Ų | 1 | 44.5 Ų | 44.5 | 1% | 0.007 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -62 | -45 | -179.6 | -173 | 0 | 0 | 0 | 0 | 112.3 | A87 L88 V89 I93 F94 L95 P96 G139 M140 P144 | A87-S91 WeakPolarHBondContact O-CB 3.16Å; A87-S91 PolarHBondContact O-N 3.39Å; L88-S91 WeakPolarHBondContact O-CB 3.34Å; L88-S91 PolarHBondContact O-N 3.07Å; V89-S91 VanDerWaalsContact C-N 3.33Å; V89-S91 PolarHBondContact O-N 2.67Å; S91-I93 PolarHBondContact O-N 2.94Å; S91-F94 PolarHBondContact O-N 3.29Å; S91-F94 VanDerWaalsContact O-N 3.13Å; S91-L95 PolarHBondContact O-N 3.07Å; S91-L95 WeakPolarHBondContact OG-CB 3.32Å; S91-L95 WeakPolarHBondContact OG-CD2 3.24Å; S91-P96 WeakPolarHBondContact O-CD 3.49Å; S91-G139 WeakPolarHBondContact CB-O 3.48Å; S91-M140 PolarHBondContact OG-O 3.31Å; S91-P144 WeakPolarHBondContact OG-CD 3.2Å |
| 92 | C | 76.9 | Confident | 81.1 | Confident | 47 Ų | 47 | 52.7 Ų | 52.7 | 32% | 0.318 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -53 | -26.8 | 178.7 | -81.2 | 0 | 0 | 0 | 0 | 114 | L88 A143 | L88-C92 PolarHBondContact O-N 2.96Å; L88-C92 PolarHBondContact O-SG 2.56Å; L88-C92 VanDerWaalsContact O-SG 3.38Å; C92-A143 HydrophobicContact CB-CB 4.23Å; C92-A143 WeakPolarHBondContact SG-CB 3.26Å |
| 93 | I | 71.4 | Confident | 80.5 | Confident | 49 Ų | 49 | 55.2 Ų | 55.2 | 25% | 0.251 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -79.2 | -40.5 | -177.9 | -62.7 | 170.3 | 0 | 0 | 0 | 112 | V90 S91 L291 | V90-I93 PolarHBondContact O-N 2.92Å; S91-I93 PolarHBondContact O-N 2.94Å; I93-L291 HydrophobicContact CB-CD1 4.3Å; I93-L291 HydrophobicContact CD1-CD1 4.31Å; I93-L291 HydrophobicContact CG1-CD1 4Å; I93-L291 HydrophobicContact CG2-CB 4.41Å; I93-L291 HydrophobicContact CG2-CD1 3.49Å; I93-L291 VanDerWaalsContact CG2-CD1 3.49Å; I93-L291 HydrophobicContact CG2-CD2 3.62Å; I93-L291 HydrophobicContact CG2-CG 4.01Å |
| 94 | F | 71.9 | Confident | 80.1 | Confident | 95 Ų | 95 | 54.8 Ų | 54.8 | 42% | 0.417 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -119.9 | -40.8 | -164.7 | -60.4 | -72.8 | 0 | 0 | 0 | 113.8 | S91 L98 | S91-F94 PolarHBondContact O-N 3.29Å; S91-F94 VanDerWaalsContact O-N 3.13Å; F94-L98 HydrophobicContact CB-CD1 4.5Å; F94-L98 WeakPolarHBondContact O-CD1 3.36Å; F94-L98 VanDerWaalsContact O-CG 3.22Å; F94-L98 WeakPolarHBondContact O-CG 3.26Å |
| 95 | L | 74.1 | Confident | 79.8 | Confident | 35 Ų | 35 | 54.7 Ų | 54.7 | 18% | 0.183 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -77.5 | -40.4 | -163 | -85.9 | 62.5 | 0 | 0 | 0 | 114 | S91 T97 L98 I99 M140 P144 | S91-L95 PolarHBondContact O-N 3.07Å; S91-L95 WeakPolarHBondContact OG-CB 3.32Å; S91-L95 WeakPolarHBondContact OG-CD2 3.24Å; L95-T97 PolarHBondContact O-N 3.45Å; L95-L98 PolarHBondContact O-N 2.92Å; L95-I99 HydrophobicContact CB-CD1 3.86Å; L95-I99 HydrophobicContact CB-CG1 4.45Å; L95-I99 HydrophobicContact CD2-CD1 4.11Å; L95-I99 HydrophobicContact CG-CD1 3.94Å; L95-I99 VanDerWaalsContact O-CB 3.31Å; L95-I99 WeakPolarHBondContact O-CB 3.29Å; L95-I99 VanDerWaalsContact O-CG1 3.25Å; L95-I99 WeakPolarHBondContact O-CG1 3.28Å; L95-I99 PolarHBondContact O-N 3.32Å; L95-M140 HydrophobicContact CD2-CB 4.01Å; L95-M140 HydrophobicContact CD2-CE 3.97Å; L95-M140 HydrophobicContact CD2-CG 4.39Å; L95-M140 WeakPolarHBondContact CD2-O 3.42Å; L95-P144 HydrophobicContact CB-CG 3.68Å |
| 96 | P | 71 | Confident | 79.8 | Confident | 18 Ų | 18 | 53.8 Ų | 53.8 | 12% | 0.117 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -53.3 | -54.4 | -179 | -30.7 | 35.4 | 0 | 0 | 0 | 113.6 | S91 L98 I100 A143 P144 A147 | S91-P96 WeakPolarHBondContact O-CD 3.49Å; P96-L98 PolarHBondContact O-N 3.43Å; P96-I100 VanDerWaalsContact O-CB 3.24Å; P96-I100 WeakPolarHBondContact O-CB 3.25Å; P96-I100 WeakPolarHBondContact O-CD1 3.37Å; P96-I100 WeakPolarHBondContact O-CG1 3.23Å; P96-I100 PolarHBondContact O-N 3.41Å; P96-A143 HydrophobicContact CG-CB 4.11Å; P96-P144 HydrophobicContact CG-CG 4.49Å; P96-A147 HydrophobicContact CB-CB 3.76Å; P96-A147 HydrophobicContact CG-CB 4.26Å |
| 97 | T | 68.4 | Low | 79.8 | Confident | 40 Ų | 40 | 57.8 Ų | 57.8 | 25% | 0.245 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -66.7 | -39.5 | -177.4 | -40.5 | 0 | 0 | 0 | 0 | 112.1 | L95 R101 G287 | L95-T97 PolarHBondContact O-N 3.45Å; T97-R101 VanDerWaalsContact O-CB 3.3Å; T97-R101 WeakPolarHBondContact O-CB 3.21Å; T97-R101 PolarHBondContact O-N 2.94Å; T97-G287 WeakPolarHBondContact OG1-CA 3.49Å; T97-G287 PolarHBondContact OG1-N 3.27Å |
| 98 | L | 70.6 | Confident | 79.8 | Confident | 109 Ų | 109 | 57.2 Ų | 57.2 | 57% | 0.571 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -69.9 | -45.1 | -177.6 | -69.8 | 177 | 0 | 0 | 0 | 112 | F94 L95 P96 K102 | F94-L98 HydrophobicContact CB-CD1 4.5Å; F94-L98 WeakPolarHBondContact O-CD1 3.36Å; F94-L98 VanDerWaalsContact O-CG 3.22Å; F94-L98 WeakPolarHBondContact O-CG 3.26Å; L95-L98 PolarHBondContact O-N 2.92Å; P96-L98 PolarHBondContact O-N 3.43Å; L98-K102 PolarHBondContact O-N 3.41Å |
| 99 | I | 76.3 | Confident | 80 | Confident | 46 Ų | 46 | 56.8 Ų | 56.8 | 24% | 0.236 | 27% | 0.272 | C | S | . | . | H | α-helix | trans | -76.3 | -45.5 | -174.2 | -61.3 | 178.3 | 0 | 0 | 0 | 110.5 | L95 R101 K102 L103 T108 P144 | L95-I99 HydrophobicContact CB-CD1 3.86Å; L95-I99 HydrophobicContact CB-CG1 4.45Å; L95-I99 HydrophobicContact CD2-CD1 4.11Å; L95-I99 HydrophobicContact CG-CD1 3.94Å; L95-I99 VanDerWaalsContact O-CB 3.31Å; L95-I99 WeakPolarHBondContact O-CB 3.29Å; L95-I99 VanDerWaalsContact O-CG1 3.25Å; L95-I99 WeakPolarHBondContact O-CG1 3.28Å; L95-I99 PolarHBondContact O-N 3.32Å; I99-R101 VanDerWaalsContact C-N 3.26Å; I99-R101 PolarHBondContact O-N 3.28Å; I99-K102 PolarHBondContact O-N 3.46Å; I99-L103 HydrophobicContact CG2-CB 4.5Å; I99-L103 HydrophobicContact CG2-CD1 3.73Å; I99-L103 HydrophobicContact CG2-CG 4.33Å; I99-L103 PolarHBondContact O-N 3.32Å; I99-T108 HydrophobicContact CB-CG2 4.34Å; I99-T108 HydrophobicContact CG2-CG2 3.64Å; I99-P144 HydrophobicContact CD1-CB 4.42Å; I99-P144 HydrophobicContact CD1-CG 3.91Å |
| 100 | I | 72.6 | Confident | 80.7 | Confident | 22 Ų | 22 | 56.1 Ų | 56.1 | 11% | 0.113 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -58 | -42.1 | 179.6 | -67.7 | 170.9 | 0 | 0 | 0 | 110.7 | P96 K102 T104 V105 T108 A147 S148 | P96-I100 VanDerWaalsContact O-CB 3.24Å; P96-I100 WeakPolarHBondContact O-CB 3.25Å; P96-I100 WeakPolarHBondContact O-CD1 3.37Å; P96-I100 WeakPolarHBondContact O-CG1 3.23Å; P96-I100 PolarHBondContact O-N 3.41Å; I100-K102 VanDerWaalsContact C-N 3.33Å; I100-K102 PolarHBondContact O-N 2.94Å; I100-T104 WeakPolarHBondContact O-CA 3.35Å; I100-T104 PolarHBondContact O-N 2.95Å; I100-V105 HydrophobicContact CG2-CG2 3.83Å; I100-T108 HydrophobicContact CG1-CG2 3.97Å; I100-A147 HydrophobicContact CD1-CB 4.05Å; I100-S148 WeakPolarHBondContact CG1-OG 3.46Å |
| 101 | R | 69.8 | Low | 81.2 | Confident | 218 Ų | 218 | 54.7 Ų | 54.7 | 82% | 0.823 | 26% | 0.262 | S | S | * | . | H | α-helix | trans | -64.4 | -34.7 | 178.2 | -172.8 | 174.7 | 175.2 | -178.9 | -1.7 | 113.1 | T97 I99 | T97-R101 VanDerWaalsContact O-CB 3.3Å; T97-R101 WeakPolarHBondContact O-CB 3.21Å; T97-R101 PolarHBondContact O-N 2.94Å; I99-R101 VanDerWaalsContact C-N 3.26Å; I99-R101 PolarHBondContact O-N 3.28Å |
| 102 | K | 79.1 | Confident | 81.6 | Confident | 172 Ų | 172 | 54.9 Ų | 54.9 | 75% | 0.748 | 26% | 0.263 | S | S | * | . | H | α-helix | trans | -82.1 | -49.9 | 179.8 | -74.9 | -171 | 176.9 | -174 | 0 | 112.5 | L98 I99 I100 | L98-K102 PolarHBondContact O-N 3.41Å; I99-K102 PolarHBondContact O-N 3.46Å; I100-K102 VanDerWaalsContact C-N 3.33Å; I100-K102 PolarHBondContact O-N 2.94Å |
| 103 | L | 79.6 | Confident | 82.6 | Confident | 75 Ų | 75 | 52.7 Ų | 52.7 | 39% | 0.393 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -96 | -12.1 | -166.9 | -66.9 | 178.4 | 0 | 0 | 0 | 114.4 | I99 W107 C111 | I99-L103 HydrophobicContact CG2-CB 4.5Å; I99-L103 HydrophobicContact CG2-CD1 3.73Å; I99-L103 HydrophobicContact CG2-CG 4.33Å; I99-L103 PolarHBondContact O-N 3.32Å; L103-W107 HydrophobicContact CB-CB 4.3Å; L103-W107 WeakPolarHBondContact O-CB 3.42Å; L103-C111 HydrophobicContact CD1-CB 4.46Å |
| 104 | T | 86.1 | Confident | 83.8 | Confident | 5 Ų | 5 | 54.8 Ų | 54.8 | 3% | 0.031 | 26% | 0.259 | C | S | . | . | trans | 68.9 | 155.3 | -161.4 | 67.3 | 0 | 0 | 0 | 0 | 112.8 | I100 K106 W107 T108 E274 K275 | I100-T104 WeakPolarHBondContact O-CA 3.35Å; I100-T104 PolarHBondContact O-N 2.95Å; T104-K106 PolarHBondContact O-N 2.86Å; T104-W107 PolarHBondContact O-N 3.25Å; T104-T108 VanDerWaalsContact O-CB 3.32Å; T104-T108 WeakPolarHBondContact O-CB 3.46Å; T104-T108 PolarHBondContact O-N 2.9Å; T104-T108 PolarHBondContact O-OG1 2.73Å; T104-E274 WeakPolarHBondContact CB-OE1 3.35Å; T104-K275 HydrophobicContact CG2-CD 4.32Å | ||
| 105 | V | 87.2 | Confident | 85 | Confident | 1 Ų | 1 | 51.5 Ų | 51.5 | 1% | 0.006 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -56.7 | -46 | -177.9 | 176 | 0 | 0 | 0 | 0 | 111.4 | I100 T108 L109 S148 T151 Y152 L269 E274 | I100-V105 HydrophobicContact CG2-CG2 3.83Å; V105-T108 PolarHBondContact O-N 3.44Å; V105-L109 WeakPolarHBondContact O-CG 3.43Å; V105-L109 PolarHBondContact O-N 2.88Å; V105-S148 WeakPolarHBondContact CG1-O 3.36Å; V105-T151 HydrophobicContact CG2-CG2 4.06Å; V105-Y152 HydrophobicContact CG1-CD2 4.02Å; V105-L269 HydrophobicContact CB-CD1 3.75Å; V105-L269 HydrophobicContact CG1-CD1 3.78Å; V105-L269 HydrophobicContact CG2-CD1 3.83Å; V105-E274 WeakPolarHBondContact CA-OE1 3.33Å; V105-E274 WeakPolarHBondContact CB-OE1 3.45Å; V105-E274 WeakPolarHBondContact CG2-OE1 3.46Å; V105-E274 PolarHBondContact N-OE1 3.35Å |
| 106 | K | 92.1 | Very high | 86.1 | Confident | 21 Ų | 21 | 50 Ų | 50 | 9% | 0.091 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -58.6 | -53.1 | 179.5 | 175.9 | 178.6 | 174 | 168.8 | 0 | 111.9 | T104 T108 L109 V110 I262 A263 L266 P268 | T104-K106 PolarHBondContact O-N 2.86Å; K106-T108 VanDerWaalsContact C-N 3.33Å; K106-L109 WeakPolarHBondContact O-CB 3.46Å; K106-L109 PolarHBondContact O-N 3.09Å; K106-V110 WeakPolarHBondContact O-CG2 3.39Å; K106-V110 PolarHBondContact O-N 3.38Å; K106-V110 VanDerWaalsContact O-N 3.14Å; K106-I262 VanDerWaalsContact CE-O 3.29Å; K106-I262 WeakPolarHBondContact CE-O 3.38Å; K106-A263 WeakPolarHBondContact CE-O 3.15Å; K106-A263 PolarHBondContact NZ-O 2.67Å; K106-L266 WeakPolarHBondContact CD-O 3.43Å; K106-L266 VanDerWaalsContact CE-O 3.26Å; K106-L266 WeakPolarHBondContact CE-O 3.16Å; K106-L266 HydrophobicContact CG-CD2 4.48Å; K106-L266 PolarHBondContact NZ-O 3.38Å; K106-P268 HydrophobicContact CD-CB 4.29Å |
| 107 | W | 92.9 | Very high | 87.3 | Confident | 121 Ų | 121 | 49.8 Ų | 49.8 | 46% | 0.458 | 24% | 0.239 | S | C | . | . | H | α-helix | trans | -75.4 | -25.6 | -177.8 | -64.2 | 108.5 | 0 | 0 | 0 | 112.5 | L103 T104 L109 V110 C111 | L103-W107 HydrophobicContact CB-CB 4.3Å; L103-W107 WeakPolarHBondContact O-CB 3.42Å; T104-W107 PolarHBondContact O-N 3.25Å; W107-L109 VanDerWaalsContact C-N 3.32Å; W107-V110 HydrophobicContact CE3-CB 4.13Å; W107-V110 HydrophobicContact CE3-CG1 4.14Å; W107-V110 HydrophobicContact CE3-CG2 4.15Å; W107-V110 HydrophobicContact CZ3-CG1 4.3Å; W107-V110 PolarHBondContact O-N 3.19Å; W107-C111 WeakPolarHBondContact O-CB 3.44Å; W107-C111 PolarHBondContact O-N 3.47Å; W107-C111 PolarHBondContact O-SG 2.68Å; W107-C111 VanDerWaalsContact O-SG 3.34Å |
| 108 | T | 91.9 | Very high | 88.7 | Confident | 0 Ų | 0 | 49.8 Ų | 49.8 | 0% | 0 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -61.2 | -43.7 | 168.2 | -55.5 | 0 | 0 | 0 | 0 | 110.4 | I99 I100 T104 V105 K106 S112 P144 S148 | I99-T108 HydrophobicContact CB-CG2 4.34Å; I99-T108 HydrophobicContact CG2-CG2 3.64Å; I100-T108 HydrophobicContact CG1-CG2 3.97Å; T104-T108 VanDerWaalsContact O-CB 3.32Å; T104-T108 WeakPolarHBondContact O-CB 3.46Å; T104-T108 PolarHBondContact O-N 2.9Å; T104-T108 PolarHBondContact O-OG1 2.73Å; V105-T108 PolarHBondContact O-N 3.44Å; K106-T108 VanDerWaalsContact C-N 3.33Å; T108-S112 WeakPolarHBondContact O-CB 3.29Å; T108-S112 PolarHBondContact O-N 2.67Å; T108-S112 PolarHBondContact O-OG 2.99Å; T108-P144 HydrophobicContact CG2-CB 3.74Å; T108-S148 WeakPolarHBondContact CB-OG 3.45Å; T108-S148 WeakPolarHBondContact CG2-OG 3.5Å |
| 109 | L | 94 | Very high | 89.9 | Confident | 0 Ų | 0 | 44.6 Ų | 44.6 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -58 | -51 | 172.7 | -72.3 | 169.5 | 0 | 0 | 0 | 111.6 | F53 V105 K106 W107 S112 M113 M145 K149 I262 L266 | F53-L109 HydrophobicContact CE2-CD2 3.88Å; F53-L109 HydrophobicContact CZ-CD2 3.9Å; V105-L109 WeakPolarHBondContact O-CG 3.43Å; V105-L109 PolarHBondContact O-N 2.88Å; K106-L109 WeakPolarHBondContact O-CB 3.46Å; K106-L109 PolarHBondContact O-N 3.09Å; W107-L109 VanDerWaalsContact C-N 3.32Å; L109-S112 PolarHBondContact O-N 2.93Å; L109-M113 WeakPolarHBondContact O-CB 3.35Å; L109-M113 VanDerWaalsContact O-CG 3.23Å; L109-M113 WeakPolarHBondContact O-CG 3.36Å; L109-M113 PolarHBondContact O-N 3.09Å; L109-M145 HydrophobicContact CD2-CG 4.23Å; L109-M145 WeakPolarHBondContact CD2-O 3.43Å; L109-K149 HydrophobicContact CD2-CB 4.15Å; L109-I262 HydrophobicContact CB-CG2 3.99Å; L109-L266 HydrophobicContact CD1-CD2 3.93Å |
| 110 | V | 96.9 | Very high | 90.8 | Very high | 16 Ų | 16 | 42.5 Ų | 42.5 | 10% | 0.097 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -56.2 | -55.4 | -179.8 | 173 | 0 | 0 | 0 | 0 | 111.8 | K106 W107 S112 M113 L114 V259 I262 A263 | K106-V110 WeakPolarHBondContact O-CG2 3.39Å; K106-V110 PolarHBondContact O-N 3.38Å; K106-V110 VanDerWaalsContact O-N 3.14Å; W107-V110 HydrophobicContact CE3-CB 4.13Å; W107-V110 HydrophobicContact CE3-CG1 4.14Å; W107-V110 HydrophobicContact CE3-CG2 4.15Å; W107-V110 HydrophobicContact CZ3-CG1 4.3Å; W107-V110 PolarHBondContact O-N 3.19Å; V110-S112 VanDerWaalsContact C-N 3.31Å; V110-S112 PolarHBondContact O-N 3.49Å; V110-M113 PolarHBondContact O-N 3.24Å; V110-L114 WeakPolarHBondContact O-CB 3.43Å; V110-L114 PolarHBondContact O-N 2.91Å; V110-L114 VanDerWaalsContact O-N 3.09Å; V110-V259 HydrophobicContact CG1-CG1 3.97Å; V110-I262 HydrophobicContact CG2-CB 4.29Å; V110-I262 HydrophobicContact CG2-CG2 3.7Å; V110-A263 HydrophobicContact CG2-CB 4.03Å |
| 111 | C | 95.6 | Very high | 91.9 | Very high | 58 Ų | 58 | 42.9 Ų | 42.9 | 39% | 0.392 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -62.7 | -39.7 | -178.7 | -66.2 | 0 | 0 | 0 | 0 | 111.9 | L103 W107 L114 C115 | L103-C111 HydrophobicContact CD1-CB 4.46Å; W107-C111 WeakPolarHBondContact O-CB 3.44Å; W107-C111 PolarHBondContact O-N 3.47Å; W107-C111 PolarHBondContact O-SG 2.68Å; W107-C111 VanDerWaalsContact O-SG 3.34Å; C111-L114 PolarHBondContact O-N 3.41Å; C111-C115 PolarHBondContact O-N 3.05Å; C111-C115 PolarHBondContact O-SG 3.06Å; C111-C115 VanDerWaalsContact O-SG 3.35Å |
| 112 | S | 95.4 | Very high | 93.1 | Very high | 5 Ų | 5 | 36.4 Ų | 36.4 | 4% | 0.035 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -72.1 | -36.8 | -178 | -56.5 | 0 | 0 | 0 | 0 | 113.1 | T108 L109 V110 L114 C115 G141 | T108-S112 WeakPolarHBondContact O-CB 3.29Å; T108-S112 PolarHBondContact O-N 2.67Å; T108-S112 PolarHBondContact O-OG 2.99Å; L109-S112 PolarHBondContact O-N 2.93Å; V110-S112 VanDerWaalsContact C-N 3.31Å; V110-S112 PolarHBondContact O-N 3.49Å; S112-L114 VanDerWaalsContact C-N 3.33Å; S112-C115 VanDerWaalsContact O-CB 3.32Å; S112-C115 WeakPolarHBondContact O-CB 3.48Å; S112-C115 PolarHBondContact O-N 3.29Å; S112-G141 VanDerWaalsContact CB-O 3.24Å; S112-G141 WeakPolarHBondContact CB-O 3.33Å |
| 113 | M | 96.9 | Very high | 93.6 | Very high | 0 Ų | 0 | 28.4 Ų | 28.4 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -69.2 | -35.2 | 175.3 | -71.3 | 175.8 | 80.6 | 0 | 0 | 111.1 | A52 F53 Q56 L109 V110 C115 Y116 M145 A258 V259 I262 | A52-M113 HydrophobicContact CB-CE 4.23Å; F53-M113 HydrophobicContact CE2-SD 4.42Å; Q56-M113 HydrophobicContact CB-CE 3.68Å; Q56-M113 HydrophobicContact CG-CE 3.93Å; Q56-M113 PolarHBondContact NE2-O 3.09Å; L109-M113 WeakPolarHBondContact O-CB 3.35Å; L109-M113 VanDerWaalsContact O-CG 3.23Å; L109-M113 WeakPolarHBondContact O-CG 3.36Å; L109-M113 PolarHBondContact O-N 3.09Å; V110-M113 PolarHBondContact O-N 3.24Å; M113-C115 PolarHBondContact O-N 3.47Å; M113-Y116 WeakPolarHBondContact O-CB 3.46Å; M113-Y116 PolarHBondContact O-N 3.3Å; M113-Y116 VanDerWaalsContact O-N 3.17Å; M113-M145 HydrophobicContact CG-CG 4.06Å; M113-M145 HydrophobicContact CG-SD 3.5Å; M113-M145 VanDerWaalsContact CG-SD 3.5Å; M113-A258 HydrophobicContact CE-CB 3.72Å; M113-V259 HydrophobicContact CB-CG2 3.79Å; M113-I262 HydrophobicContact CE-CG1 4.5Å; M113-I262 HydrophobicContact SD-CG1 3.87Å |
| 114 | L | 97.1 | Very high | 94.1 | Very high | 94 Ų | 94 | 27.5 Ų | 27.5 | 49% | 0.492 | 15% | 0.147 | S | C | . | . | H | α-helix | trans | -63.5 | -27.4 | 176.3 | -171.9 | 63.9 | 0 | 0 | 0 | 112.9 | V110 C111 S112 Y116 A117 P118 V259 | V110-L114 WeakPolarHBondContact O-CB 3.43Å; V110-L114 PolarHBondContact O-N 2.91Å; V110-L114 VanDerWaalsContact O-N 3.09Å; C111-L114 PolarHBondContact O-N 3.41Å; S112-L114 VanDerWaalsContact C-N 3.33Å; L114-Y116 PolarHBondContact O-N 3.37Å; L114-A117 HydrophobicContact CD1-CB 4.32Å; L114-A117 WeakPolarHBondContact O-CB 3.04Å; L114-A117 PolarHBondContact O-N 3.16Å; L114-P118 WeakPolarHBondContact O-CD 3.38Å; L114-V259 HydrophobicContact CB-CG2 4.4Å |
| 115 | C | 97.3 | Very high | 94.3 | Very high | 25 Ų | 25 | 34.1 Ų | 34.1 | 17% | 0.169 | 18% | 0.176 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -57.1 | -18.4 | 174.2 | -67.6 | 0 | 0 | 0 | 0 | 114 | C111 S112 M113 L137 | C111-C115 PolarHBondContact O-N 3.05Å; C111-C115 PolarHBondContact O-SG 3.06Å; C111-C115 VanDerWaalsContact O-SG 3.35Å; S112-C115 VanDerWaalsContact O-CB 3.32Å; S112-C115 WeakPolarHBondContact O-CB 3.48Å; S112-C115 PolarHBondContact O-N 3.29Å; M113-C115 PolarHBondContact O-N 3.47Å; C115-L137 HydrophobicContact CB-CD1 4.4Å; C115-L137 HydrophobicContact CB-CG 3.94Å; C115-L137 WeakPolarHBondContact CB-O 3.31Å |
| 116 | Y | 97.4 | Very high | 94.5 | Very high | 4 Ų | 4 | 35.4 Ų | 35.4 | 2% | 0.016 | 18% | 0.184 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -81.8 | -24.3 | 177.5 | -70.2 | -118.7 | 0 | 0 | 0 | 113.2 | F60 M113 L114 Y119 I120 V138 A142 M145 | F60-Y116 HydrophobicContact CB-CD1 4.14Å; F60-Y116 HydrophobicContact CB-CE1 4.22Å; F60-Y116 HydrophobicContact CD1-CE1 4.23Å; F60-Y116 AromaticContact CD2-CD1 3.61Å; F60-Y116 HydrophobicContact CD2-CD1 3.61Å; F60-Y116 AromaticContact CD2-CE1 3.61Å; F60-Y116 HydrophobicContact CD2-CE1 3.61Å; F60-Y116 HydrophobicContact CE2-CD1 4.25Å; F60-Y116 HydrophobicContact CE2-CE1 4Å; F60-Y116 AromaticContact CG-CD1 3.96Å; F60-Y116 HydrophobicContact CG-CD1 3.96Å; F60-Y116 AromaticContact CG-CE1 3.73Å; F60-Y116 HydrophobicContact CG-CE1 3.73Å; F60-Y116 HydrophobicContact CZ-CE1 4.46Å; M113-Y116 WeakPolarHBondContact O-CB 3.46Å; M113-Y116 PolarHBondContact O-N 3.3Å; M113-Y116 VanDerWaalsContact O-N 3.17Å; L114-Y116 PolarHBondContact O-N 3.37Å; Y116-Y119 PolarHBondContact O-N 2.86Å; Y116-I120 PolarHBondContact O-N 3.08Å; Y116-V138 HydrophobicContact CD1-CG1 3.91Å; Y116-V138 HydrophobicContact CD1-CG2 4.4Å; Y116-V138 HydrophobicContact CD2-CG1 4.34Å; Y116-V138 HydrophobicContact CE1-CG1 3.61Å; Y116-V138 HydrophobicContact CE2-CG1 4.04Å; Y116-V138 HydrophobicContact CG-CG1 4.26Å; Y116-V138 HydrophobicContact CG-CG2 4.25Å; Y116-A142 WeakPolarHBondContact OH-CB 3.46Å; Y116-M145 HydrophobicContact CE2-CE 4.06Å; Y116-M145 HydrophobicContact CE2-SD 4.17Å; Y116-M145 WeakPolarHBondContact OH-CE 3.47Å |
| 117 | A | 96.9 | Very high | 94.5 | Very high | 13 Ų | 13 | 41.4 Ų | 41.4 | 11% | 0.107 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -59.8 | -44.9 | -175.6 | 0 | 0 | 0 | 0 | 0 | 113 | L114 Y119 I120 A121 L252 I255 | L114-A117 HydrophobicContact CD1-CB 4.32Å; L114-A117 WeakPolarHBondContact O-CB 3.04Å; L114-A117 PolarHBondContact O-N 3.16Å; A117-Y119 VanDerWaalsContact C-N 3.29Å; A117-Y119 PolarHBondContact O-N 3.29Å; A117-I120 PolarHBondContact O-N 2.89Å; A117-A121 WeakPolarHBondContact O-CB 3.46Å; A117-A121 PolarHBondContact O-N 3.49Å; A117-L252 HydrophobicContact CB-CD1 3.9Å; A117-I255 HydrophobicContact CB-CG2 3.98Å |
| 118 | P | 96.9 | Very high | 94.6 | Very high | 41 Ų | 41 | 40 Ų | 40 | 27% | 0.266 | 20% | 0.203 | S | C | . | . | H | α-helix | trans | -62 | -35.2 | 177.5 | -25.7 | 37.4 | 0 | 0 | 0 | 113.5 | L114 A121 F122 A134 L137 | L114-P118 WeakPolarHBondContact O-CD 3.38Å; P118-A121 PolarHBondContact O-N 3.34Å; P118-F122 HydrophobicContact CB-CD2 4.38Å; P118-F122 HydrophobicContact CB-CE2 4.12Å; P118-F122 WeakPolarHBondContact O-CB 3.27Å; P118-F122 VanDerWaalsContact O-CD2 3.24Å; P118-F122 WeakPolarHBondContact O-CD2 3.48Å; P118-F122 VanDerWaalsContact O-CG 3.31Å; P118-F122 WeakPolarHBondContact O-CG 3.42Å; P118-F122 PolarHBondContact O-N 3.47Å; P118-A134 HydrophobicContact CB-CB 4.25Å; P118-L137 HydrophobicContact CB-CD2 4.44Å; P118-L137 HydrophobicContact CG-CD2 3.9Å |
| 119 | Y | 96.3 | Very high | 94.6 | Very high | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -66.6 | -38.6 | 179.9 | -175.1 | -106.2 | 0 | 0 | 0 | 111.9 | F60 T63 S80 I84 Y116 A117 Q123 A134 V138 | F60-Y119 HydrophobicContact CE2-CE1 4.39Å; T63-Y119 HydrophobicContact CG2-CE1 4.35Å; S80-Y119 PolarHBondContact OG-OH 3.11Å; I84-Y119 HydrophobicContact CD1-CD1 4.45Å; I84-Y119 HydrophobicContact CD1-CD2 4.48Å; I84-Y119 HydrophobicContact CD1-CE1 3.93Å; I84-Y119 HydrophobicContact CD1-CE2 3.98Å; Y116-Y119 PolarHBondContact O-N 2.86Å; A117-Y119 VanDerWaalsContact C-N 3.29Å; A117-Y119 PolarHBondContact O-N 3.29Å; Y119-Q123 WeakPolarHBondContact O-CG 3.5Å; Y119-A134 HydrophobicContact CD2-CB 4.14Å; Y119-V138 VanDerWaalsContact CB-CG2 3.47Å; Y119-V138 HydrophobicContact CD1-CG2 4.37Å; Y119-V138 HydrophobicContact CG-CG2 3.9Å |
| 120 | I | 95.4 | Very high | 94.7 | Very high | 1 Ų | 1 | 49.2 Ų | 49.2 | 1% | 0.005 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -72.6 | -43.9 | 173.9 | -54.2 | -56 | 0 | 0 | 0 | 111 | T63 Y116 A117 F122 Q123 S248 L252 I255 | T63-I120 HydrophobicContact CG2-CD1 3.88Å; T63-I120 WeakPolarHBondContact OG1-CD1 3.42Å; Y116-I120 PolarHBondContact O-N 3.08Å; A117-I120 PolarHBondContact O-N 2.89Å; I120-F122 PolarHBondContact O-N 3.47Å; I120-Q123 WeakPolarHBondContact O-CB 3.35Å; I120-Q123 VanDerWaalsContact O-CG 3.31Å; I120-Q123 WeakPolarHBondContact O-CG 3.46Å; I120-Q123 PolarHBondContact O-N 2.85Å; I120-S248 WeakPolarHBondContact CG2-O 3.34Å; I120-L252 HydrophobicContact CG2-CB 4.11Å; I120-I255 HydrophobicContact CG1-CG1 4.08Å |
| 121 | A | 94.8 | Very high | 94.6 | Very high | 31 Ų | 31 | 48.4 Ų | 48.4 | 26% | 0.256 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -64.2 | -37.9 | -178.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | A117 P118 Q123 L124 L252 | A117-A121 WeakPolarHBondContact O-CB 3.46Å; A117-A121 PolarHBondContact O-N 3.49Å; P118-A121 PolarHBondContact O-N 3.34Å; A121-Q123 PolarHBondContact O-N 2.92Å; A121-L124 WeakPolarHBondContact O-CG 3.42Å; A121-L124 PolarHBondContact O-N 2.88Å; A121-L252 HydrophobicContact CB-CD1 4.42Å; A121-L252 HydrophobicContact CB-CD2 4.31Å |
| 122 | F | 94.8 | Very high | 94.6 | Very high | 82 Ų | 82 | 47.2 Ų | 47.2 | 36% | 0.36 | 23% | 0.227 | S | C | . | . | G | 310 helix | trans | -74.8 | -0.6 | 179.5 | -69 | -33 | 0 | 0 | 0 | 114.5 | P118 I120 L124 F125 T130 L131 A134 | P118-F122 HydrophobicContact CB-CD2 4.38Å; P118-F122 HydrophobicContact CB-CE2 4.12Å; P118-F122 WeakPolarHBondContact O-CB 3.27Å; P118-F122 VanDerWaalsContact O-CD2 3.24Å; P118-F122 WeakPolarHBondContact O-CD2 3.48Å; P118-F122 VanDerWaalsContact O-CG 3.31Å; P118-F122 WeakPolarHBondContact O-CG 3.42Å; P118-F122 PolarHBondContact O-N 3.47Å; I120-F122 PolarHBondContact O-N 3.47Å; F122-L124 PolarHBondContact O-N 3.3Å; F122-F125 CarbonylContact O-C 3.11Å; F122-F125 PolarHBondContact O-N 3.41Å; F122-T130 WeakPolarHBondContact CD2-O 3.28Å; F122-L131 HydrophobicContact CB-CD2 3.88Å; F122-A134 HydrophobicContact CD2-CB 3.75Å; F122-A134 HydrophobicContact CE2-CB 4.25Å |
| 123 | Q | 90.9 | Very high | 94.7 | Very high | 4 Ų | 4 | 50.2 Ų | 50.2 | 2% | 0.019 | 25% | 0.247 | C | C | . | . | G | 310 helix | trans | -65.9 | -20 | 168.4 | -56.8 | -57.6 | 6.4 | 0 | 0 | 113.2 | T63 N71 Y119 I120 A121 F125 P126 L131 | T63-Q123 HydrophobicContact CG2-CG 4.34Å; N71-Q123 PolarHBondContact ND2-OE1 2.88Å; Y119-Q123 WeakPolarHBondContact O-CG 3.5Å; I120-Q123 WeakPolarHBondContact O-CB 3.35Å; I120-Q123 VanDerWaalsContact O-CG 3.31Å; I120-Q123 WeakPolarHBondContact O-CG 3.46Å; I120-Q123 PolarHBondContact O-N 2.85Å; A121-Q123 PolarHBondContact O-N 2.92Å; Q123-F125 VanDerWaalsContact C-N 3.27Å; Q123-F125 PolarHBondContact O-N 2.85Å; Q123-P126 WeakPolarHBondContact O-CD 3.21Å; Q123-L131 VanDerWaalsContact OE1-CD2 3.25Å |
| 124 | L | 88.9 | Confident | 94.8 | Very high | 55 Ų | 55 | 50.3 Ų | 50.3 | 29% | 0.288 | 25% | 0.248 | S | C | . | . | G | 310 helix | trans | -69.6 | -24.8 | 170.3 | -57 | -178.6 | 0 | 0 | 0 | 112.7 | A121 F122 F245 | A121-L124 WeakPolarHBondContact O-CG 3.42Å; A121-L124 PolarHBondContact O-N 2.88Å; F122-L124 PolarHBondContact O-N 3.3Å; L124-F245 HydrophobicContact CD1-CD2 4.11Å; L124-F245 HydrophobicContact CD1-CE2 4.23Å; L124-F245 HydrophobicContact CD2-CB 4.08Å; L124-F245 HydrophobicContact CD2-CD2 3.64Å; L124-F245 HydrophobicContact CD2-CG 4.25Å |
| 125 | F | 90.3 | Very high | 94.7 | Very high | 145 Ų | 145 | 45.9 Ų | 45.9 | 64% | 0.636 | 22% | 0.224 | S | C | * | . | S | Bend | trans | -133.6 | 66.7 | -179.8 | -58.6 | -76.5 | 0 | 0 | 0 | 110.4 | F122 Q123 R127 T130 | F122-F125 CarbonylContact O-C 3.11Å; F122-F125 PolarHBondContact O-N 3.41Å; Q123-F125 VanDerWaalsContact C-N 3.27Å; Q123-F125 PolarHBondContact O-N 2.85Å; F125-R127 PolarHBondContact O-N 3.38Å; F125-T130 PolarHBondContact O-OG1 3.27Å |
| 126 | P | 90.9 | Very high | 94.7 | Very high | 27 Ų | 27 | 48.1 Ų | 48.1 | 18% | 0.175 | 23% | 0.234 | C | C | . | . | trans | -74.3 | 102.1 | -170.1 | 30.3 | -33.1 | 0 | 0 | 0 | 110.2 | N71 L76 Q123 L131 | N71-P126 VanDerWaalsContact OD1-CB 3.23Å; N71-P126 WeakPolarHBondContact OD1-CB 3.45Å; L76-P126 VanDerWaalsContact CD2-C 3.49Å; L76-P126 HydrophobicContact CD2-CB 4.01Å; L76-P126 WeakPolarHBondContact CD2-O 3.36Å; Q123-P126 WeakPolarHBondContact O-CD 3.21Å; P126-L131 HydrophobicContact CB-CD1 3.78Å | ||
| 127 | R | 93.8 | Very high | 94.7 | Very high | 147 Ų | 147 | 51.1 Ų | 51.1 | 56% | 0.555 | 25% | 0.25 | S | S | * | . | trans | -135.9 | 156.2 | 174.8 | -61.3 | -68.3 | -174.5 | 175 | 0.1 | 109.1 | F125 Y129 T130 L131 | F125-R127 PolarHBondContact O-N 3.38Å; R127-Y129 HydrophobicContact CB-CD1 3.87Å; R127-Y129 HydrophobicContact CB-CE1 3.53Å; R127-Y129 HydrophobicContact CB-CE2 4.24Å; R127-Y129 HydrophobicContact CB-CG 4.35Å; R127-Y129 HydrophobicContact CG-CE1 3.86Å; R127-Y129 PolarHBondContact O-N 3.22Å; R127-T130 HydrophobicContact CB-CG2 4.41Å; R127-T130 PolarHBondContact N-OG1 3.43Å; R127-T130 PolarHBondContact O-N 3.12Å; R127-T130 PolarHBondContact O-OG1 3.06Å; R127-L131 PolarHBondContact O-N 3.36Å | ||
| 128 | F | 93.4 | Very high | 94.7 | Very high | 91 Ų | 91 | 50.5 Ų | 50.5 | 40% | 0.399 | 25% | 0.245 | S | C | . | . | H | α-helix | trans | -54.7 | -42.5 | 177.2 | -77.5 | -83.1 | 0 | 0 | 0 | 112.3 | D74 L76 V79 T130 V132 P133 | D74-F128 HydrophobicContact CB-CE2 3.88Å; D74-F128 HydrophobicContact CB-CZ 3.93Å; L76-F128 HydrophobicContact CB-CE1 4.37Å; L76-F128 HydrophobicContact CB-CE2 4.27Å; L76-F128 HydrophobicContact CB-CZ 4.04Å; L76-F128 HydrophobicContact CD1-CB 4.21Å; L76-F128 HydrophobicContact CD1-CD1 3.61Å; L76-F128 HydrophobicContact CD1-CD2 4.02Å; L76-F128 HydrophobicContact CD1-CE1 3.87Å; L76-F128 HydrophobicContact CD1-CE2 4.25Å; L76-F128 HydrophobicContact CD1-CG 3.68Å; L76-F128 HydrophobicContact CD1-CZ 4.19Å; V79-F128 HydrophobicContact CB-CE1 4.18Å; V79-F128 HydrophobicContact CG1-CD1 4.37Å; V79-F128 HydrophobicContact CG1-CE1 4.1Å; V79-F128 HydrophobicContact CG2-CE1 4.32Å; F128-T130 VanDerWaalsContact C-N 3.25Å; F128-T130 PolarHBondContact O-N 3.04Å; F128-V132 HydrophobicContact CD1-CG2 4.17Å; F128-V132 VanDerWaalsContact O-CB 3.24Å; F128-V132 WeakPolarHBondContact O-CB 3.31Å; F128-V132 WeakPolarHBondContact O-CG2 3.27Å; F128-V132 PolarHBondContact O-N 3.14Å; F128-P133 WeakPolarHBondContact O-CD 3.13Å |
| 129 | Y | 93.8 | Very high | 94.6 | Very high | 175 Ų | 175 | 48.6 Ų | 48.6 | 69% | 0.686 | 23% | 0.232 | S | C | * | . | H | α-helix | trans | -76 | -5.3 | -179.5 | 62.7 | -97.2 | 0 | 0 | 0 | 114.6 | R127 P133 | R127-Y129 HydrophobicContact CB-CD1 3.87Å; R127-Y129 HydrophobicContact CB-CE1 3.53Å; R127-Y129 HydrophobicContact CB-CE2 4.24Å; R127-Y129 HydrophobicContact CB-CG 4.35Å; R127-Y129 HydrophobicContact CG-CE1 3.86Å; R127-Y129 PolarHBondContact O-N 3.22Å; Y129-P133 WeakPolarHBondContact O-CG 3.26Å |
| 130 | T | 95.5 | Very high | 94.4 | Very high | 19 Ų | 19 | 52.6 Ų | 52.6 | 12% | 0.117 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -104.5 | -55.5 | 173.4 | 57.1 | 0 | 0 | 0 | 0 | 111 | F122 F125 R127 F128 A134 | F122-T130 WeakPolarHBondContact CD2-O 3.28Å; F125-T130 PolarHBondContact O-OG1 3.27Å; R127-T130 HydrophobicContact CB-CG2 4.41Å; R127-T130 PolarHBondContact N-OG1 3.43Å; R127-T130 PolarHBondContact O-N 3.12Å; R127-T130 PolarHBondContact O-OG1 3.06Å; F128-T130 VanDerWaalsContact C-N 3.25Å; F128-T130 PolarHBondContact O-N 3.04Å; T130-A134 WeakPolarHBondContact O-CB 3.36Å; T130-A134 PolarHBondContact O-N 3.26Å |
| 131 | L | 94.9 | Very high | 94.3 | Very high | 0 Ų | 0 | 52.8 Ų | 52.8 | 0% | 0 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -74 | -37.5 | -173.9 | -69 | -178.1 | 0 | 0 | 0 | 113.9 | L76 F122 Q123 P126 R127 A134 G135 | L76-L131 HydrophobicContact CD1-CB 4.39Å; L76-L131 HydrophobicContact CD1-CD1 4.43Å; L76-L131 HydrophobicContact CD2-CD1 3.95Å; L76-L131 HydrophobicContact CG-CD1 4.01Å; F122-L131 HydrophobicContact CB-CD2 3.88Å; Q123-L131 VanDerWaalsContact OE1-CD2 3.25Å; P126-L131 HydrophobicContact CB-CD1 3.78Å; R127-L131 PolarHBondContact O-N 3.36Å; L131-A134 PolarHBondContact O-N 2.95Å; L131-G135 PolarHBondContact O-N 3.37Å |
| 132 | V | 95.9 | Very high | 94.2 | Very high | 32 Ų | 32 | 51.4 Ų | 51.4 | 19% | 0.194 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -67.2 | -49.5 | -179.6 | 177.4 | 0 | 0 | 0 | 0 | 111 | V79 A83 F128 A134 G135 I136 | V79-V132 HydrophobicContact CG1-CG2 3.97Å; A83-V132 HydrophobicContact CB-CG1 3.89Å; F128-V132 HydrophobicContact CD1-CG2 4.17Å; F128-V132 VanDerWaalsContact O-CB 3.24Å; F128-V132 WeakPolarHBondContact O-CB 3.31Å; F128-V132 WeakPolarHBondContact O-CG2 3.27Å; F128-V132 PolarHBondContact O-N 3.14Å; V132-A134 VanDerWaalsContact C-N 3.31Å; V132-A134 PolarHBondContact O-N 3.29Å; V132-G135 PolarHBondContact O-N 3.46Å; V132-G135 VanDerWaalsContact O-N 3.17Å; V132-I136 HydrophobicContact CG1-CD1 4.31Å; V132-I136 WeakPolarHBondContact O-CG1 3.42Å; V132-I136 PolarHBondContact O-N 2.86Å |
| 133 | P | 97.4 | Very high | 93.7 | Very high | 68 Ų | 68 | 47.8 Ų | 47.8 | 44% | 0.442 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -60 | -38.8 | 174.4 | -26.9 | 37.8 | 0 | 0 | 0 | 113.5 | F128 Y129 I136 L137 | F128-P133 WeakPolarHBondContact O-CD 3.13Å; Y129-P133 WeakPolarHBondContact O-CG 3.26Å; P133-I136 PolarHBondContact O-N 3.49Å; P133-L137 PolarHBondContact O-N 2.87Å |
| 134 | A | 97.2 | Very high | 93.6 | Very high | 3 Ų | 3 | 47.6 Ų | 47.6 | 3% | 0.025 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -68.1 | -35.4 | 175.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | P118 Y119 F122 T130 L131 V132 L137 V138 | P118-A134 HydrophobicContact CB-CB 4.25Å; Y119-A134 HydrophobicContact CD2-CB 4.14Å; F122-A134 HydrophobicContact CD2-CB 3.75Å; F122-A134 HydrophobicContact CE2-CB 4.25Å; T130-A134 WeakPolarHBondContact O-CB 3.36Å; T130-A134 PolarHBondContact O-N 3.26Å; L131-A134 PolarHBondContact O-N 2.95Å; V132-A134 VanDerWaalsContact C-N 3.31Å; V132-A134 PolarHBondContact O-N 3.29Å; A134-L137 WeakPolarHBondContact O-CB 3.36Å; A134-L137 PolarHBondContact O-N 3.49Å; A134-V138 WeakPolarHBondContact O-CG2 3.43Å; A134-V138 PolarHBondContact O-N 3.02Å |
| 135 | G | 96.4 | Very high | 93.8 | Very high | 0 Ų | 0 | 45 Ų | 45 | 0% | 0 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -63 | -43.5 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112 | I84 L131 V132 L137 V138 G139 | I84-G135 WeakPolarHBondContact CA-O 3.29Å; I84-G135 VanDerWaalsContact CG1-O 3.27Å; I84-G135 WeakPolarHBondContact CG1-O 3.34Å; L131-G135 PolarHBondContact O-N 3.37Å; V132-G135 PolarHBondContact O-N 3.46Å; V132-G135 VanDerWaalsContact O-N 3.17Å; G135-L137 VanDerWaalsContact C-N 3.28Å; G135-L137 PolarHBondContact O-N 2.9Å; G135-V138 WeakPolarHBondContact O-CB 3.37Å; G135-V138 PolarHBondContact O-N 2.97Å; G135-G139 PolarHBondContact O-N 2.69Å |
| 136 | I | 96.9 | Very high | 93.6 | Very high | 72 Ų | 72 | 39.9 Ų | 39.9 | 37% | 0.369 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -57.8 | -44.3 | 172.9 | -66.4 | 169.8 | 0 | 0 | 0 | 110.4 | A83 A87 V132 P133 V138 G139 M140 | A83-I136 HydrophobicContact CB-CG1 4.02Å; A87-I136 HydrophobicContact CB-CB 4.29Å; A87-I136 HydrophobicContact CB-CG2 4Å; A87-I136 WeakPolarHBondContact CB-O 3.36Å; V132-I136 HydrophobicContact CG1-CD1 4.31Å; V132-I136 WeakPolarHBondContact O-CG1 3.42Å; V132-I136 PolarHBondContact O-N 2.86Å; P133-I136 PolarHBondContact O-N 3.49Å; I136-V138 PolarHBondContact O-N 3.37Å; I136-G139 PolarHBondContact O-N 3.03Å; I136-M140 HydrophobicContact CG2-CG 4.37Å; I136-M140 HydrophobicContact CG2-SD 4.08Å; I136-M140 WeakPolarHBondContact O-CG 3.49Å; I136-M140 PolarHBondContact O-N 3.41Å |
| 137 | L | 97.1 | Very high | 93.2 | Very high | 68 Ų | 68 | 40 Ų | 40 | 36% | 0.356 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -61.4 | -43 | 177.8 | -176.1 | 63.5 | 0 | 0 | 0 | 112.2 | C115 P118 P133 A134 G135 M140 G141 | C115-L137 HydrophobicContact CB-CD1 4.4Å; C115-L137 HydrophobicContact CB-CG 3.94Å; C115-L137 WeakPolarHBondContact CB-O 3.31Å; P118-L137 HydrophobicContact CB-CD2 4.44Å; P118-L137 HydrophobicContact CG-CD2 3.9Å; P133-L137 PolarHBondContact O-N 2.87Å; A134-L137 WeakPolarHBondContact O-CB 3.36Å; A134-L137 PolarHBondContact O-N 3.49Å; G135-L137 VanDerWaalsContact C-N 3.28Å; G135-L137 PolarHBondContact O-N 2.9Å; L137-M140 PolarHBondContact O-N 3.01Å; L137-G141 PolarHBondContact O-N 3.34Å |
| 138 | V | 96.8 | Very high | 92.9 | Very high | 0 Ų | 0 | 33 Ų | 33 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -56.9 | -50.7 | 172.3 | 170.7 | 0 | 0 | 0 | 0 | 110.6 | F60 I84 Y116 Y119 A134 G135 I136 M140 G141 A142 | F60-V138 HydrophobicContact CE2-CG1 4.03Å; F60-V138 HydrophobicContact CZ-CG1 4.5Å; I84-V138 HydrophobicContact CD1-CB 4.46Å; I84-V138 HydrophobicContact CD1-CG1 4.24Å; I84-V138 HydrophobicContact CG1-CB 4.14Å; I84-V138 HydrophobicContact CG1-CG1 4.21Å; I84-V138 HydrophobicContact CG2-CB 4.37Å; I84-V138 HydrophobicContact CG2-CG1 3.76Å; Y116-V138 HydrophobicContact CD1-CG1 3.91Å; Y116-V138 HydrophobicContact CD1-CG2 4.4Å; Y116-V138 HydrophobicContact CD2-CG1 4.34Å; Y116-V138 HydrophobicContact CE1-CG1 3.61Å; Y116-V138 HydrophobicContact CE2-CG1 4.04Å; Y116-V138 HydrophobicContact CG-CG1 4.26Å; Y116-V138 HydrophobicContact CG-CG2 4.25Å; Y119-V138 VanDerWaalsContact CB-CG2 3.47Å; Y119-V138 HydrophobicContact CD1-CG2 4.37Å; Y119-V138 HydrophobicContact CG-CG2 3.9Å; A134-V138 WeakPolarHBondContact O-CG2 3.43Å; A134-V138 PolarHBondContact O-N 3.02Å; G135-V138 WeakPolarHBondContact O-CB 3.37Å; G135-V138 PolarHBondContact O-N 2.97Å; I136-V138 PolarHBondContact O-N 3.37Å; V138-M140 VanDerWaalsContact C-N 3.33Å; V138-M140 PolarHBondContact O-N 2.74Å; V138-G141 CarbonylContact O-C 3.26Å; V138-G141 PolarHBondContact O-N 3.39Å; V138-G141 VanDerWaalsContact O-N 3.15Å; V138-A142 WeakPolarHBondContact O-CB 3.29Å; V138-A142 PolarHBondContact O-N 2.67Å |
| 139 | G | 94.4 | Very high | 92.7 | Very high | 0 Ų | 0 | 28.9 Ų | 28.9 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -61 | -40.8 | 179.9 | 0 | 0 | 0 | 0 | 0 | 112.7 | I84 L88 S91 G135 I136 G141 A142 | I84-G139 VanDerWaalsContact O-CA 3.25Å; I84-G139 WeakPolarHBondContact O-CA 3.24Å; L88-G139 WeakPolarHBondContact CA-O 3.2Å; S91-G139 WeakPolarHBondContact CB-O 3.48Å; G135-G139 PolarHBondContact O-N 2.69Å; I136-G139 PolarHBondContact O-N 3.03Å; G139-G141 PolarHBondContact O-N 3.32Å; G139-A142 PolarHBondContact O-N 2.96Å |
| 140 | M | 93.2 | Very high | 92.2 | Very high | 85 Ų | 85 | 22 Ų | 22 | 42% | 0.419 | 13% | 0.128 | S | C | . | . | H | α-helix | trans | -61 | -41.9 | 173.7 | -72.7 | -178.7 | 70.3 | 0 | 0 | 112.4 | A87 S91 L95 I136 L137 V138 P144 | A87-M140 HydrophobicContact CB-CG 4.45Å; S91-M140 PolarHBondContact OG-O 3.31Å; L95-M140 HydrophobicContact CD2-CB 4.01Å; L95-M140 HydrophobicContact CD2-CE 3.97Å; L95-M140 HydrophobicContact CD2-CG 4.39Å; L95-M140 WeakPolarHBondContact CD2-O 3.42Å; I136-M140 HydrophobicContact CG2-CG 4.37Å; I136-M140 HydrophobicContact CG2-SD 4.08Å; I136-M140 WeakPolarHBondContact O-CG 3.49Å; I136-M140 PolarHBondContact O-N 3.41Å; L137-M140 PolarHBondContact O-N 3.01Å; V138-M140 VanDerWaalsContact C-N 3.33Å; V138-M140 PolarHBondContact O-N 2.74Å; M140-P144 WeakPolarHBondContact O-CD 3.35Å |
| 141 | G | 93.6 | Very high | 91.6 | Very high | 4 Ų | 4 | 22.1 Ų | 22.1 | 4% | 0.041 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -75 | -29.2 | 175.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | S112 L137 V138 G139 A143 P144 M145 | S112-G141 VanDerWaalsContact CB-O 3.24Å; S112-G141 WeakPolarHBondContact CB-O 3.33Å; L137-G141 PolarHBondContact O-N 3.34Å; V138-G141 CarbonylContact O-C 3.26Å; V138-G141 PolarHBondContact O-N 3.39Å; V138-G141 VanDerWaalsContact O-N 3.15Å; G139-G141 PolarHBondContact O-N 3.32Å; G141-A143 PolarHBondContact O-N 2.68Å; G141-P144 WeakPolarHBondContact O-CD 3.19Å; G141-M145 WeakPolarHBondContact O-CB 3.47Å; G141-M145 PolarHBondContact O-N 3.39Å; G141-M145 VanDerWaalsContact O-N 3.11Å |
| 142 | A | 91.4 | Very high | 91.3 | Very high | 2 Ų | 2 | 22.1 Ų | 22.1 | 2% | 0.017 | 13% | 0.129 | C | C | . | . | H | α-helix | trans | -60.9 | -48.5 | -173 | 0 | 0 | 0 | 0 | 0 | 112.8 | L88 Y116 V138 G139 M145 W146 | L88-A142 HydrophobicContact CD1-CB 3.71Å; L88-A142 HydrophobicContact CG-CB 4.27Å; Y116-A142 WeakPolarHBondContact OH-CB 3.46Å; V138-A142 WeakPolarHBondContact O-CB 3.29Å; V138-A142 PolarHBondContact O-N 2.67Å; G139-A142 PolarHBondContact O-N 2.96Å; A142-M145 WeakPolarHBondContact O-CB 3.43Å; A142-M145 PolarHBondContact O-N 2.97Å; A142-W146 PolarHBondContact O-N 3.49Å |
| 143 | A | 85.9 | Confident | 90.8 | Very high | 6 Ų | 6 | 20.6 Ų | 20.6 | 5% | 0.05 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -64.7 | -47.5 | -176.4 | 0 | 0 | 0 | 0 | 0 | 113.5 | C92 P96 G141 M145 W146 A147 | C92-A143 HydrophobicContact CB-CB 4.23Å; C92-A143 WeakPolarHBondContact SG-CB 3.26Å; P96-A143 HydrophobicContact CG-CB 4.11Å; G141-A143 PolarHBondContact O-N 2.68Å; A143-M145 VanDerWaalsContact C-N 3.3Å; A143-M145 PolarHBondContact O-N 2.89Å; A143-W146 PolarHBondContact O-N 2.87Å; A143-A147 WeakPolarHBondContact O-CB 3.29Å; A143-A147 PolarHBondContact O-N 3.28Å |
| 144 | P | 88.4 | Confident | 90.1 | Very high | 0 Ų | 0 | 19.4 Ų | 19.4 | 0% | 0 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -61.7 | -34.8 | 174.1 | -23.9 | 34 | 0 | 0 | 0 | 113.3 | S91 L95 P96 I99 T108 M140 G141 S148 | S91-P144 WeakPolarHBondContact OG-CD 3.2Å; L95-P144 HydrophobicContact CB-CG 3.68Å; P96-P144 HydrophobicContact CG-CG 4.49Å; I99-P144 HydrophobicContact CD1-CB 4.42Å; I99-P144 HydrophobicContact CD1-CG 3.91Å; T108-P144 HydrophobicContact CG2-CB 3.74Å; M140-P144 WeakPolarHBondContact O-CD 3.35Å; G141-P144 WeakPolarHBondContact O-CD 3.19Å; P144-S148 WeakPolarHBondContact O-CB 3.25Å; P144-S148 PolarHBondContact O-N 3.32Å; P144-S148 PolarHBondContact O-OG 3.29Å |
| 145 | M | 92.4 | Very high | 89.5 | Confident | 0 Ų | 0 | 20.1 Ų | 20.1 | 0% | 0 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -60.5 | -53.2 | 175.1 | -179.5 | 179.9 | 72.4 | 0 | 0 | 111.3 | F53 F57 L109 M113 Y116 G141 A142 A143 A147 S148 K149 | F53-M145 HydrophobicContact CE1-CE 4.14Å; F53-M145 HydrophobicContact CE1-CG 3.88Å; F53-M145 HydrophobicContact CE1-SD 4.16Å; F53-M145 HydrophobicContact CE2-CG 4.45Å; F53-M145 HydrophobicContact CZ-CG 3.52Å; F53-M145 HydrophobicContact CZ-SD 4.2Å; F57-M145 HydrophobicContact CE2-CE 3.68Å; F57-M145 HydrophobicContact CZ-CE 3.66Å; L109-M145 HydrophobicContact CD2-CG 4.23Å; L109-M145 WeakPolarHBondContact CD2-O 3.43Å; M113-M145 HydrophobicContact CG-CG 4.06Å; M113-M145 HydrophobicContact CG-SD 3.5Å; M113-M145 VanDerWaalsContact CG-SD 3.5Å; Y116-M145 HydrophobicContact CE2-CE 4.06Å; Y116-M145 HydrophobicContact CE2-SD 4.17Å; Y116-M145 WeakPolarHBondContact OH-CE 3.47Å; G141-M145 WeakPolarHBondContact O-CB 3.47Å; G141-M145 PolarHBondContact O-N 3.39Å; G141-M145 VanDerWaalsContact O-N 3.11Å; A142-M145 WeakPolarHBondContact O-CB 3.43Å; A142-M145 PolarHBondContact O-N 2.97Å; A143-M145 VanDerWaalsContact C-N 3.3Å; A143-M145 PolarHBondContact O-N 2.89Å; M145-A147 PolarHBondContact O-N 2.97Å; M145-S148 PolarHBondContact O-N 3.25Å; M145-K149 WeakPolarHBondContact O-CB 3.25Å; M145-K149 PolarHBondContact O-N 3.14Å |
| 146 | W | 86.3 | Confident | 89.1 | Confident | 38 Ų | 38 | 20.1 Ų | 20.1 | 14% | 0.144 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -62.5 | -42.4 | 179.7 | -78.1 | 110.7 | 0 | 0 | 0 | 112.5 | F53 F57 A142 A143 A150 F179 F180 W183 | F53-W146 HydrophobicContact CE1-CE3 4.49Å; F57-W146 HydrophobicContact CE1-CZ2 4.04Å; F57-W146 HydrophobicContact CE2-CH2 4.49Å; F57-W146 AromaticContact CE2-CZ2 3.91Å; F57-W146 HydrophobicContact CE2-CZ2 3.91Å; F57-W146 AromaticContact CZ-CE2 3.87Å; F57-W146 HydrophobicContact CZ-CH2 4.32Å; F57-W146 AromaticContact CZ-CZ2 3.39Å; F57-W146 HydrophobicContact CZ-CZ2 3.39Å; F57-W146 AromaticContact CZ-NE1 3.98Å; A142-W146 PolarHBondContact O-N 3.49Å; A143-W146 PolarHBondContact O-N 2.87Å; W146-A150 WeakPolarHBondContact O-CB 3.49Å; W146-A150 PolarHBondContact O-N 2.74Å; W146-F179 AromaticContact CZ3-CE1 3.89Å; W146-F179 HydrophobicContact CZ3-CE1 3.89Å; W146-F179 HydrophobicContact CZ3-CZ 4.08Å; W146-F180 HydrophobicContact CZ3-CE1 4.05Å; W146-W183 AromaticContact CH2-CD2 3.99Å; W146-W183 HydrophobicContact CH2-CD2 3.99Å; W146-W183 AromaticContact CH2-CE2 3.58Å; W146-W183 HydrophobicContact CH2-CG 4.32Å; W146-W183 AromaticContact CH2-CZ2 3.88Å; W146-W183 HydrophobicContact CH2-CZ2 3.88Å; W146-W183 AromaticContact CH2-NE1 3.69Å; W146-W183 AromaticContact CZ2-CE2 3.97Å; W146-W183 HydrophobicContact CZ2-CZ2 4.02Å; W146-W183 AromaticContact CZ2-NE1 3.91Å |
| 147 | A | 82.8 | Confident | 88.6 | Confident | 29 Ų | 29 | 16.7 Ų | 16.7 | 24% | 0.24 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -63.4 | -49.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 111.7 | P96 I100 A143 M145 K149 A150 T151 | P96-A147 HydrophobicContact CB-CB 3.76Å; P96-A147 HydrophobicContact CG-CB 4.26Å; I100-A147 HydrophobicContact CD1-CB 4.05Å; A143-A147 WeakPolarHBondContact O-CB 3.29Å; A143-A147 PolarHBondContact O-N 3.28Å; M145-A147 PolarHBondContact O-N 2.97Å; A147-K149 VanDerWaalsContact C-N 3.3Å; A147-K149 PolarHBondContact O-N 3.44Å; A147-A150 PolarHBondContact O-N 3.15Å; A147-A150 VanDerWaalsContact O-N 3.09Å; A147-T151 PolarHBondContact O-N 3.46Å; A147-T151 PolarHBondContact O-OG1 2.99Å |
| 148 | S | 86.8 | Confident | 87.9 | Confident | 0 Ų | 0 | 16.2 Ų | 16.2 | 0% | 0 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -58 | -44 | 179.1 | -64.1 | 0 | 0 | 0 | 0 | 111.7 | I100 V105 T108 P144 M145 T151 Y152 | I100-S148 WeakPolarHBondContact CG1-OG 3.46Å; V105-S148 WeakPolarHBondContact CG1-O 3.36Å; T108-S148 WeakPolarHBondContact CB-OG 3.45Å; T108-S148 WeakPolarHBondContact CG2-OG 3.5Å; P144-S148 WeakPolarHBondContact O-CB 3.25Å; P144-S148 PolarHBondContact O-N 3.32Å; P144-S148 PolarHBondContact O-OG 3.29Å; M145-S148 PolarHBondContact O-N 3.25Å; S148-T151 PolarHBondContact O-N 2.76Å; S148-Y152 WeakPolarHBondContact O-CB 3.1Å; S148-Y152 PolarHBondContact O-N 3.4Å |
| 149 | K | 90.3 | Very high | 87.5 | Confident | 5 Ų | 5 | 17.5 Ų | 17.5 | 2% | 0.022 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -59.8 | -47.8 | 175 | -176.1 | -121.5 | 55.9 | 168.2 | 0 | 111.6 | I49 F53 L109 M145 A147 T151 Y152 L153 F179 | I49-K149 HydrophobicContact CG2-CG 3.79Å; F53-K149 HydrophobicContact CE1-CB 4.29Å; F53-K149 HydrophobicContact CE1-CD 4.32Å; F53-K149 HydrophobicContact CE1-CG 4.25Å; F53-K149 HydrophobicContact CE2-CB 4.07Å; F53-K149 HydrophobicContact CE2-CG 3.94Å; F53-K149 HydrophobicContact CZ-CB 3.59Å; F53-K149 HydrophobicContact CZ-CD 4.32Å; F53-K149 HydrophobicContact CZ-CG 3.75Å; L109-K149 HydrophobicContact CD2-CB 4.15Å; M145-K149 WeakPolarHBondContact O-CB 3.25Å; M145-K149 PolarHBondContact O-N 3.14Å; A147-K149 VanDerWaalsContact C-N 3.3Å; A147-K149 PolarHBondContact O-N 3.44Å; K149-T151 PolarHBondContact O-N 3.04Å; K149-Y152 PolarHBondContact O-N 2.88Å; K149-L153 HydrophobicContact CD-CD1 4.21Å; K149-L153 HydrophobicContact CG-CD1 3.79Å; K149-L153 WeakPolarHBondContact O-CD1 3.08Å; K149-L153 PolarHBondContact O-N 3.41Å; K149-F179 HydrophobicContact CD-CD1 3.84Å; K149-F179 HydrophobicContact CD-CD2 3.76Å; K149-F179 HydrophobicContact CD-CE1 3.43Å; K149-F179 VanDerWaalsContact CD-CE1 3.43Å; K149-F179 HydrophobicContact CD-CE2 3.29Å; K149-F179 HydrophobicContact CD-CG 4.02Å; K149-F179 HydrophobicContact CD-CZ 3.14Å; K149-F179 HydrophobicContact CG-CD2 4.27Å; K149-F179 HydrophobicContact CG-CE2 3.8Å; K149-F179 HydrophobicContact CG-CZ 4.07Å; K149-F179 VanDerWaalsContact NZ-CE1 3.33Å |
| 150 | A | 82.9 | Confident | 87.2 | Confident | 31 Ų | 31 | 18.7 Ų | 18.7 | 26% | 0.256 | 11% | 0.105 | S | C | . | . | H | α-helix | trans | -61.8 | -44.2 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.2 | W146 A147 Y152 T154 F176 | W146-A150 WeakPolarHBondContact O-CB 3.49Å; W146-A150 PolarHBondContact O-N 2.74Å; A147-A150 PolarHBondContact O-N 3.15Å; A147-A150 VanDerWaalsContact O-N 3.09Å; A150-Y152 VanDerWaalsContact C-N 3.35Å; A150-Y152 PolarHBondContact O-N 3.49Å; A150-T154 VanDerWaalsContact O-CB 3.29Å; A150-T154 WeakPolarHBondContact O-CB 3.5Å; A150-T154 PolarHBondContact O-N 2.7Å; A150-T154 PolarHBondContact O-OG1 3.44Å; A150-F176 HydrophobicContact CB-CE1 4.13Å; A150-F176 HydrophobicContact CB-CZ 3.91Å |
| 151 | T | 82.6 | Confident | 86.8 | Confident | 22 Ų | 22 | 14.7 Ų | 14.7 | 14% | 0.135 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -60.5 | -44.3 | 174.6 | -58.3 | 0 | 0 | 0 | 0 | 111.1 | V105 A147 S148 K149 T154 Q155 | V105-T151 HydrophobicContact CG2-CG2 4.06Å; A147-T151 PolarHBondContact O-N 3.46Å; A147-T151 PolarHBondContact O-OG1 2.99Å; S148-T151 PolarHBondContact O-N 2.76Å; K149-T151 PolarHBondContact O-N 3.04Å; T151-T154 PolarHBondContact O-N 3.4Å; T151-Q155 HydrophobicContact CG2-CG 4.37Å; T151-Q155 WeakPolarHBondContact O-CB 2.93Å; T151-Q155 WeakPolarHBondContact O-CG 3.4Å; T151-Q155 PolarHBondContact O-N 3.43Å |
| 152 | Y | 88.1 | Confident | 86.3 | Confident | 0 Ų | 0 | 20 Ų | 20 | 0% | 0 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -59.5 | -55.7 | 178.8 | -162.6 | -71.8 | 0 | 0 | 0 | 111.9 | N45 I49 V105 S148 K149 A150 T154 Q155 V156 L266 D267 L269 | N45-Y152 HydrophobicContact CB-CE1 3.98Å; N45-Y152 WeakPolarHBondContact CB-OH 3.26Å; N45-Y152 PolarHBondContact ND2-OH 3.31Å; I49-Y152 HydrophobicContact CD1-CD1 3.19Å; I49-Y152 HydrophobicContact CD1-CD2 3.94Å; I49-Y152 HydrophobicContact CD1-CE1 3.59Å; I49-Y152 HydrophobicContact CD1-CE2 4.29Å; I49-Y152 HydrophobicContact CD1-CG 3.41Å; I49-Y152 VanDerWaalsContact CD1-CG 3.41Å; V105-Y152 HydrophobicContact CG1-CD2 4.02Å; S148-Y152 WeakPolarHBondContact O-CB 3.1Å; S148-Y152 PolarHBondContact O-N 3.4Å; K149-Y152 PolarHBondContact O-N 2.88Å; A150-Y152 VanDerWaalsContact C-N 3.35Å; A150-Y152 PolarHBondContact O-N 3.49Å; Y152-T154 VanDerWaalsContact C-N 3.26Å; Y152-T154 PolarHBondContact O-N 3.27Å; Y152-Q155 PolarHBondContact O-N 2.73Å; Y152-V156 HydrophobicContact CD1-CG1 3.87Å; Y152-V156 HydrophobicContact CD1-CG2 4.2Å; Y152-V156 HydrophobicContact CE1-CG1 3.53Å; Y152-V156 HydrophobicContact CE1-CG2 4.28Å; Y152-V156 WeakPolarHBondContact O-CG2 3.17Å; Y152-V156 PolarHBondContact O-N 2.95Å; Y152-L266 HydrophobicContact CD2-CD2 4.15Å; Y152-L266 HydrophobicContact CE1-CD1 4.05Å; Y152-L266 HydrophobicContact CE2-CD1 3.94Å; Y152-L266 HydrophobicContact CE2-CD2 3.75Å; Y152-L266 HydrophobicContact CE2-CG 3.86Å; Y152-L266 WeakPolarHBondContact OH-CD1 3.48Å; Y152-D267 WeakPolarHBondContact CE2-O 3.44Å; Y152-D267 PolarHBondContact OH-O 3.03Å; Y152-L269 HydrophobicContact CD1-CD2 4.19Å; Y152-L269 HydrophobicContact CD2-CD1 3.54Å; Y152-L269 HydrophobicContact CD2-CD2 3.65Å; Y152-L269 HydrophobicContact CD2-CG 3.42Å; Y152-L269 VanDerWaalsContact CD2-CG 3.42Å; Y152-L269 HydrophobicContact CE1-CD2 4.14Å; Y152-L269 HydrophobicContact CE2-CD1 4.19Å; Y152-L269 HydrophobicContact CE2-CD2 3.59Å; Y152-L269 HydrophobicContact CE2-CG 3.52Å; Y152-L269 HydrophobicContact CG-CD1 3.95Å; Y152-L269 HydrophobicContact CG-CD2 3.94Å; Y152-L269 HydrophobicContact CG-CG 4.1Å |
| 153 | L | 86.3 | Confident | 86.1 | Confident | 0 Ų | 0 | 22.4 Ų | 22.4 | 0% | 0 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -60.1 | -38.3 | -178.7 | -86.6 | 80.5 | 0 | 0 | 0 | 111.9 | I49 K149 G157 F175 F176 F179 | I49-L153 HydrophobicContact CD1-CD1 4.34Å; I49-L153 HydrophobicContact CG2-CD1 4.09Å; K149-L153 HydrophobicContact CD-CD1 4.21Å; K149-L153 HydrophobicContact CG-CD1 3.79Å; K149-L153 WeakPolarHBondContact O-CD1 3.08Å; K149-L153 PolarHBondContact O-N 3.41Å; L153-G157 WeakPolarHBondContact O-CA 3.11Å; L153-G157 PolarHBondContact O-N 3.3Å; L153-F175 HydrophobicContact CD2-CB 4.31Å; L153-F176 HydrophobicContact CB-CD2 4Å; L153-F176 HydrophobicContact CB-CE2 3.62Å; L153-F176 HydrophobicContact CB-CZ 4.15Å; L153-F176 HydrophobicContact CD2-CD2 4.01Å; L153-F176 HydrophobicContact CD2-CE2 4.35Å; L153-F176 HydrophobicContact CD2-CG 4.13Å; L153-F179 HydrophobicContact CD2-CB 3.72Å; L153-F179 HydrophobicContact CD2-CG 4.18Å |
| 154 | T | 82.5 | Confident | 86.2 | Confident | 42 Ų | 42 | 23.5 Ų | 23.5 | 26% | 0.258 | 13% | 0.125 | S | C | . | . | H | α-helix | trans | -65.7 | -49.7 | 178.9 | -59.6 | 0 | 0 | 0 | 0 | 111.2 | A150 T151 Y152 G157 Q158 I172 | A150-T154 VanDerWaalsContact O-CB 3.29Å; A150-T154 WeakPolarHBondContact O-CB 3.5Å; A150-T154 PolarHBondContact O-N 2.7Å; A150-T154 PolarHBondContact O-OG1 3.44Å; T151-T154 PolarHBondContact O-N 3.4Å; Y152-T154 VanDerWaalsContact C-N 3.26Å; Y152-T154 PolarHBondContact O-N 3.27Å; T154-G157 PolarHBondContact O-N 3.42Å; T154-Q158 WeakPolarHBondContact O-CG 3.21Å; T154-Q158 PolarHBondContact O-N 3.27Å; T154-I172 HydrophobicContact CG2-CD1 4.07Å |
| 155 | Q | 83.6 | Confident | 86.1 | Confident | 19 Ų | 19 | 32.3 Ų | 32.3 | 9% | 0.089 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -65.3 | -46.6 | -178.1 | -73.4 | -176.1 | 6.1 | 0 | 0 | 112 | T151 Y152 G157 Q158 V159 L269 S281 | T151-Q155 HydrophobicContact CG2-CG 4.37Å; T151-Q155 WeakPolarHBondContact O-CB 2.93Å; T151-Q155 WeakPolarHBondContact O-CG 3.4Å; T151-Q155 PolarHBondContact O-N 3.43Å; Y152-Q155 PolarHBondContact O-N 2.73Å; Q155-G157 VanDerWaalsContact C-N 3.28Å; Q155-G157 PolarHBondContact O-N 3.39Å; Q155-Q158 PolarHBondContact O-N 2.88Å; Q155-V159 WeakPolarHBondContact O-CG2 3.06Å; Q155-V159 PolarHBondContact O-N 3.38Å; Q155-L269 HydrophobicContact CB-CD2 4.43Å; Q155-S281 PolarHBondContact NE2-OG 2.68Å; Q155-S281 VanDerWaalsContact NE2-OG 3.12Å |
| 156 | V | 88.6 | Confident | 85.8 | Confident | 0 Ų | 0 | 36.5 Ų | 36.5 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -68.6 | -30.9 | 176.9 | -55.5 | 0 | 0 | 0 | 0 | 111.9 | I42 I46 Y152 V159 Y160 L269 Y272 | I42-V156 HydrophobicContact CG1-CB 4.43Å; I42-V156 HydrophobicContact CG2-CB 3.84Å; I42-V156 HydrophobicContact CG2-CG2 4.01Å; I46-V156 HydrophobicContact CD1-CG2 4.13Å; I46-V156 HydrophobicContact CG1-CG2 4Å; Y152-V156 HydrophobicContact CD1-CG1 3.87Å; Y152-V156 HydrophobicContact CD1-CG2 4.2Å; Y152-V156 HydrophobicContact CE1-CG1 3.53Å; Y152-V156 HydrophobicContact CE1-CG2 4.28Å; Y152-V156 WeakPolarHBondContact O-CG2 3.17Å; Y152-V156 PolarHBondContact O-N 2.95Å; V156-V159 PolarHBondContact O-N 3.38Å; V156-Y160 VanDerWaalsContact O-CB 3.27Å; V156-Y160 WeakPolarHBondContact O-CB 3.37Å; V156-Y160 PolarHBondContact O-N 2.91Å; V156-L269 HydrophobicContact CG1-CD2 3.64Å; V156-Y272 HydrophobicContact CG1-CD2 4.1Å; V156-Y272 HydrophobicContact CG1-CE2 3.85Å |
| 157 | G | 86.3 | Confident | 85.6 | Confident | 0 Ų | 0 | 37.9 Ų | 37.9 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -61.4 | -44.3 | 171.8 | 0 | 0 | 0 | 0 | 0 | 113 | L153 T154 Q155 V159 Y160 A161 | L153-G157 WeakPolarHBondContact O-CA 3.11Å; L153-G157 PolarHBondContact O-N 3.3Å; T154-G157 PolarHBondContact O-N 3.42Å; Q155-G157 VanDerWaalsContact C-N 3.28Å; Q155-G157 PolarHBondContact O-N 3.39Å; G157-V159 PolarHBondContact O-N 3.45Å; G157-Y160 PolarHBondContact O-N 2.93Å; G157-A161 VanDerWaalsContact O-CB 3.25Å; G157-A161 WeakPolarHBondContact O-CB 3.49Å; G157-A161 PolarHBondContact O-N 3.17Å |
| 158 | Q | 83.6 | Confident | 85.3 | Confident | 58 Ų | 58 | 38.9 Ų | 38.9 | 27% | 0.271 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -61.9 | -42.6 | 175.3 | -72.6 | 172.7 | -10.4 | 0 | 0 | 112.1 | T154 Q155 K162 V168 I172 | T154-Q158 WeakPolarHBondContact O-CG 3.21Å; T154-Q158 PolarHBondContact O-N 3.27Å; Q155-Q158 PolarHBondContact O-N 2.88Å; Q158-K162 WeakPolarHBondContact O-CG 3.04Å; Q158-K162 PolarHBondContact O-N 2.84Å; Q158-V168 HydrophobicContact CB-CG1 4.45Å; Q158-V168 HydrophobicContact CG-CG1 3.71Å; Q158-I172 HydrophobicContact CG-CD1 4.3Å |
| 159 | V | 86.8 | Confident | 84.7 | Confident | 26 Ų | 26 | 44.5 Ų | 44.5 | 16% | 0.158 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -67.1 | -45.9 | 177.3 | 178 | 0 | 0 | 0 | 0 | 110.6 | L34 I42 Q155 V156 G157 A161 K162 I163 Y272 | L34-V159 HydrophobicContact CD2-CG1 3.96Å; I42-V159 HydrophobicContact CD1-CB 4.23Å; I42-V159 HydrophobicContact CD1-CG1 3.93Å; Q155-V159 WeakPolarHBondContact O-CG2 3.06Å; Q155-V159 PolarHBondContact O-N 3.38Å; V156-V159 PolarHBondContact O-N 3.38Å; G157-V159 PolarHBondContact O-N 3.45Å; V159-A161 PolarHBondContact O-N 3.05Å; V159-K162 PolarHBondContact O-N 3.03Å; V159-I163 HydrophobicContact CG1-CD1 3.96Å; V159-I163 WeakPolarHBondContact O-CG1 3.49Å; V159-I163 PolarHBondContact O-N 3Å; V159-Y272 HydrophobicContact CB-CD1 4.48Å; V159-Y272 HydrophobicContact CG1-CD1 4.16Å; V159-Y272 HydrophobicContact CG1-CE1 4.1Å; V159-Y272 HydrophobicContact CG2-CD1 3.92Å; V159-Y272 HydrophobicContact CG2-CG 4.26Å |
| 160 | Y | 88.2 | Confident | 83.9 | Confident | 26 Ų | 26 | 46.7 Ų | 46.7 | 10% | 0.102 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -61.8 | -43.3 | 179 | -174.2 | -84 | 0 | 0 | 0 | 112.8 | K39 I42 L43 V156 G157 K162 I163 T164 I171 F175 | K39-Y160 HydrophobicContact CB-CE2 4.45Å; K39-Y160 HydrophobicContact CD-CE2 4.34Å; K39-Y160 WeakPolarHBondContact CE-OH 3.38Å; K39-Y160 HydrophobicContact CG-CD2 4.15Å; K39-Y160 HydrophobicContact CG-CE2 3.4Å; I42-Y160 HydrophobicContact CB-CD2 4.24Å; I42-Y160 HydrophobicContact CD1-CD2 4.43Å; I42-Y160 HydrophobicContact CG2-CD2 3.95Å; I42-Y160 HydrophobicContact CG2-CG 4.45Å; L43-Y160 HydrophobicContact CD1-CE2 4.21Å; L43-Y160 HydrophobicContact CD2-CE2 3.86Å; L43-Y160 HydrophobicContact CG-CE2 3.88Å; V156-Y160 VanDerWaalsContact O-CB 3.27Å; V156-Y160 WeakPolarHBondContact O-CB 3.37Å; V156-Y160 PolarHBondContact O-N 2.91Å; G157-Y160 PolarHBondContact O-N 2.93Å; Y160-K162 VanDerWaalsContact C-N 3.27Å; Y160-K162 PolarHBondContact O-N 3.42Å; Y160-I163 PolarHBondContact O-N 3.35Å; Y160-T164 HydrophobicContact CD1-CG2 4.04Å; Y160-T164 HydrophobicContact CE1-CG2 3.61Å; Y160-T164 HydrophobicContact CE2-CG2 4.36Å; Y160-T164 WeakPolarHBondContact O-CB 3.34Å; Y160-T164 PolarHBondContact O-N 3.29Å; Y160-T164 PolarHBondContact O-OG1 3.39Å; Y160-I171 HydrophobicContact CD1-CD1 3.98Å; Y160-I171 HydrophobicContact CD1-CG1 4.2Å; Y160-I171 HydrophobicContact CD1-CG2 3.71Å; Y160-I171 HydrophobicContact CE1-CD1 3.93Å; Y160-I171 HydrophobicContact CG-CG2 4.34Å; Y160-F175 HydrophobicContact CD1-CE2 4.42Å; Y160-F175 AromaticContact CD1-CZ 3.73Å; Y160-F175 HydrophobicContact CD1-CZ 3.73Å; Y160-F175 AromaticContact CD2-CZ 3.85Å; Y160-F175 HydrophobicContact CD2-CZ 3.85Å; Y160-F175 HydrophobicContact CE1-CZ 4.15Å; Y160-F175 HydrophobicContact CE2-CZ 4.23Å; Y160-F175 HydrophobicContact CG-CE2 4.07Å; Y160-F175 AromaticContact CG-CZ 3.57Å; Y160-F175 HydrophobicContact CG-CZ 3.57Å |
| 161 | A | 85.4 | Confident | 84 | Confident | 1 Ų | 1 | 45.3 Ų | 45.3 | 1% | 0.008 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -60 | -39.4 | 177.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | G157 V159 T164 E165 Q166 V168 I171 | G157-A161 VanDerWaalsContact O-CB 3.25Å; G157-A161 WeakPolarHBondContact O-CB 3.49Å; G157-A161 PolarHBondContact O-N 3.17Å; V159-A161 PolarHBondContact O-N 3.05Å; A161-T164 PolarHBondContact O-N 2.87Å; A161-E165 WeakPolarHBondContact O-CA 3.38Å; A161-E165 PolarHBondContact O-N 3.32Å; A161-Q166 PolarHBondContact O-N 2.96Å; A161-V168 HydrophobicContact CB-CB 4.23Å; A161-V168 HydrophobicContact CB-CG2 3.83Å; A161-I171 HydrophobicContact CB-CB 4.08Å; A161-I171 HydrophobicContact CB-CG1 3.81Å; A161-I171 HydrophobicContact CB-CG2 4.47Å |
| 162 | K | 84.1 | Confident | 83.7 | Confident | 115 Ų | 115 | 45.6 Ų | 45.6 | 50% | 0.5 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -65.8 | -44.1 | 174.1 | -70.7 | 174.7 | -178.6 | -177.5 | 0 | 112.3 | Q158 V159 Y160 T164 | Q158-K162 WeakPolarHBondContact O-CG 3.04Å; Q158-K162 PolarHBondContact O-N 2.84Å; V159-K162 PolarHBondContact O-N 3.03Å; Y160-K162 VanDerWaalsContact C-N 3.27Å; Y160-K162 PolarHBondContact O-N 3.42Å; K162-T164 VanDerWaalsContact C-N 3.29Å; K162-T164 PolarHBondContact O-N 3.18Å |
| 163 | I | 87.2 | Confident | 83.2 | Confident | 52 Ų | 52 | 50.6 Ų | 50.6 | 27% | 0.267 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -63.6 | -36 | 178.1 | -63 | 163.2 | 0 | 0 | 0 | 111.6 | L34 E38 I42 V159 Y160 | L34-I163 HydrophobicContact CB-CG1 4.49Å; L34-I163 HydrophobicContact CD1-CG1 4.09Å; L34-I163 HydrophobicContact CD2-CD1 3.86Å; L34-I163 HydrophobicContact CD2-CG1 3.83Å; L34-I163 HydrophobicContact CG-CG1 4.35Å; E38-I163 HydrophobicContact CB-CD1 4.14Å; E38-I163 HydrophobicContact CG-CD1 4.11Å; I42-I163 HydrophobicContact CD1-CD1 4.02Å; V159-I163 HydrophobicContact CG1-CD1 3.96Å; V159-I163 WeakPolarHBondContact O-CG1 3.49Å; V159-I163 PolarHBondContact O-N 3Å; Y160-I163 PolarHBondContact O-N 3.35Å |
| 164 | T | 87 | Confident | 83 | Confident | 30 Ų | 30 | 58.8 Ų | 58.8 | 18% | 0.184 | 31% | 0.307 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -98.8 | 3.9 | -173.8 | 56.1 | 0 | 0 | 0 | 0 | 114.1 | K39 Y160 A161 K162 Q166 | K39-T164 HydrophobicContact CD-CG2 4.41Å; Y160-T164 HydrophobicContact CD1-CG2 4.04Å; Y160-T164 HydrophobicContact CE1-CG2 3.61Å; Y160-T164 HydrophobicContact CE2-CG2 4.36Å; Y160-T164 WeakPolarHBondContact O-CB 3.34Å; Y160-T164 PolarHBondContact O-N 3.29Å; Y160-T164 PolarHBondContact O-OG1 3.39Å; A161-T164 PolarHBondContact O-N 2.87Å; K162-T164 VanDerWaalsContact C-N 3.29Å; K162-T164 PolarHBondContact O-N 3.18Å; T164-Q166 PolarHBondContact O-N 3.2Å |
| 165 | E | 86.3 | Confident | 83.3 | Confident | 185 Ų | 185 | 57.5 Ų | 57.5 | 86% | 0.864 | 30% | 0.298 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 51.2 | 39.1 | -177.4 | -59.3 | -176.7 | -175.6 | 0 | 0 | 113.4 | A161 | A161-E165 WeakPolarHBondContact O-CA 3.38Å; A161-E165 PolarHBondContact O-N 3.32Å |
| 166 | Q | 85.4 | Confident | 83.3 | Confident | 87 Ų | 87 | 58.5 Ų | 58.5 | 41% | 0.407 | 30% | 0.303 | S | S | . | . | trans | -109.2 | 159.6 | 178 | -73 | 179 | 48 | 0 | 0 | 111.5 | A161 T164 V168 I171 | A161-Q166 PolarHBondContact O-N 2.96Å; T164-Q166 PolarHBondContact O-N 3.2Å; Q166-V168 PolarHBondContact O-N 2.87Å; Q166-I171 HydrophobicContact CB-CD1 4.03Å; Q166-I171 HydrophobicContact CB-CG1 3.98Å; Q166-I171 VanDerWaalsContact OE1-CD1 3.3Å | ||
| 167 | A | 82.6 | Confident | 82.9 | Confident | 67 Ų | 67 | 60.4 Ų | 60.4 | 55% | 0.554 | 32% | 0.322 | S | S | * | . | trans | -61 | 124.8 | 174.9 | 0 | 0 | 0 | 0 | 0 | 110.9 | D169 A170 I171 | A167-D169 VanDerWaalsContact C-N 3.32Å; A167-D169 PolarHBondContact O-N 3.5Å; A167-A170 HydrophobicContact CB-CB 4.19Å; A167-A170 WeakPolarHBondContact O-CB 3.45Å; A167-A170 PolarHBondContact O-N 2.97Å; A167-I171 PolarHBondContact O-N 3.05Å | ||
| 168 | V | 77.6 | Confident | 82.9 | Confident | 51 Ų | 51 | 65 Ų | 65 | 31% | 0.309 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -52.4 | -49 | -178.2 | 174 | 0 | 0 | 0 | 0 | 111.8 | Q158 A161 Q166 A170 I171 I172 | Q158-V168 HydrophobicContact CB-CG1 4.45Å; Q158-V168 HydrophobicContact CG-CG1 3.71Å; A161-V168 HydrophobicContact CB-CB 4.23Å; A161-V168 HydrophobicContact CB-CG2 3.83Å; Q166-V168 PolarHBondContact O-N 2.87Å; V168-A170 VanDerWaalsContact C-N 3.28Å; V168-A170 PolarHBondContact O-N 3.31Å; V168-I171 PolarHBondContact O-N 3.04Å; V168-I172 HydrophobicContact CG1-CD1 3.6Å; V168-I172 HydrophobicContact CG1-CG1 4.36Å; V168-I172 WeakPolarHBondContact O-CG1 3.41Å; V168-I172 PolarHBondContact O-N 2.88Å |
| 169 | D | 72.7 | Confident | 83.2 | Confident | 118 Ų | 118 | 62.2 Ų | 62.2 | 63% | 0.631 | 33% | 0.329 | S | S | * | . | H | α-helix | trans | -60.2 | -37.3 | -179.2 | -69.8 | -11.4 | 0 | 0 | 0 | 112.2 | A167 V173 | A167-D169 VanDerWaalsContact C-N 3.32Å; A167-D169 PolarHBondContact O-N 3.5Å; D169-V173 WeakPolarHBondContact O-CB 3.12Å; D169-V173 WeakPolarHBondContact O-CG2 3.33Å; D169-V173 PolarHBondContact O-N 3.47Å |
| 170 | A | 74.6 | Confident | 83.1 | Confident | 50 Ų | 50 | 65 Ų | 65 | 41% | 0.413 | 34% | 0.339 | S | S | . | . | H | α-helix | trans | -69.8 | -38.7 | -179.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | A167 V168 R174 | A167-A170 HydrophobicContact CB-CB 4.19Å; A167-A170 WeakPolarHBondContact O-CB 3.45Å; A167-A170 PolarHBondContact O-N 2.97Å; V168-A170 VanDerWaalsContact C-N 3.28Å; V168-A170 PolarHBondContact O-N 3.31Å; A170-R174 PolarHBondContact O-N 3.44Å |
| 171 | I | 83.8 | Confident | 82.9 | Confident | 3 Ų | 3 | 68.8 Ų | 68.8 | 2% | 0.015 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -68 | -46.3 | 176.7 | -66.2 | -56.5 | 0 | 0 | 0 | 111.1 | Y160 A161 Q166 A167 V168 V173 R174 F175 | Y160-I171 HydrophobicContact CD1-CD1 3.98Å; Y160-I171 HydrophobicContact CD1-CG1 4.2Å; Y160-I171 HydrophobicContact CD1-CG2 3.71Å; Y160-I171 HydrophobicContact CE1-CD1 3.93Å; Y160-I171 HydrophobicContact CG-CG2 4.34Å; A161-I171 HydrophobicContact CB-CB 4.08Å; A161-I171 HydrophobicContact CB-CG1 3.81Å; A161-I171 HydrophobicContact CB-CG2 4.47Å; Q166-I171 HydrophobicContact CB-CD1 4.03Å; Q166-I171 HydrophobicContact CB-CG1 3.98Å; Q166-I171 VanDerWaalsContact OE1-CD1 3.3Å; A167-I171 PolarHBondContact O-N 3.05Å; V168-I171 PolarHBondContact O-N 3.04Å; I171-V173 VanDerWaalsContact C-N 3.31Å; I171-V173 PolarHBondContact O-N 3.12Å; I171-R174 WeakPolarHBondContact O-CB 3.3Å; I171-R174 PolarHBondContact O-N 3.17Å; I171-R174 VanDerWaalsContact O-N 3.15Å; I171-F175 HydrophobicContact CG2-CD1 4.41Å; I171-F175 HydrophobicContact CG2-CD2 3.9Å; I171-F175 HydrophobicContact CG2-CE1 4.09Å; I171-F175 HydrophobicContact CG2-CE2 3.54Å; I171-F175 HydrophobicContact CG2-CG 4.34Å; I171-F175 HydrophobicContact CG2-CZ 3.66Å; I171-F175 WeakPolarHBondContact O-CG 3.07Å; I171-F175 PolarHBondContact O-N 2.9Å |
| 172 | I | 77.1 | Confident | 83.1 | Confident | 28 Ų | 28 | 69.3 Ų | 69.3 | 14% | 0.144 | 37% | 0.365 | C | S | . | . | H | α-helix | trans | -57.8 | -47.9 | 177.6 | -67.4 | 168.5 | 0 | 0 | 0 | 109.6 | T154 Q158 V168 R174 F175 F176 | T154-I172 HydrophobicContact CG2-CD1 4.07Å; Q158-I172 HydrophobicContact CG-CD1 4.3Å; V168-I172 HydrophobicContact CG1-CD1 3.6Å; V168-I172 HydrophobicContact CG1-CG1 4.36Å; V168-I172 WeakPolarHBondContact O-CG1 3.41Å; V168-I172 PolarHBondContact O-N 2.88Å; I172-R174 VanDerWaalsContact C-N 3.32Å; I172-R174 PolarHBondContact O-N 2.98Å; I172-F175 PolarHBondContact O-N 3.28Å; I172-F176 HydrophobicContact CG2-CD2 3.7Å; I172-F176 HydrophobicContact CG2-CE2 3.73Å; I172-F176 WeakPolarHBondContact O-CD2 3.42Å; I172-F176 PolarHBondContact O-N 3.4Å |
| 173 | V | 77 | Confident | 83.3 | Confident | 105 Ų | 105 | 65.9 Ų | 65.9 | 64% | 0.636 | 35% | 0.349 | S | S | * | . | H | α-helix | trans | -58.4 | -43.1 | 177.2 | 169.6 | 0 | 0 | 0 | 0 | 111.7 | D169 I171 G177 | D169-V173 WeakPolarHBondContact O-CB 3.12Å; D169-V173 WeakPolarHBondContact O-CG2 3.33Å; D169-V173 PolarHBondContact O-N 3.47Å; I171-V173 VanDerWaalsContact C-N 3.31Å; I171-V173 PolarHBondContact O-N 3.12Å; V173-G177 PolarHBondContact O-N 3.11Å |
| 174 | R | 83.3 | Confident | 83.1 | Confident | 171 Ų | 171 | 64.9 Ų | 64.9 | 65% | 0.645 | 34% | 0.343 | S | S | * | . | H | α-helix | trans | -61.7 | -44.6 | 175.6 | -91.9 | -179.3 | 172.2 | 160 | -3.6 | 112.8 | A170 I171 I172 G177 F178 | A170-R174 PolarHBondContact O-N 3.44Å; I171-R174 WeakPolarHBondContact O-CB 3.3Å; I171-R174 PolarHBondContact O-N 3.17Å; I171-R174 VanDerWaalsContact O-N 3.15Å; I172-R174 VanDerWaalsContact C-N 3.32Å; I172-R174 PolarHBondContact O-N 2.98Å; R174-G177 PolarHBondContact O-N 3.41Å; R174-F178 PolarHBondContact O-N 2.84Å |
| 175 | F | 87.7 | Confident | 83.2 | Confident | 15 Ų | 15 | 65.1 Ų | 65.1 | 7% | 0.066 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -66.7 | -42.5 | -179.3 | -70 | -7.6 | 0 | 0 | 0 | 112 | I42 L43 I46 L153 Y160 I171 I172 G177 F178 F179 | I42-F175 HydrophobicContact CG2-CE2 4.06Å; I42-F175 HydrophobicContact CG2-CZ 4.27Å; L43-F175 HydrophobicContact CD2-CE1 4.05Å; L43-F175 HydrophobicContact CD2-CZ 4.27Å; I46-F175 HydrophobicContact CD1-CB 4.42Å; I46-F175 HydrophobicContact CD1-CD1 3.75Å; I46-F175 HydrophobicContact CD1-CD2 3.3Å; I46-F175 HydrophobicContact CD1-CE1 3.65Å; I46-F175 HydrophobicContact CD1-CE2 3.18Å; I46-F175 HydrophobicContact CD1-CG 3.58Å; I46-F175 HydrophobicContact CD1-CZ 3.36Å; I46-F175 HydrophobicContact CG1-CD2 4.27Å; I46-F175 HydrophobicContact CG1-CE2 4.46Å; I46-F175 HydrophobicContact CG1-CG 4.47Å; L153-F175 HydrophobicContact CD2-CB 4.31Å; Y160-F175 HydrophobicContact CD1-CE2 4.42Å; Y160-F175 AromaticContact CD1-CZ 3.73Å; Y160-F175 HydrophobicContact CD1-CZ 3.73Å; Y160-F175 AromaticContact CD2-CZ 3.85Å; Y160-F175 HydrophobicContact CD2-CZ 3.85Å; Y160-F175 HydrophobicContact CE1-CZ 4.15Å; Y160-F175 HydrophobicContact CE2-CZ 4.23Å; Y160-F175 HydrophobicContact CG-CE2 4.07Å; Y160-F175 AromaticContact CG-CZ 3.57Å; Y160-F175 HydrophobicContact CG-CZ 3.57Å; I171-F175 HydrophobicContact CG2-CD1 4.41Å; I171-F175 HydrophobicContact CG2-CD2 3.9Å; I171-F175 HydrophobicContact CG2-CE1 4.09Å; I171-F175 HydrophobicContact CG2-CE2 3.54Å; I171-F175 HydrophobicContact CG2-CG 4.34Å; I171-F175 HydrophobicContact CG2-CZ 3.66Å; I171-F175 WeakPolarHBondContact O-CG 3.07Å; I171-F175 PolarHBondContact O-N 2.9Å; I172-F175 PolarHBondContact O-N 3.28Å; F175-G177 VanDerWaalsContact C-N 3.33Å; F175-F178 PolarHBondContact O-N 3.19Å; F175-F179 WeakPolarHBondContact O-CB 3.34Å; F175-F179 PolarHBondContact O-N 3.39Å |
| 176 | F | 83.9 | Confident | 83.4 | Confident | 41 Ų | 41 | 56.3 Ų | 56.3 | 18% | 0.18 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -64.3 | -39.2 | 172.5 | -86.8 | -100.2 | 0 | 0 | 0 | 111.8 | A150 L153 I172 F179 F180 | A150-F176 HydrophobicContact CB-CE1 4.13Å; A150-F176 HydrophobicContact CB-CZ 3.91Å; L153-F176 HydrophobicContact CB-CD2 4Å; L153-F176 HydrophobicContact CB-CE2 3.62Å; L153-F176 HydrophobicContact CB-CZ 4.15Å; L153-F176 HydrophobicContact CD2-CD2 4.01Å; L153-F176 HydrophobicContact CD2-CE2 4.35Å; L153-F176 HydrophobicContact CD2-CG 4.13Å; I172-F176 HydrophobicContact CG2-CD2 3.7Å; I172-F176 HydrophobicContact CG2-CE2 3.73Å; I172-F176 WeakPolarHBondContact O-CD2 3.42Å; I172-F176 PolarHBondContact O-N 3.4Å; F176-F179 PolarHBondContact O-N 3.47Å; F176-F180 HydrophobicContact CB-CD2 4.35Å; F176-F180 HydrophobicContact CB-CE2 4.42Å; F176-F180 HydrophobicContact CD1-CD2 4.47Å; F176-F180 AromaticContact CD1-CE2 3.81Å; F176-F180 HydrophobicContact CD1-CE2 3.81Å; F176-F180 WeakPolarHBondContact O-CB 3.2Å; F176-F180 WeakPolarHBondContact O-CD2 3.48Å; F176-F180 PolarHBondContact O-N 3.33Å |
| 177 | G | 80.7 | Confident | 83.6 | Confident | 40 Ų | 40 | 52.8 Ų | 52.8 | 41% | 0.412 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -60.1 | -47.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | V173 R174 F175 F180 L181 | V173-G177 PolarHBondContact O-N 3.11Å; R174-G177 PolarHBondContact O-N 3.41Å; F175-G177 VanDerWaalsContact C-N 3.33Å; G177-F180 PolarHBondContact O-N 3.11Å; G177-L181 WeakPolarHBondContact O-CB 3.26Å; G177-L181 PolarHBondContact O-N 3.26Å |
| 178 | F | 86.9 | Confident | 84 | Confident | 96 Ų | 96 | 52.2 Ų | 52.2 | 42% | 0.421 | 28% | 0.276 | S | S | . | . | H | α-helix | trans | -61 | -44.9 | 175 | 177.8 | -96.7 | 0 | 0 | 0 | 112.1 | I46 R174 F175 F180 L181 A182 | I46-F178 HydrophobicContact CG2-CD1 3.93Å; I46-F178 HydrophobicContact CG2-CE1 4.44Å; R174-F178 PolarHBondContact O-N 2.84Å; F175-F178 PolarHBondContact O-N 3.19Å; F178-F180 PolarHBondContact O-N 3.4Å; F178-L181 PolarHBondContact O-N 3.01Å; F178-A182 PolarHBondContact O-N 2.87Å; F178-A182 VanDerWaalsContact O-N 3.14Å |
| 179 | F | 89.5 | Confident | 84.8 | Confident | 0 Ų | 0 | 55.7 Ų | 55.7 | 0% | 0 | 28% | 0.283 | C | S | . | . | H | α-helix | trans | -58.7 | -48.3 | 176.1 | 167.1 | -86.8 | 0 | 0 | 0 | 112.3 | I49 S50 F53 W146 K149 L153 F175 F176 L181 A182 W183 | I49-F179 HydrophobicContact CG2-CD2 4.08Å; I49-F179 HydrophobicContact CG2-CE2 4.09Å; S50-F179 WeakPolarHBondContact OG-CA 3.49Å; F53-F179 HydrophobicContact CB-CE2 3.57Å; F53-F179 HydrophobicContact CB-CZ 3.9Å; F53-F179 AromaticContact CD1-CE2 3.74Å; F53-F179 HydrophobicContact CD1-CE2 3.74Å; F53-F179 AromaticContact CD1-CZ 3.45Å; F53-F179 HydrophobicContact CD1-CZ 3.45Å; F53-F179 VanDerWaalsContact CD1-CZ 3.45Å; F53-F179 AromaticContact CD2-CE2 3.89Å; F53-F179 HydrophobicContact CD2-CE2 3.89Å; F53-F179 HydrophobicContact CD2-CZ 4.45Å; F53-F179 HydrophobicContact CE1-CE2 4.37Å; F53-F179 HydrophobicContact CE1-CZ 4.03Å; F53-F179 AromaticContact CG-CE2 3.46Å; F53-F179 HydrophobicContact CG-CE2 3.46Å; F53-F179 VanDerWaalsContact CG-CE2 3.46Å; F53-F179 AromaticContact CG-CZ 3.68Å; F53-F179 HydrophobicContact CG-CZ 3.68Å; W146-F179 AromaticContact CZ3-CE1 3.89Å; W146-F179 HydrophobicContact CZ3-CE1 3.89Å; W146-F179 HydrophobicContact CZ3-CZ 4.08Å; K149-F179 HydrophobicContact CD-CD1 3.84Å; K149-F179 HydrophobicContact CD-CD2 3.76Å; K149-F179 HydrophobicContact CD-CE1 3.43Å; K149-F179 VanDerWaalsContact CD-CE1 3.43Å; K149-F179 HydrophobicContact CD-CE2 3.29Å; K149-F179 HydrophobicContact CD-CG 4.02Å; K149-F179 HydrophobicContact CD-CZ 3.14Å; K149-F179 HydrophobicContact CG-CD2 4.27Å; K149-F179 HydrophobicContact CG-CE2 3.8Å; K149-F179 HydrophobicContact CG-CZ 4.07Å; K149-F179 VanDerWaalsContact NZ-CE1 3.33Å; L153-F179 HydrophobicContact CD2-CB 3.72Å; L153-F179 HydrophobicContact CD2-CG 4.18Å; F175-F179 WeakPolarHBondContact O-CB 3.34Å; F175-F179 PolarHBondContact O-N 3.39Å; F176-F179 PolarHBondContact O-N 3.47Å; F179-L181 VanDerWaalsContact C-N 3.31Å; F179-L181 PolarHBondContact O-N 3.24Å; F179-A182 PolarHBondContact O-N 3.25Å; F179-W183 HydrophobicContact CE1-CB 4.17Å; F179-W183 HydrophobicContact CZ-CB 4.25Å; F179-W183 WeakPolarHBondContact O-CB 3.43Å; F179-W183 PolarHBondContact O-N 2.95Å |
| 180 | F | 83.5 | Confident | 85.8 | Confident | 84 Ų | 84 | 50 Ų | 50 | 37% | 0.368 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -70.1 | -29.3 | -177.6 | -79.5 | -59.8 | 0 | 0 | 0 | 112.4 | W146 F176 G177 F178 W183 Q184 | W146-F180 HydrophobicContact CZ3-CE1 4.05Å; F176-F180 HydrophobicContact CB-CD2 4.35Å; F176-F180 HydrophobicContact CB-CE2 4.42Å; F176-F180 HydrophobicContact CD1-CD2 4.47Å; F176-F180 AromaticContact CD1-CE2 3.81Å; F176-F180 HydrophobicContact CD1-CE2 3.81Å; F176-F180 WeakPolarHBondContact O-CB 3.2Å; F176-F180 WeakPolarHBondContact O-CD2 3.48Å; F176-F180 PolarHBondContact O-N 3.33Å; G177-F180 PolarHBondContact O-N 3.11Å; F178-F180 PolarHBondContact O-N 3.4Å; F180-W183 HydrophobicContact CD1-CD2 4.44Å; F180-W183 AromaticContact CD1-CE3 3.71Å; F180-W183 HydrophobicContact CD1-CE3 3.71Å; F180-W183 HydrophobicContact CD1-CZ3 4.22Å; F180-W183 HydrophobicContact CE1-CE3 4.28Å; F180-W183 PolarHBondContact O-N 2.56Å; F180-Q184 WeakPolarHBondContact O-CB 3.33Å; F180-Q184 PolarHBondContact O-N 2.97Å |
| 181 | L | 84.8 | Confident | 86.7 | Confident | 106 Ų | 106 | 47.7 Ų | 47.7 | 56% | 0.555 | 23% | 0.234 | S | C | * | . | H | α-helix | trans | -63.2 | -46.7 | 171.2 | 179.9 | 136.8 | 0 | 0 | 0 | 111.4 | G177 F178 F179 S185 I354 | G177-L181 WeakPolarHBondContact O-CB 3.26Å; G177-L181 PolarHBondContact O-N 3.26Å; F178-L181 PolarHBondContact O-N 3.01Å; F179-L181 VanDerWaalsContact C-N 3.31Å; F179-L181 PolarHBondContact O-N 3.24Å; L181-S185 PolarHBondContact O-N 3Å; L181-I354 HydrophobicContact CD1-CD1 4.27Å |
| 182 | A | 89.3 | Confident | 87.2 | Confident | 11 Ų | 11 | 49.9 Ų | 49.9 | 9% | 0.091 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -64.1 | -45.2 | 175.2 | 0 | 0 | 0 | 0 | 0 | 111.6 | M54 F178 F179 S185 | M54-A182 HydrophobicContact CB-CB 4.47Å; M54-A182 WeakPolarHBondContact CG-O 3.35Å; F178-A182 PolarHBondContact O-N 2.87Å; F178-A182 VanDerWaalsContact O-N 3.14Å; F179-A182 PolarHBondContact O-N 3.25Å; A182-S185 PolarHBondContact O-N 3.45Å; A182-S185 PolarHBondContact O-OG 3.48Å |
| 183 | W | 87.9 | Confident | 88 | Confident | 44 Ų | 44 | 50.6 Ų | 50.6 | 17% | 0.167 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -61.5 | -43.7 | 178.3 | 175 | 68.7 | 0 | 0 | 0 | 112.7 | F57 W146 F179 F180 S185 A186 | F57-W183 AromaticContact CD1-NE1 3.27Å; F57-W183 VanDerWaalsContact CD1-NE1 3.27Å; F57-W183 AromaticContact CD2-CD1 3.46Å; F57-W183 VanDerWaalsContact CD2-CD1 3.46Å; F57-W183 AromaticContact CD2-NE1 3.37Å; F57-W183 AromaticContact CE1-NE1 3.6Å; F57-W183 AromaticContact CE2-NE1 3.69Å; F57-W183 AromaticContact CG-CD1 3.52Å; F57-W183 AromaticContact CG-NE1 3.14Å; F57-W183 AromaticContact CZ-NE1 3.8Å; W146-W183 AromaticContact CH2-CD2 3.99Å; W146-W183 HydrophobicContact CH2-CD2 3.99Å; W146-W183 AromaticContact CH2-CE2 3.58Å; W146-W183 HydrophobicContact CH2-CG 4.32Å; W146-W183 AromaticContact CH2-CZ2 3.88Å; W146-W183 HydrophobicContact CH2-CZ2 3.88Å; W146-W183 AromaticContact CH2-NE1 3.69Å; W146-W183 AromaticContact CZ2-CE2 3.97Å; W146-W183 HydrophobicContact CZ2-CZ2 4.02Å; W146-W183 AromaticContact CZ2-NE1 3.91Å; F179-W183 HydrophobicContact CE1-CB 4.17Å; F179-W183 HydrophobicContact CZ-CB 4.25Å; F179-W183 WeakPolarHBondContact O-CB 3.43Å; F179-W183 PolarHBondContact O-N 2.95Å; F180-W183 HydrophobicContact CD1-CD2 4.44Å; F180-W183 AromaticContact CD1-CE3 3.71Å; F180-W183 HydrophobicContact CD1-CE3 3.71Å; F180-W183 HydrophobicContact CD1-CZ3 4.22Å; F180-W183 HydrophobicContact CE1-CE3 4.28Å; F180-W183 PolarHBondContact O-N 2.56Å; W183-S185 VanDerWaalsContact C-N 3.27Å; W183-S185 PolarHBondContact O-N 3.48Å; W183-A186 WeakPolarHBondContact O-CB 3.35Å; W183-A186 PolarHBondContact O-N 3Å |
| 184 | Q | 84 | Confident | 88.8 | Confident | 30 Ų | 30 | 45.6 Ų | 45.6 | 14% | 0.14 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -66.3 | -28.1 | 177.5 | -85.4 | -57.1 | 85.7 | 0 | 0 | 113.5 | F180 A186 E187 N349 A350 | F180-Q184 WeakPolarHBondContact O-CB 3.33Å; F180-Q184 PolarHBondContact O-N 2.97Å; Q184-A186 PolarHBondContact O-N 3.47Å; Q184-E187 WeakPolarHBondContact O-CB 3.44Å; Q184-E187 PolarHBondContact O-N 3.39Å; Q184-N349 PolarHBondContact NE2-ND2 3.02Å; Q184-A350 HydrophobicContact CB-CB 4.37Å |
| 185 | S | 88.2 | Confident | 89.1 | Confident | 36 Ų | 36 | 37.4 Ų | 37.4 | 25% | 0.252 | 19% | 0.188 | S | C | . | . | H | α-helix | trans | -66.7 | -16.5 | 174.3 | 76.4 | 0 | 0 | 0 | 0 | 113.2 | M54 L181 A182 W183 E187 L188 W189 | M54-S185 PolarHBondContact SD-OG 3.32Å; M54-S185 VanDerWaalsContact SD-OG 3.39Å; L181-S185 PolarHBondContact O-N 3Å; A182-S185 PolarHBondContact O-N 3.45Å; A182-S185 PolarHBondContact O-OG 3.48Å; W183-S185 VanDerWaalsContact C-N 3.27Å; W183-S185 PolarHBondContact O-N 3.48Å; S185-E187 PolarHBondContact O-N 3.25Å; S185-L188 WeakPolarHBondContact O-CB 3.3Å; S185-L188 PolarHBondContact O-N 3.45Å; S185-W189 PolarHBondContact O-N 3.47Å |
| 186 | A | 91.7 | Very high | 89.3 | Confident | 0 Ų | 0 | 41.3 Ų | 41.3 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -61.9 | -33.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | M54 F57 W183 Q184 L188 W189 G190 | M54-A186 HydrophobicContact CG-CB 4.4Å; M54-A186 VanDerWaalsContact O-CB 3.31Å; M54-A186 WeakPolarHBondContact O-CB 3.21Å; F57-A186 HydrophobicContact CB-CB 3.72Å; W183-A186 WeakPolarHBondContact O-CB 3.35Å; W183-A186 PolarHBondContact O-N 3Å; Q184-A186 PolarHBondContact O-N 3.47Å; A186-L188 VanDerWaalsContact C-N 3.29Å; A186-L188 PolarHBondContact O-N 2.96Å; A186-W189 PolarHBondContact O-N 3.33Å; A186-G190 PolarHBondContact O-N 2.74Å |
| 187 | E | 88.5 | Confident | 89.7 | Confident | 13 Ų | 13 | 39.8 Ų | 39.8 | 6% | 0.061 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -59.7 | -41.2 | 176.1 | -165.4 | 66.6 | -142.3 | 0 | 0 | 110.9 | Q61 N65 Q184 S185 N191 | Q61-E187 WeakPolarHBondContact CB-OE2 3.38Å; Q61-E187 WeakPolarHBondContact CG-OE2 3.34Å; Q61-E187 PolarHBondContact NE2-OE2 3.18Å; Q61-E187 PolarHBondContact OE1-OE2 3.08Å; N65-E187 PolarHBondContact ND2-OE1 2.89Å; Q184-E187 WeakPolarHBondContact O-CB 3.44Å; Q184-E187 PolarHBondContact O-N 3.39Å; S185-E187 PolarHBondContact O-N 3.25Å; E187-N191 WeakPolarHBondContact O-CB 3.37Å; E187-N191 PolarHBondContact O-N 2.95Å; E187-N191 PolarHBondContact O-ND2 3.39Å; E187-N191 PolarHBondContact OE1-ND2 3.4Å |
| 188 | L | 91.8 | Very high | 90 | Very high | 54 Ų | 54 | 38 Ų | 38 | 28% | 0.283 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -62.5 | -53.4 | 175.9 | 171.4 | 71.6 | 0 | 0 | 0 | 110.9 | S185 A186 L192 I343 V347 | S185-L188 WeakPolarHBondContact O-CB 3.3Å; S185-L188 PolarHBondContact O-N 3.45Å; A186-L188 VanDerWaalsContact C-N 3.29Å; A186-L188 PolarHBondContact O-N 2.96Å; L188-L192 WeakPolarHBondContact O-CB 3.28Å; L188-L192 PolarHBondContact O-N 3.4Å; L188-I343 HydrophobicContact CD1-CB 4.35Å; L188-I343 HydrophobicContact CD1-CD1 4.41Å; L188-I343 HydrophobicContact CD1-CG1 4.1Å; L188-I343 HydrophobicContact CD1-CG2 3.45Å; L188-I343 VanDerWaalsContact CD1-CG2 3.45Å; L188-V347 HydrophobicContact CD1-CG2 4.08Å |
| 189 | W | 93.8 | Very high | 89.9 | Confident | 124 Ų | 124 | 35 Ų | 35 | 47% | 0.47 | 18% | 0.175 | S | C | . | . | H | α-helix | trans | -67.7 | -40.8 | -174.6 | -64 | 115.2 | 0 | 0 | 0 | 112.5 | T58 S185 A186 L192 I193 | T58-W189 HydrophobicContact CG2-CB 3.77Å; S185-W189 PolarHBondContact O-N 3.47Å; A186-W189 PolarHBondContact O-N 3.33Å; W189-L192 HydrophobicContact CE3-CD2 4.26Å; W189-L192 HydrophobicContact CZ3-CD2 4.28Å; W189-L192 PolarHBondContact O-N 3.2Å; W189-I193 VanDerWaalsContact O-CG1 3.27Å; W189-I193 WeakPolarHBondContact O-CG1 3.49Å; W189-I193 PolarHBondContact O-N 3.33Å |
| 190 | G | 94.3 | Very high | 89.5 | Confident | 0 Ų | 0 | 39.4 Ų | 39.4 | 0% | 0 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -61.7 | -52.8 | -178.5 | 0 | 0 | 0 | 0 | 0 | 110.9 | T58 A186 L192 I193 S194 Y251 | T58-G190 WeakPolarHBondContact O-CA 3.3Å; A186-G190 PolarHBondContact O-N 2.74Å; G190-L192 VanDerWaalsContact C-N 3.32Å; G190-L192 PolarHBondContact O-N 3.36Å; G190-I193 PolarHBondContact O-N 3.22Å; G190-S194 PolarHBondContact O-N 2.93Å; G190-S194 PolarHBondContact O-OG 3.31Å; G190-Y251 PolarHBondContact O-OH 3.33Å |
| 191 | N | 93.9 | Very high | 88.8 | Confident | 0 Ų | 0 | 36.3 Ų | 36.3 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -67.4 | -30.3 | 179.3 | -72.7 | -55.4 | 0 | 0 | 0 | 113.2 | N65 E187 S194 S195 G339 M342 I343 | N65-N191 PolarHBondContact ND2-ND2 3.16Å; N65-N191 VanDerWaalsContact ND2-ND2 3.16Å; N65-N191 PolarHBondContact ND2-OD1 2.78Å; E187-N191 WeakPolarHBondContact O-CB 3.37Å; E187-N191 PolarHBondContact O-N 2.95Å; E187-N191 PolarHBondContact O-ND2 3.39Å; E187-N191 PolarHBondContact OE1-ND2 3.4Å; N191-S194 WeakPolarHBondContact CA-OG 3.26Å; N191-S194 PolarHBondContact O-OG 2.89Å; N191-S194 VanDerWaalsContact O-OG 3.12Å; N191-S195 VanDerWaalsContact O-CB 3.32Å; N191-S195 WeakPolarHBondContact O-CB 3.38Å; N191-S195 PolarHBondContact O-N 3Å; N191-S195 VanDerWaalsContact O-N 3.11Å; N191-S195 PolarHBondContact O-OG 3.04Å; N191-G339 WeakPolarHBondContact CB-O 3.48Å; N191-M342 HydrophobicContact CB-CB 4.48Å; N191-I343 HydrophobicContact CB-CD1 4.48Å; N191-I343 HydrophobicContact CB-CG1 3.81Å |
| 192 | L | 93.4 | Very high | 87.8 | Confident | 50 Ų | 50 | 34.2 Ų | 34.2 | 26% | 0.262 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -67.3 | -45.9 | 174.2 | -177.6 | 63.3 | 0 | 0 | 0 | 111.5 | L188 W189 G190 S195 L196 I343 | L188-L192 WeakPolarHBondContact O-CB 3.28Å; L188-L192 PolarHBondContact O-N 3.4Å; W189-L192 HydrophobicContact CE3-CD2 4.26Å; W189-L192 HydrophobicContact CZ3-CD2 4.28Å; W189-L192 PolarHBondContact O-N 3.2Å; G190-L192 VanDerWaalsContact C-N 3.32Å; G190-L192 PolarHBondContact O-N 3.36Å; L192-S195 PolarHBondContact O-N 3.34Å; L192-L196 HydrophobicContact CD1-CD1 3.93Å; L192-L196 HydrophobicContact CD1-CG 4.03Å; L192-L196 HydrophobicContact CG-CD1 3.88Å; L192-L196 HydrophobicContact CG-CG 4.35Å; L192-L196 WeakPolarHBondContact O-CB 3.47Å; L192-L196 VanDerWaalsContact O-CG 3.26Å; L192-L196 WeakPolarHBondContact O-CG 3.22Å; L192-L196 PolarHBondContact O-N 3.09Å; L192-I343 HydrophobicContact CB-CD1 3.92Å; L192-I343 HydrophobicContact CD1-CD1 4.15Å |
| 193 | I | 94.4 | Very high | 86.8 | Confident | 42 Ų | 42 | 35.3 Ų | 35.3 | 22% | 0.215 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -58.7 | -52.6 | 178.8 | -71.2 | 164.9 | 0 | 0 | 0 | 110.5 | T58 W189 G190 S195 L196 V197 I250 Y251 | T58-I193 HydrophobicContact CG2-CD1 3.69Å; W189-I193 VanDerWaalsContact O-CG1 3.27Å; W189-I193 WeakPolarHBondContact O-CG1 3.49Å; W189-I193 PolarHBondContact O-N 3.33Å; G190-I193 PolarHBondContact O-N 3.22Å; I193-S195 VanDerWaalsContact C-N 3.34Å; I193-S195 PolarHBondContact O-N 3.49Å; I193-L196 PolarHBondContact O-N 3.04Å; I193-V197 WeakPolarHBondContact O-CG2 3.39Å; I193-V197 PolarHBondContact O-N 2.88Å; I193-V197 VanDerWaalsContact O-N 3.12Å; I193-I250 HydrophobicContact CD1-CG2 4.39Å; I193-I250 HydrophobicContact CG2-CB 4.48Å; I193-I250 HydrophobicContact CG2-CD1 4.32Å; I193-I250 HydrophobicContact CG2-CG2 3.8Å; I193-Y251 HydrophobicContact CB-CE1 4.03Å; I193-Y251 HydrophobicContact CD1-CE1 4.33Å; I193-Y251 HydrophobicContact CG2-CD1 4.39Å; I193-Y251 HydrophobicContact CG2-CE1 3.72Å |
| 194 | S | 92.8 | Very high | 85.4 | Confident | 0 Ų | 0 | 34.6 Ų | 34.6 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -60.6 | -44.6 | -179.6 | 45.2 | 0 | 0 | 0 | 0 | 112 | G190 N191 L196 V197 L198 Y251 | G190-S194 PolarHBondContact O-N 2.93Å; G190-S194 PolarHBondContact O-OG 3.31Å; N191-S194 WeakPolarHBondContact CA-OG 3.26Å; N191-S194 PolarHBondContact O-OG 2.89Å; N191-S194 VanDerWaalsContact O-OG 3.12Å; S194-L196 VanDerWaalsContact C-N 3.35Å; S194-L196 PolarHBondContact O-N 2.9Å; S194-V197 PolarHBondContact O-N 2.85Å; S194-L198 WeakPolarHBondContact O-CB 3.42Å; S194-L198 WeakPolarHBondContact O-CG 3.23Å; S194-L198 PolarHBondContact O-N 3.23Å; S194-Y251 VanDerWaalsContact CB-OH 3.28Å; S194-Y251 WeakPolarHBondContact CB-OH 3.49Å; S194-Y251 PolarHBondContact N-OH 3.06Å; S194-Y251 PolarHBondContact OG-OH 3.25Å |
| 195 | S | 90.5 | Very high | 83.9 | Confident | 0 Ų | 0 | 35.5 Ų | 35.5 | 0% | 0 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -65.3 | -38.7 | -178.7 | -54.3 | 0 | 0 | 0 | 0 | 112.6 | N191 L192 I193 S199 G339 F340 | N191-S195 VanDerWaalsContact O-CB 3.32Å; N191-S195 WeakPolarHBondContact O-CB 3.38Å; N191-S195 PolarHBondContact O-N 3Å; N191-S195 VanDerWaalsContact O-N 3.11Å; N191-S195 PolarHBondContact O-OG 3.04Å; L192-S195 PolarHBondContact O-N 3.34Å; I193-S195 VanDerWaalsContact C-N 3.34Å; I193-S195 PolarHBondContact O-N 3.49Å; S195-S199 WeakPolarHBondContact O-CB 3.33Å; S195-S199 PolarHBondContact O-N 3.26Å; S195-S199 PolarHBondContact O-OG 3.43Å; S195-G339 WeakPolarHBondContact OG-CA 3.28Å; S195-G339 PolarHBondContact OG-N 3.08Å; S195-F340 PolarHBondContact OG-N 3.38Å |
| 196 | L | 91.2 | Very high | 82.1 | Confident | 96 Ų | 96 | 37.4 Ų | 37.4 | 50% | 0.503 | 25% | 0.247 | S | C | . | . | H | α-helix | trans | -66 | -47.7 | 179 | -73.4 | 175.2 | 0 | 0 | 0 | 111 | L192 I193 S194 S199 S200 | L192-L196 HydrophobicContact CD1-CD1 3.93Å; L192-L196 HydrophobicContact CD1-CG 4.03Å; L192-L196 HydrophobicContact CG-CD1 3.88Å; L192-L196 HydrophobicContact CG-CG 4.35Å; L192-L196 WeakPolarHBondContact O-CB 3.47Å; L192-L196 VanDerWaalsContact O-CG 3.26Å; L192-L196 WeakPolarHBondContact O-CG 3.22Å; L192-L196 PolarHBondContact O-N 3.09Å; I193-L196 PolarHBondContact O-N 3.04Å; S194-L196 VanDerWaalsContact C-N 3.35Å; S194-L196 PolarHBondContact O-N 2.9Å; L196-S199 PolarHBondContact O-N 3.49Å; L196-S200 WeakPolarHBondContact O-CB 3.43Å; L196-S200 PolarHBondContact O-N 3.12Å; L196-S200 PolarHBondContact O-OG 3.22Å |
| 197 | V | 91.7 | Very high | 79.8 | Confident | 10 Ų | 10 | 42 Ų | 42 | 6% | 0.061 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -61.4 | -49.5 | 178.8 | 176.8 | 0 | 0 | 0 | 0 | 111 | I193 S194 S199 S200 G201 E246 I247 I250 | I193-V197 WeakPolarHBondContact O-CG2 3.39Å; I193-V197 PolarHBondContact O-N 2.88Å; I193-V197 VanDerWaalsContact O-N 3.12Å; S194-V197 PolarHBondContact O-N 2.85Å; V197-S199 PolarHBondContact O-N 2.89Å; V197-S200 PolarHBondContact O-N 3.31Å; V197-S200 PolarHBondContact O-OG 2.92Å; V197-S200 VanDerWaalsContact O-OG 3.12Å; V197-G201 PolarHBondContact O-N 2.74Å; V197-E246 HydrophobicContact CG1-CB 4Å; V197-E246 HydrophobicContact CG1-CG 3.92Å; V197-E246 HydrophobicContact CG2-CG 4.32Å; V197-I247 HydrophobicContact CB-CD1 4.18Å; V197-I247 HydrophobicContact CB-CG1 3.69Å; V197-I247 HydrophobicContact CG1-CD1 4.1Å; V197-I247 HydrophobicContact CG1-CG1 3.55Å; V197-I247 HydrophobicContact CG2-CG1 4.15Å; V197-I250 HydrophobicContact CG2-CD1 3.95Å |
| 198 | L | 88.3 | Confident | 77.5 | Confident | 2 Ų | 2 | 46.5 Ų | 46.5 | 1% | 0.01 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -66.3 | -25.5 | 178.9 | -64.5 | 174.8 | 0 | 0 | 0 | 113.1 | L66 S194 G204 P239 E243 I247 V335 N336 | L66-L198 HydrophobicContact CD1-CD1 4.36Å; L66-L198 HydrophobicContact CD2-CD1 4.15Å; S194-L198 WeakPolarHBondContact O-CB 3.42Å; S194-L198 WeakPolarHBondContact O-CG 3.23Å; S194-L198 PolarHBondContact O-N 3.23Å; L198-G204 WeakPolarHBondContact O-CA 3.48Å; L198-G204 PolarHBondContact O-N 2.93Å; L198-G204 VanDerWaalsContact O-N 3.08Å; L198-P239 HydrophobicContact CD2-CB 3.65Å; L198-P239 HydrophobicContact CD2-CG 3.66Å; L198-E243 HydrophobicContact CD2-CB 4.23Å; L198-E243 VanDerWaalsContact CD2-OE2 3.3Å; L198-E243 WeakPolarHBondContact CD2-OE2 3.08Å; L198-I247 HydrophobicContact CD1-CD1 4.27Å; L198-I247 HydrophobicContact CD2-CD1 3.61Å; L198-I247 HydrophobicContact CG-CD1 3.64Å; L198-V335 HydrophobicContact CD1-CG1 4.11Å; L198-N336 HydrophobicContact CB-CB 3.73Å |
| 199 | S | 85.3 | Confident | 75.1 | Confident | 33 Ų | 33 | 48 Ų | 48 | 23% | 0.231 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -85.8 | -30.1 | 178.8 | -63 | 0 | 0 | 0 | 0 | 113 | S195 L196 V197 G204 F340 | S195-S199 WeakPolarHBondContact O-CB 3.33Å; S195-S199 PolarHBondContact O-N 3.26Å; S195-S199 PolarHBondContact O-OG 3.43Å; L196-S199 PolarHBondContact O-N 3.49Å; V197-S199 PolarHBondContact O-N 2.89Å; S199-G204 CarbonylContact O-C 3.57Å; S199-G204 WeakPolarHBondContact O-CA 3.45Å; S199-F340 WeakPolarHBondContact OG-CE2 3.23Å |
| 200 | S | 80.4 | Confident | 72.6 | Confident | 93 Ų | 93 | 50 Ų | 50 | 65% | 0.65 | 35% | 0.347 | S | S | * | . | H | α-helix | trans | -83.2 | -23.7 | 177.3 | 55.4 | 0 | 0 | 0 | 0 | 113.6 | L196 V197 | L196-S200 WeakPolarHBondContact O-CB 3.43Å; L196-S200 PolarHBondContact O-N 3.12Å; L196-S200 PolarHBondContact O-OG 3.22Å; V197-S200 PolarHBondContact O-N 3.31Å; V197-S200 PolarHBondContact O-OG 2.92Å; V197-S200 VanDerWaalsContact O-OG 3.12Å |
| 201 | G | 69 | Low | 70.5 | Confident | 18 Ų | 18 | 55.2 Ų | 55.2 | 19% | 0.186 | 38% | 0.379 | C | S | . | . | S | Bend | trans | -76.4 | -178.4 | 178.9 | 0 | 0 | 0 | 0 | 0 | 113.9 | V197 H203 G204 G205 E243 | V197-G201 PolarHBondContact O-N 2.74Å; G201-H203 PolarHBondContact O-N 3.09Å; G201-G204 PolarHBondContact O-N 2.9Å; G201-G205 PolarHBondContact O-N 2.98Å; G201-E243 VanDerWaalsContact CA-OE1 3.24Å; G201-E243 WeakPolarHBondContact CA-OE1 3.45Å |
| 202 | A | 63.8 | Low | 68.7 | Low | 62 Ų | 62 | 60.9 Ų | 60.9 | 51% | 0.512 | 41% | 0.414 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -59.9 | -25.3 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | P240 E243 | A202-P240 HydrophobicContact CB-CG 4.41Å; A202-E243 PolarHBondContact N-OE1 2.95Å |
| 203 | H | 68.5 | Low | 67.5 | Low | 35 Ų | 35 | 60.7 Ų | 60.7 | 16% | 0.162 | 41% | 0.414 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -73.6 | -24.2 | 176.6 | -160.7 | 64.6 | 0 | 0 | 0 | 113.4 | G201 E237 P240 E243 | G201-H203 PolarHBondContact O-N 3.09Å; H203-E237 PolarHBondContact CE1-O 3.47Å; H203-P240 HydrophobicContact CB-CG 4.5Å; H203-E243 WeakPolarHBondContact CB-OE1 3.49Å; H203-E243 WeakPolarHBondContact CB-OE2 3.29Å; H203-E243 IonicContact CG-OE2 3.57Å; H203-E243 PolarHBondContact N-OE1 3.42Å |
| 204 | G | 59 | Low | 66.5 | Low | 29 Ų | 29 | 60.6 Ų | 60.6 | 30% | 0.299 | 42% | 0.418 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -107.3 | -28.4 | 177.2 | 0 | 0 | 0 | 0 | 0 | 114.5 | L198 S199 G201 G206 | L198-G204 WeakPolarHBondContact O-CA 3.48Å; L198-G204 PolarHBondContact O-N 2.93Å; L198-G204 VanDerWaalsContact O-N 3.08Å; S199-G204 CarbonylContact O-C 3.57Å; S199-G204 WeakPolarHBondContact O-CA 3.45Å; G201-G204 PolarHBondContact O-N 2.9Å; G204-G206 PolarHBondContact O-N 3.43Å |
| 205 | G | 51.6 | Low | 65.8 | Low | 48 Ų | 48 | 65.7 Ų | 65.7 | 50% | 0.495 | 44% | 0.441 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.1 | 76.6 | -178.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | G201 S207 | G201-G205 PolarHBondContact O-N 2.98Å; G205-S207 VanDerWaalsContact C-N 3.32Å; G205-S207 PolarHBondContact O-N 3.46Å |
| 206 | G | 50.3 | Low | 65.3 | Low | 77 Ų | 77 | 72.5 Ų | 72.5 | 79% | 0.794 | 47% | 0.473 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 45.7 | 39.9 | 147.8 | 0 | 0 | 0 | 0 | 0 | 118.5 | G204 S208 | G204-G206 PolarHBondContact O-N 3.43Å; G206-S208 PolarHBondContact O-N 3.48Å |
| 207 | S | 44.2 | Very low | 64.7 | Low | 95 Ų | 95 | 70.9 Ų | 70.9 | 66% | 0.664 | 47% | 0.465 | S | S | * | . | trans | -71.7 | 83 | 161.7 | -168.1 | 0 | 0 | 0 | 0 | 108.6 | G205 S209 | G205-S207 VanDerWaalsContact C-N 3.32Å; G205-S207 PolarHBondContact O-N 3.46Å; S207-S209 VanDerWaalsContact C-N 3.34Å; S207-S209 PolarHBondContact O-N 2.83Å | ||
| 208 | S | 40.1 | Very low | 64.4 | Low | 108 Ų | 108 | 70.6 Ų | 70.6 | 76% | 0.755 | 46% | 0.463 | S | S | * | . | S | Bend | trans | 26.4 | 60.1 | 147.5 | 54.8 | 0 | 0 | 0 | 0 | 117.5 | G206 | G206-S208 PolarHBondContact O-N 3.48Š|
| 209 | S | 40.5 | Very low | 64.3 | Low | 85 Ų | 85 | 75.1 Ų | 75.1 | 59% | 0.594 | 48% | 0.484 | S | S | * | . | trans | -145 | 120.9 | 136.3 | -80.2 | 0 | 0 | 0 | 0 | 106.3 | S207 T211 | S207-S209 VanDerWaalsContact C-N 3.34Å; S207-S209 PolarHBondContact O-N 2.83Å; S209-T211 PolarHBondContact O-N 3.47Å; S209-T211 PolarHBondContact O-OG1 2.97Å | ||
| 210 | N | 42.3 | Very low | 64.5 | Low | 166 Ų | 166 | 77.3 Ų | 77.3 | 89% | 0.888 | 49% | 0.49 | S | S | * | . | trans | -61.3 | 65.9 | 150.2 | -83.8 | -15.3 | 0 | 0 | 0 | 107.4 | T212 | N210-T212 PolarHBondContact O-N 3.48Š| ||
| 211 | T | 48.6 | Very low | 64.9 | Low | 110 Ų | 110 | 73 Ų | 73 | 68% | 0.675 | 46% | 0.46 | S | S | * | . | trans | -76.8 | 73 | 159.2 | 21.3 | 0 | 0 | 0 | 0 | 105.1 | S209 V213 | S209-T211 PolarHBondContact O-N 3.47Å; S209-T211 PolarHBondContact O-OG1 2.97Å; T211-V213 VanDerWaalsContact C-N 3.28Å; T211-V213 PolarHBondContact O-N 3.04Å | ||
| 212 | T | 56.5 | Low | 66.1 | Low | 119 Ų | 119 | 72.2 Ų | 72.2 | 73% | 0.73 | 45% | 0.451 | S | S | * | . | trans | -49.9 | 108.1 | 148.7 | 46.4 | 0 | 0 | 0 | 0 | 104.7 | N210 S214 | N210-T212 PolarHBondContact O-N 3.48Å; T212-S214 PolarHBondContact O-N 3.45Å | ||
| 213 | V | 68.1 | Low | 67.5 | Low | 46 Ų | 46 | 69.6 Ų | 69.6 | 28% | 0.279 | 43% | 0.43 | S | S | . | . | trans | -47 | 117.5 | 174.4 | -177.1 | 0 | 0 | 0 | 0 | 105.6 | T211 D217 L218 | T211-V213 VanDerWaalsContact C-N 3.28Å; T211-V213 PolarHBondContact O-N 3.04Å; V213-D217 HydrophobicContact CG1-CB 3.67Å; V213-L218 HydrophobicContact CB-CD2 4.16Å; V213-L218 HydrophobicContact CB-CG 4.29Å; V213-L218 HydrophobicContact CG1-CD2 3.68Å; V213-L218 HydrophobicContact CG1-CG 3.81Å | ||
| 214 | S | 74.1 | Confident | 68.6 | Low | 41 Ų | 41 | 72.3 Ų | 72.3 | 29% | 0.287 | 45% | 0.445 | S | S | . | . | trans | -64 | 154.3 | -167.9 | 73.7 | 0 | 0 | 0 | 0 | 109.5 | T212 E216 D217 L218 | T212-S214 PolarHBondContact O-N 3.45Å; S214-E216 PolarHBondContact O-N 3.01Å; S214-E216 PolarHBondContact OG-N 2.71Å; S214-D217 WeakPolarHBondContact CB-OD2 3.45Å; S214-D217 PolarHBondContact N-OD2 3.43Å; S214-D217 WeakPolarHBondContact O-CB 3.28Å; S214-D217 PolarHBondContact O-N 2.77Å; S214-D217 WeakPolarHBondContact OG-CB 3.28Å; S214-D217 PolarHBondContact OG-N 2.98Å; S214-D217 VanDerWaalsContact OG-N 3.09Å; S214-D217 PolarHBondContact OG-OD2 3.4Å; S214-L218 PolarHBondContact O-N 3.33Å | ||
| 215 | E | 78.8 | Confident | 70.1 | Confident | 106 Ų | 106 | 70.9 Ų | 70.9 | 50% | 0.495 | 43% | 0.431 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.9 | -16.6 | 175.6 | -171.8 | 56.9 | -150.8 | 0 | 0 | 111.6 | Q219 R387 | E215-Q219 WeakPolarHBondContact O-CG 3.27Å; E215-R387 PolarHBondContact O-NH2 3.35Å; E215-R387 IonicContact OE1-CZ 3.13Å; E215-R387 IonicContact OE1-NH1 2.64Å; E215-R387 PolarHBondContact OE1-NH1 3.49Å; E215-R387 IonicContact OE1-NH2 2.66Å; E215-R387 PolarHBondContact OE1-NH2 3.17Å; E215-R387 VanDerWaalsContact OE1-NH2 3.13Å |
| 216 | E | 78.8 | Confident | 71.8 | Confident | 144 Ų | 144 | 70.1 Ų | 70.1 | 67% | 0.673 | 42% | 0.418 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.8 | -43.8 | 172.2 | -62.5 | 180 | -176.5 | 0 | 0 | 111 | S214 L218 Q219 F220 | S214-E216 PolarHBondContact O-N 3.01Å; S214-E216 PolarHBondContact OG-N 2.71Å; E216-L218 PolarHBondContact O-N 3.02Å; E216-Q219 VanDerWaalsContact O-CB 3.28Å; E216-Q219 WeakPolarHBondContact O-CB 3.47Å; E216-Q219 WeakPolarHBondContact O-CG 3.45Å; E216-Q219 PolarHBondContact O-N 3.35Å; E216-Q219 VanDerWaalsContact O-N 3.11Å; E216-F220 WeakPolarHBondContact O-CD2 3.45Å |
| 217 | D | 79.4 | Confident | 73.1 | Confident | 61 Ų | 61 | 67 Ų | 67 | 33% | 0.326 | 38% | 0.383 | S | S | . | . | G | 310 helix | trans | -63.2 | -40 | 177.7 | -71 | -35.2 | 0 | 0 | 0 | 112.6 | V213 S214 Q219 F220 N235 | V213-D217 HydrophobicContact CG1-CB 3.67Å; S214-D217 WeakPolarHBondContact CB-OD2 3.45Å; S214-D217 PolarHBondContact N-OD2 3.43Å; S214-D217 WeakPolarHBondContact O-CB 3.28Å; S214-D217 PolarHBondContact O-N 2.77Å; S214-D217 WeakPolarHBondContact OG-CB 3.28Å; S214-D217 PolarHBondContact OG-N 2.98Å; S214-D217 VanDerWaalsContact OG-N 3.09Å; S214-D217 PolarHBondContact OG-OD2 3.4Å; D217-Q219 PolarHBondContact O-N 3.42Å; D217-Q219 VanDerWaalsContact O-N 3.13Å; D217-F220 PolarHBondContact O-N 3.35Å; D217-N235 VanDerWaalsContact CB-OD1 3.27Å; D217-N235 WeakPolarHBondContact CB-OD1 3.3Å; D217-N235 PolarHBondContact O-ND2 2.94Å |
| 218 | L | 85.6 | Confident | 74.3 | Confident | 4 Ų | 4 | 67.6 Ų | 67.6 | 2% | 0.021 | 38% | 0.383 | C | S | . | . | G | 310 helix | trans | -64.7 | -14.5 | 177 | -70.9 | 176.7 | 0 | 0 | 0 | 112.8 | V213 S214 E216 F220 C221 A332 R387 | V213-L218 HydrophobicContact CB-CD2 4.16Å; V213-L218 HydrophobicContact CB-CG 4.29Å; V213-L218 HydrophobicContact CG1-CD2 3.68Å; V213-L218 HydrophobicContact CG1-CG 3.81Å; S214-L218 PolarHBondContact O-N 3.33Å; E216-L218 PolarHBondContact O-N 3.02Å; L218-F220 PolarHBondContact O-N 2.99Å; L218-C221 PolarHBondContact O-N 3.48Å; L218-A332 HydrophobicContact CD2-CB 4.05Å; L218-R387 VanDerWaalsContact CB-NH2 3.25Å; L218-R387 PolarHBondContact O-NE 2.99Å |
| 219 | Q | 86.1 | Confident | 75.2 | Confident | 98 Ų | 98 | 65 Ų | 65 | 46% | 0.458 | 37% | 0.374 | S | S | . | . | G | 310 helix | trans | -70 | -23.2 | 179.4 | -62.5 | -175.8 | 9.2 | 0 | 0 | 111.7 | E215 E216 D217 N224 | E215-Q219 WeakPolarHBondContact O-CG 3.27Å; E216-Q219 VanDerWaalsContact O-CB 3.28Å; E216-Q219 WeakPolarHBondContact O-CB 3.47Å; E216-Q219 WeakPolarHBondContact O-CG 3.45Å; E216-Q219 PolarHBondContact O-N 3.35Å; E216-Q219 VanDerWaalsContact O-N 3.11Å; D217-Q219 PolarHBondContact O-N 3.42Å; D217-Q219 VanDerWaalsContact O-N 3.13Å; Q219-N224 VanDerWaalsContact O-CB 3.27Å; Q219-N224 WeakPolarHBondContact O-CB 3.36Å; Q219-N224 PolarHBondContact O-ND2 3.32Å; Q219-N224 VanDerWaalsContact O-ND2 3.09Å |
| 220 | F | 88 | Confident | 75.7 | Confident | 79 Ų | 79 | 66.7 Ų | 66.7 | 35% | 0.346 | 39% | 0.386 | S | S | . | . | G | 310 helix | trans | -96.3 | 3.6 | 179.9 | -55.2 | -77.1 | 0 | 0 | 0 | 113 | E216 D217 L218 F225 | E216-F220 WeakPolarHBondContact O-CD2 3.45Å; D217-F220 PolarHBondContact O-N 3.35Å; L218-F220 PolarHBondContact O-N 2.99Å; F220-F225 WeakPolarHBondContact O-CA 3.24Å; F220-F225 WeakPolarHBondContact O-CB 3.36Å; F220-F225 PolarHBondContact O-N 3.4Å |
| 221 | C | 90.6 | Very high | 76.3 | Confident | 3 Ų | 3 | 60.1 Ų | 60.1 | 2% | 0.02 | 36% | 0.357 | C | S | . | . | S | Bend | trans | -90.5 | 167 | 172.3 | -59.8 | 0 | 0 | 0 | 0 | 112 | L218 C331 P388 | L218-C221 PolarHBondContact O-N 3.48Å; C221-C331 WeakPolarHBondContact CA-SG 3.24Å; C221-C331 HydrophobicContact CB-CB 3.8Å; C221-C331 WeakPolarHBondContact CB-SG 3.37Å; C221-C331 WeakPolarHBondContact SG-CB 3.29Å; C221-C331 PolarHBondContact SG-O 2.97Å; C221-C331 VanDerWaalsContact SG-O 3.35Å; C221-C331 CovalentContact SG-SG 2.04Å; C221-C331 PolarHBondContact SG-SG 3.1Å; C221-P388 HydrophobicContact CB-CB 4.35Å; C221-P388 HydrophobicContact CB-CG 4.2Å |
| 222 | G | 93.2 | Very high | 76.5 | Confident | 0 Ų | 0 | 55 Ų | 55 | 0% | 0 | 33% | 0.325 | C | S | . | . | G | 310 helix | trans | 68.9 | -132.7 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.4 | N224 F225 A327 Y328 T453 | G222-N224 PolarHBondContact O-N 3.27Å; G222-F225 VanDerWaalsContact O-CB 3.25Å; G222-F225 WeakPolarHBondContact O-CB 3.43Å; G222-F225 PolarHBondContact O-N 2.68Å; G222-F225 VanDerWaalsContact O-N 3.16Å; G222-A327 PolarHBondContact N-O 2.82Å; G222-Y328 VanDerWaalsContact CA-CE1 3.44Å; G222-Y328 VanDerWaalsContact CA-CZ 3.49Å; G222-T453 WeakPolarHBondContact O-CB 3.5Å; G222-T453 WeakPolarHBondContact O-CG2 3.27Å |
| 223 | A | 93.9 | Very high | 76.7 | Confident | 8 Ų | 8 | 52.4 Ų | 52.4 | 7% | 0.066 | 31% | 0.305 | C | S | . | . | G | 310 helix | trans | -59.4 | -33.9 | -178.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | F225 Y328 Q454 | A223-F225 PolarHBondContact O-N 2.91Å; A223-Y328 PolarHBondContact N-OH 2.93Å; A223-Q454 HydrophobicContact CB-CB 4.17Å; A223-Q454 WeakPolarHBondContact O-CA 3.4Å; A223-Q454 WeakPolarHBondContact O-CB 3.14Å; A223-Q454 PolarHBondContact O-N 3.35Å |
| 224 | N | 91.3 | Very high | 76.4 | Confident | 91 Ų | 91 | 53.5 Ų | 53.5 | 49% | 0.487 | 33% | 0.326 | S | S | . | . | G | 310 helix | trans | -77.9 | -4 | -178.4 | -66.6 | -23.2 | 0 | 0 | 0 | 113.9 | Q219 G222 C226 | Q219-N224 VanDerWaalsContact O-CB 3.27Å; Q219-N224 WeakPolarHBondContact O-CB 3.36Å; Q219-N224 PolarHBondContact O-ND2 3.32Å; Q219-N224 VanDerWaalsContact O-ND2 3.09Å; G222-N224 PolarHBondContact O-N 3.27Å; N224-C226 PolarHBondContact O-N 3.1Å |
| 225 | F | 90.5 | Very high | 76.1 | Confident | 0 Ų | 0 | 52.8 Ų | 52.8 | 0% | 0 | 32% | 0.319 | C | S | . | . | trans | -67 | 132.8 | -178.8 | -175.8 | -86.2 | 0 | 0 | 0 | 111.9 | F220 G222 A223 G232 L236 Q326 A327 C452 T453 | F220-F225 WeakPolarHBondContact O-CA 3.24Å; F220-F225 WeakPolarHBondContact O-CB 3.36Å; F220-F225 PolarHBondContact O-N 3.4Å; G222-F225 VanDerWaalsContact O-CB 3.25Å; G222-F225 WeakPolarHBondContact O-CB 3.43Å; G222-F225 PolarHBondContact O-N 2.68Å; G222-F225 VanDerWaalsContact O-N 3.16Å; A223-F225 PolarHBondContact O-N 2.91Å; F225-G232 WeakPolarHBondContact CE2-O 3.25Å; F225-L236 HydrophobicContact CE2-CD1 4.07Å; F225-L236 HydrophobicContact CZ-CD1 3.82Å; F225-Q326 HydrophobicContact CE1-CG 4.11Å; F225-Q326 HydrophobicContact CZ-CG 3.84Å; F225-A327 HydrophobicContact CB-CB 3.55Å; F225-A327 HydrophobicContact CD1-CB 3.68Å; F225-A327 HydrophobicContact CD2-CB 4.24Å; F225-A327 HydrophobicContact CE1-CB 4.47Å; F225-A327 HydrophobicContact CG-CB 3.56Å; F225-C452 CarbonylContact O-C 3.59Å; F225-C452 WeakPolarHBondContact O-CA 3.37Å; F225-C452 WeakPolarHBondContact O-CB 3.3Å; F225-T453 PolarHBondContact O-N 3.49Å; F225-T453 PolarHBondContact O-OG1 2.82Å | ||
| 226 | C | 87.9 | Confident | 76 | Confident | 31 Ų | 31 | 48.7 Ų | 48.7 | 21% | 0.209 | 30% | 0.3 | C | S | . | . | trans | -133.3 | 132.3 | 176.4 | -54.1 | 0 | 0 | 0 | 0 | 109.8 | N224 C452 | N224-C226 PolarHBondContact O-N 3.1Å; C226-C452 HydrophobicContact CB-CB 4.06Å; C226-C452 WeakPolarHBondContact CB-SG 3.45Å; C226-C452 WeakPolarHBondContact SG-CB 3.36Å; C226-C452 CovalentContact SG-SG 2.03Å; C226-C452 PolarHBondContact SG-SG 3.2Å | ||
| 227 | T | 77.6 | Confident | 76.1 | Confident | 12 Ų | 12 | 48.5 Ų | 48.5 | 7% | 0.074 | 30% | 0.299 | C | S | . | . | S | Bend | trans | -73.3 | -33.5 | 177.3 | -40.9 | 0 | 0 | 0 | 0 | 111.9 | H233 A448 T449 | T227-H233 PolarHBondContact O-CD2 2.83Å; T227-H233 VanDerWaalsContact O-CD2 3.28Å; T227-H233 PolarHBondContact O-NE2 3.37Å; T227-A448 PolarHBondContact OG1-O 2.95Å; T227-A448 VanDerWaalsContact OG1-O 3.09Å; T227-T449 HydrophobicContact CG2-CG2 4.35Å |
| 228 | T | 68.4 | Low | 76.3 | Confident | 107 Ų | 107 | 50.3 Ų | 50.3 | 66% | 0.656 | 30% | 0.301 | S | S | * | . | S | Bend | trans | -114.6 | 109.6 | 178.1 | -49.8 | 0 | 0 | 0 | 0 | 108.9 | T449 | T228-T449 PolarHBondContact OG1-O 2.84Š|
| 229 | G | 59.2 | Low | 76.3 | Confident | 55 Ų | 55 | 50.2 Ų | 50.2 | 57% | 0.567 | 30% | 0.301 | S | S | * | . | S | Bend | trans | 130.1 | 168.3 | -176.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | G231 | G229-G231 PolarHBondContact O-N 3.07Š|
| 230 | S | 50.6 | Low | 76.4 | Confident | 120 Ų | 120 | 47.5 Ų | 47.5 | 84% | 0.839 | 29% | 0.292 | S | S | * | . | S | Bend | trans | -62.2 | 122.4 | -172.8 | -47.1 | 0 | 0 | 0 | 0 | 112.9 | ||
| 231 | G | 54.9 | Low | 76.4 | Confident | 27 Ų | 27 | 50.7 Ų | 50.7 | 28% | 0.278 | 31% | 0.308 | S | S | . | . | S | Bend | trans | 128.6 | -56.6 | 158.4 | 0 | 0 | 0 | 0 | 0 | 116.5 | G229 H233 G234 | G229-G231 PolarHBondContact O-N 3.07Å; G231-H233 PolarHBondContact O-N 3.31Å; G231-G234 PolarHBondContact O-N 3.22Å; G231-G234 VanDerWaalsContact O-N 3.14Å |
| 232 | G | 54 | Low | 76.3 | Confident | 2 Ų | 2 | 55.5 Ų | 55.5 | 2% | 0.021 | 33% | 0.333 | C | S | . | . | G | 310 helix | trans | -65 | -32.4 | -166.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | F225 G234 | F225-G232 WeakPolarHBondContact CE2-O 3.25Å; G232-G234 VanDerWaalsContact C-N 3.3Å; G232-G234 PolarHBondContact O-N 3.27Å |
| 233 | H | 59.8 | Low | 76.2 | Confident | 65 Ų | 65 | 55.6 Ų | 55.6 | 30% | 0.301 | 33% | 0.334 | S | S | . | . | G | 310 helix | trans | -72.4 | -19.7 | 178.2 | -83.5 | -72.9 | 0 | 0 | 0 | 114.1 | A72 T227 G231 N235 L236 | A72-H233 PolarHBondContact O-CE1 3.28Å; T227-H233 PolarHBondContact O-CD2 2.83Å; T227-H233 VanDerWaalsContact O-CD2 3.28Å; T227-H233 PolarHBondContact O-NE2 3.37Å; G231-H233 PolarHBondContact O-N 3.31Å; H233-N235 PolarHBondContact O-N 3.2Å; H233-L236 PolarHBondContact O-N 2.8Å |
| 234 | G | 61.3 | Low | 76.1 | Confident | 69 Ų | 69 | 55.7 Ų | 55.7 | 71% | 0.711 | 33% | 0.333 | S | S | * | . | G | 310 helix | trans | -60.9 | -29.3 | -179.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | G231 G232 | G231-G234 PolarHBondContact O-N 3.22Å; G231-G234 VanDerWaalsContact O-N 3.14Å; G232-G234 VanDerWaalsContact C-N 3.3Å; G232-G234 PolarHBondContact O-N 3.27Å |
| 235 | N | 67.8 | Low | 76.1 | Confident | 26 Ų | 26 | 56.5 Ų | 56.5 | 14% | 0.139 | 33% | 0.333 | C | S | . | . | G | 310 helix | trans | -95.4 | -5.7 | -176.6 | -57.4 | -21.1 | 0 | 0 | 0 | 113.5 | D217 H233 E237 | D217-N235 VanDerWaalsContact CB-OD1 3.27Å; D217-N235 WeakPolarHBondContact CB-OD1 3.3Å; D217-N235 PolarHBondContact O-ND2 2.94Å; H233-N235 PolarHBondContact O-N 3.2Å; N235-E237 PolarHBondContact O-N 2.99Å |
| 236 | L | 77.7 | Confident | 76.3 | Confident | 20 Ų | 20 | 61.1 Ų | 61.1 | 11% | 0.105 | 35% | 0.354 | C | S | . | . | trans | -95.4 | 85.2 | 179.2 | -66.9 | 175 | 0 | 0 | 0 | 109.3 | A72 F225 H233 R238 Q326 A330 | A72-L236 HydrophobicContact CB-CD1 4.02Å; F225-L236 HydrophobicContact CE2-CD1 4.07Å; F225-L236 HydrophobicContact CZ-CD1 3.82Å; H233-L236 PolarHBondContact O-N 2.8Å; L236-R238 PolarHBondContact O-N 3.43Å; L236-Q326 HydrophobicContact CD1-CG 3.72Å; L236-Q326 HydrophobicContact CD2-CG 4.29Å; L236-A330 HydrophobicContact CD2-CB 3.5Å | ||
| 237 | E | 79.3 | Confident | 76.6 | Confident | 141 Ų | 141 | 60.1 Ų | 60.1 | 66% | 0.659 | 35% | 0.347 | S | S | * | . | P | Polyproline II helix | trans | -76.7 | 121 | 170.8 | -171.5 | 172.7 | -174.7 | 0 | 0 | 109.9 | H203 N235 | H203-E237 PolarHBondContact CE1-O 3.47Å; N235-E237 PolarHBondContact O-N 2.99Å |
| 238 | R | 84.8 | Confident | 77.4 | Confident | 98 Ų | 98 | 60 Ų | 60 | 37% | 0.37 | 35% | 0.346 | S | S | . | . | P | Polyproline II helix | trans | -71.5 | 131.8 | 176.1 | -176.8 | 176.1 | 179.5 | -116.7 | -1.1 | 108.7 | L236 E241 I244 | L236-R238 PolarHBondContact O-N 3.43Å; R238-E241 IonicContact NH1-OE1 3.98Å; R238-I244 HydrophobicContact CG-CD1 4.11Å |
| 239 | P | 86.4 | Confident | 78.7 | Confident | 2 Ų | 2 | 58.4 Ų | 58.4 | 1% | 0.013 | 33% | 0.332 | C | S | . | . | P | Polyproline II helix | trans | -56.6 | 150.1 | 175.4 | -25.4 | 33.6 | 0 | 0 | 0 | 112.5 | I70 L198 I244 V335 | I70-P239 HydrophobicContact CG2-CG 4.19Å; L198-P239 HydrophobicContact CD2-CB 3.65Å; L198-P239 HydrophobicContact CD2-CG 3.66Å; P239-I244 HydrophobicContact CB-CD1 4.48Å; P239-I244 HydrophobicContact CB-CG1 4.15Å; P239-I244 WeakPolarHBondContact O-CD1 3.39Å; P239-V335 HydrophobicContact CG-CB 4.41Å; P239-V335 HydrophobicContact CG-CG1 4.04Å |
| 240 | P | 87.8 | Confident | 80.5 | Confident | 41 Ų | 41 | 58.5 Ų | 58.5 | 27% | 0.266 | 32% | 0.319 | S | S | . | . | P | Polyproline II helix | trans | -51.1 | 151 | 172.5 | -28.3 | 36.9 | 0 | 0 | 0 | 113.3 | A202 H203 D242 E243 I244 | A202-P240 HydrophobicContact CB-CG 4.41Å; H203-P240 HydrophobicContact CB-CG 4.5Å; P240-D242 VanDerWaalsContact C-N 3.25Å; P240-D242 WeakPolarHBondContact CB-OD1 3.46Å; P240-D242 PolarHBondContact O-N 3.07Å; P240-E243 PolarHBondContact O-N 3.08Å; P240-I244 PolarHBondContact O-N 3.36Å; P240-I244 VanDerWaalsContact O-N 3.15Å |
| 241 | E | 87.8 | Confident | 82.7 | Confident | 146 Ų | 146 | 52.8 Ų | 52.8 | 68% | 0.682 | 28% | 0.279 | S | S | * | . | H | α-helix | trans | -64.8 | -29.3 | -175.4 | -62.9 | -166.2 | 154 | 0 | 0 | 113 | R238 F245 | R238-E241 IonicContact NH1-OE1 3.98Å; E241-F245 WeakPolarHBondContact O-CB 3.46Å; E241-F245 PolarHBondContact O-N 2.92Å |
| 242 | D | 89.1 | Confident | 84.7 | Confident | 104 Ų | 104 | 53.4 Ų | 53.4 | 56% | 0.556 | 28% | 0.276 | S | S | * | . | H | α-helix | trans | -66.1 | -41.6 | 175.2 | 55.4 | -53.9 | 0 | 0 | 0 | 112.4 | P240 F245 E246 | P240-D242 VanDerWaalsContact C-N 3.25Å; P240-D242 WeakPolarHBondContact CB-OD1 3.46Å; P240-D242 PolarHBondContact O-N 3.07Å; D242-F245 WeakPolarHBondContact O-CB 3.44Å; D242-F245 PolarHBondContact O-N 3.37Å; D242-E246 WeakPolarHBondContact O-CB 3.25Å; D242-E246 PolarHBondContact O-N 3.11Å |
| 243 | E | 90.3 | Very high | 86.8 | Confident | 2 Ų | 2 | 56.7 Ų | 56.7 | 1% | 0.009 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -68.3 | -43.1 | 175.5 | -65.1 | 179 | -160.2 | 0 | 0 | 111.6 | L198 G201 A202 H203 P240 F245 E246 I247 | L198-E243 HydrophobicContact CD2-CB 4.23Å; L198-E243 VanDerWaalsContact CD2-OE2 3.3Å; L198-E243 WeakPolarHBondContact CD2-OE2 3.08Å; G201-E243 VanDerWaalsContact CA-OE1 3.24Å; G201-E243 WeakPolarHBondContact CA-OE1 3.45Å; A202-E243 PolarHBondContact N-OE1 2.95Å; H203-E243 WeakPolarHBondContact CB-OE1 3.49Å; H203-E243 WeakPolarHBondContact CB-OE2 3.29Å; H203-E243 IonicContact CG-OE2 3.57Å; H203-E243 PolarHBondContact N-OE1 3.42Å; P240-E243 PolarHBondContact O-N 3.08Å; E243-F245 VanDerWaalsContact C-N 3.25Å; E243-F245 PolarHBondContact O-N 3.11Å; E243-E246 PolarHBondContact O-N 3.35Å; E243-I247 VanDerWaalsContact O-CG1 3.31Å; E243-I247 WeakPolarHBondContact O-CG1 3.43Å; E243-I247 PolarHBondContact O-N 3.12Å |
| 244 | I | 90.9 | Very high | 88.6 | Confident | 11 Ų | 11 | 54.7 Ų | 54.7 | 6% | 0.056 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -61.1 | -40.5 | 174.8 | -65.3 | 175 | 0 | 0 | 0 | 110.1 | R238 P239 P240 S248 | R238-I244 HydrophobicContact CG-CD1 4.11Å; P239-I244 HydrophobicContact CB-CD1 4.48Å; P239-I244 HydrophobicContact CB-CG1 4.15Å; P239-I244 WeakPolarHBondContact O-CD1 3.39Å; P240-I244 PolarHBondContact O-N 3.36Å; P240-I244 VanDerWaalsContact O-N 3.15Å; I244-S248 WeakPolarHBondContact O-CB 3.32Å; I244-S248 PolarHBondContact O-N 2.74Å; I244-S248 PolarHBondContact O-OG 2.97Å |
| 245 | F | 93.1 | Very high | 90.3 | Very high | 108 Ų | 108 | 51.4 Ų | 51.4 | 47% | 0.474 | 26% | 0.257 | S | S | . | . | H | α-helix | trans | -62.2 | -48.7 | 176.2 | 178.8 | -90.1 | 0 | 0 | 0 | 111.5 | L124 E241 D242 E243 S248 M249 | L124-F245 HydrophobicContact CD1-CD2 4.11Å; L124-F245 HydrophobicContact CD1-CE2 4.23Å; L124-F245 HydrophobicContact CD2-CB 4.08Å; L124-F245 HydrophobicContact CD2-CD2 3.64Å; L124-F245 HydrophobicContact CD2-CG 4.25Å; E241-F245 WeakPolarHBondContact O-CB 3.46Å; E241-F245 PolarHBondContact O-N 2.92Å; D242-F245 WeakPolarHBondContact O-CB 3.44Å; D242-F245 PolarHBondContact O-N 3.37Å; E243-F245 VanDerWaalsContact C-N 3.25Å; E243-F245 PolarHBondContact O-N 3.11Å; F245-S248 PolarHBondContact O-N 3.25Å; F245-M249 HydrophobicContact CD1-CG 4.15Å; F245-M249 HydrophobicContact CD2-CG 4.38Å; F245-M249 HydrophobicContact CE1-CG 3.78Å; F245-M249 HydrophobicContact CE2-CG 4.03Å; F245-M249 HydrophobicContact CE2-SD 4.41Å; F245-M249 HydrophobicContact CG-CG 4.43Å; F245-M249 HydrophobicContact CZ-CG 3.71Å; F245-M249 HydrophobicContact CZ-SD 4.31Å; F245-M249 WeakPolarHBondContact O-CB 3.2Å; F245-M249 VanDerWaalsContact O-CG 3.28Å; F245-M249 WeakPolarHBondContact O-CG 3.41Å; F245-M249 PolarHBondContact O-N 3.42Å |
| 246 | E | 93.8 | Very high | 91.8 | Very high | 96 Ų | 96 | 53.7 Ų | 53.7 | 45% | 0.449 | 27% | 0.272 | S | S | . | . | H | α-helix | trans | -58.4 | -50.6 | 178.8 | -176 | 174.4 | 175.9 | 0 | 0 | 111.8 | V197 D242 E243 S248 M249 I250 | V197-E246 HydrophobicContact CG1-CB 4Å; V197-E246 HydrophobicContact CG1-CG 3.92Å; V197-E246 HydrophobicContact CG2-CG 4.32Å; D242-E246 WeakPolarHBondContact O-CB 3.25Å; D242-E246 PolarHBondContact O-N 3.11Å; E243-E246 PolarHBondContact O-N 3.35Å; E246-S248 PolarHBondContact O-N 3.12Å; E246-M249 PolarHBondContact O-N 3.33Å; E246-I250 HydrophobicContact CG-CD1 3.97Å; E246-I250 VanDerWaalsContact O-CG1 3.3Å; E246-I250 WeakPolarHBondContact O-CG1 3.44Å; E246-I250 PolarHBondContact O-N 3.09Å |
| 247 | I | 93.7 | Very high | 92.8 | Very high | 11 Ų | 11 | 54.8 Ų | 54.8 | 6% | 0.056 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -60.1 | -47.4 | 178.2 | -64.3 | 169.5 | 0 | 0 | 0 | 110.8 | V197 L198 E243 M249 I250 Y251 | V197-I247 HydrophobicContact CB-CD1 4.18Å; V197-I247 HydrophobicContact CB-CG1 3.69Å; V197-I247 HydrophobicContact CG1-CD1 4.1Å; V197-I247 HydrophobicContact CG1-CG1 3.55Å; V197-I247 HydrophobicContact CG2-CG1 4.15Å; L198-I247 HydrophobicContact CD1-CD1 4.27Å; L198-I247 HydrophobicContact CD2-CD1 3.61Å; L198-I247 HydrophobicContact CG-CD1 3.64Å; E243-I247 VanDerWaalsContact O-CG1 3.31Å; E243-I247 WeakPolarHBondContact O-CG1 3.43Å; E243-I247 PolarHBondContact O-N 3.12Å; I247-M249 VanDerWaalsContact C-N 3.3Å; I247-M249 PolarHBondContact O-N 2.73Å; I247-I250 PolarHBondContact O-N 3.38Å; I247-Y251 HydrophobicContact CG2-CD2 3.54Å; I247-Y251 HydrophobicContact CG2-CE2 3.23Å; I247-Y251 HydrophobicContact CG2-CG 4.4Å; I247-Y251 WeakPolarHBondContact O-CB 2.98Å; I247-Y251 PolarHBondContact O-N 3.34Å |
| 248 | S | 94.1 | Very high | 93.7 | Very high | 8 Ų | 8 | 48 Ų | 48 | 6% | 0.056 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -62.7 | -38.6 | -178.1 | -59.6 | 0 | 0 | 0 | 0 | 111.6 | I120 I244 F245 E246 L252 | I120-S248 WeakPolarHBondContact CG2-O 3.34Å; I244-S248 WeakPolarHBondContact O-CB 3.32Å; I244-S248 PolarHBondContact O-N 2.74Å; I244-S248 PolarHBondContact O-OG 2.97Å; F245-S248 PolarHBondContact O-N 3.25Å; E246-S248 PolarHBondContact O-N 3.12Å; S248-L252 WeakPolarHBondContact O-CB 3.16Å; S248-L252 PolarHBondContact O-N 3.15Å |
| 249 | M | 95.8 | Very high | 94.3 | Very high | 74 Ų | 74 | 44.1 Ų | 44.1 | 37% | 0.365 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -71.6 | -39.4 | 178.1 | -73.2 | -57.4 | -61.6 | 0 | 0 | 112.8 | F245 E246 I247 L252 S253 | F245-M249 HydrophobicContact CD1-CG 4.15Å; F245-M249 HydrophobicContact CD2-CG 4.38Å; F245-M249 HydrophobicContact CE1-CG 3.78Å; F245-M249 HydrophobicContact CE2-CG 4.03Å; F245-M249 HydrophobicContact CE2-SD 4.41Å; F245-M249 HydrophobicContact CG-CG 4.43Å; F245-M249 HydrophobicContact CZ-CG 3.71Å; F245-M249 HydrophobicContact CZ-SD 4.31Å; F245-M249 WeakPolarHBondContact O-CB 3.2Å; F245-M249 VanDerWaalsContact O-CG 3.28Å; F245-M249 WeakPolarHBondContact O-CG 3.41Å; F245-M249 PolarHBondContact O-N 3.42Å; E246-M249 PolarHBondContact O-N 3.33Å; I247-M249 VanDerWaalsContact C-N 3.3Å; I247-M249 PolarHBondContact O-N 2.73Å; M249-L252 HydrophobicContact SD-CD2 4.45Å; M249-S253 WeakPolarHBondContact O-CB 3.4Å; M249-S253 PolarHBondContact O-N 2.83Å; M249-S253 PolarHBondContact O-OG 3.43Å |
| 250 | I | 96.9 | Very high | 94.9 | Very high | 57 Ų | 57 | 46.4 Ų | 46.4 | 29% | 0.292 | 26% | 0.255 | S | S | . | . | H | α-helix | trans | -60.5 | -50.5 | 172.9 | -67 | 165.2 | 0 | 0 | 0 | 109.7 | I193 V197 E246 I247 L252 S253 C254 | I193-I250 HydrophobicContact CD1-CG2 4.39Å; I193-I250 HydrophobicContact CG2-CB 4.48Å; I193-I250 HydrophobicContact CG2-CD1 4.32Å; I193-I250 HydrophobicContact CG2-CG2 3.8Å; V197-I250 HydrophobicContact CG2-CD1 3.95Å; E246-I250 HydrophobicContact CG-CD1 3.97Å; E246-I250 VanDerWaalsContact O-CG1 3.3Å; E246-I250 WeakPolarHBondContact O-CG1 3.44Å; E246-I250 PolarHBondContact O-N 3.09Å; I247-I250 PolarHBondContact O-N 3.38Å; I250-L252 PolarHBondContact O-N 3.37Å; I250-S253 WeakPolarHBondContact O-CB 3.37Å; I250-S253 PolarHBondContact O-N 3.4Å; I250-C254 PolarHBondContact O-N 3.02Å; I250-C254 PolarHBondContact O-SG 3Å; I250-C254 VanDerWaalsContact O-SG 3.38Å |
| 251 | Y | 97.3 | Very high | 95.3 | Very high | 1 Ų | 1 | 46.3 Ų | 46.3 | 0% | 0.004 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -65.2 | -40.1 | -179.9 | -71.4 | -20.2 | 0 | 0 | 0 | 113 | A59 G62 T63 G190 I193 S194 I247 S253 C254 I255 | A59-Y251 HydrophobicContact CB-CD1 4.05Å; A59-Y251 HydrophobicContact CB-CG 3.98Å; A59-Y251 WeakPolarHBondContact CB-O 3.2Å; G62-Y251 WeakPolarHBondContact CA-OH 3.32Å; T63-Y251 WeakPolarHBondContact OG1-CD2 3.33Å; T63-Y251 WeakPolarHBondContact OG1-CE2 3.48Å; G190-Y251 PolarHBondContact O-OH 3.33Å; I193-Y251 HydrophobicContact CB-CE1 4.03Å; I193-Y251 HydrophobicContact CD1-CE1 4.33Å; I193-Y251 HydrophobicContact CG2-CD1 4.39Å; I193-Y251 HydrophobicContact CG2-CE1 3.72Å; S194-Y251 VanDerWaalsContact CB-OH 3.28Å; S194-Y251 WeakPolarHBondContact CB-OH 3.49Å; S194-Y251 PolarHBondContact N-OH 3.06Å; S194-Y251 PolarHBondContact OG-OH 3.25Å; I247-Y251 HydrophobicContact CG2-CD2 3.54Å; I247-Y251 HydrophobicContact CG2-CE2 3.23Å; I247-Y251 HydrophobicContact CG2-CG 4.4Å; I247-Y251 WeakPolarHBondContact O-CB 2.98Å; I247-Y251 PolarHBondContact O-N 3.34Å; Y251-S253 VanDerWaalsContact C-N 3.26Å; Y251-S253 PolarHBondContact O-N 2.91Å; Y251-C254 WeakPolarHBondContact O-CB 3.26Å; Y251-C254 PolarHBondContact O-N 3.01Å; Y251-C254 VanDerWaalsContact O-N 3.15Å; Y251-I255 WeakPolarHBondContact O-CG1 3.32Å; Y251-I255 PolarHBondContact O-N 3.2Å |
| 252 | L | 97.1 | Very high | 95.8 | Very high | 40 Ų | 40 | 39.4 Ų | 39.4 | 21% | 0.209 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -61.7 | -39.8 | 175.4 | -176.8 | 61.5 | 0 | 0 | 0 | 110.9 | A117 I120 A121 S248 M249 I250 C254 I255 V256 | A117-L252 HydrophobicContact CB-CD1 3.9Å; I120-L252 HydrophobicContact CG2-CB 4.11Å; A121-L252 HydrophobicContact CB-CD1 4.42Å; A121-L252 HydrophobicContact CB-CD2 4.31Å; S248-L252 WeakPolarHBondContact O-CB 3.16Å; S248-L252 PolarHBondContact O-N 3.15Å; M249-L252 HydrophobicContact SD-CD2 4.45Å; I250-L252 PolarHBondContact O-N 3.37Å; L252-C254 VanDerWaalsContact C-N 3.34Å; L252-C254 PolarHBondContact O-N 2.78Å; L252-I255 PolarHBondContact O-N 3.34Å; L252-V256 WeakPolarHBondContact O-CG2 3.32Å; L252-V256 PolarHBondContact O-N 2.85Å |
| 253 | S | 97.8 | Very high | 96.2 | Very high | 70 Ų | 70 | 35.3 Ų | 35.3 | 49% | 0.49 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -62.9 | -39.9 | 175 | -58.1 | 0 | 0 | 0 | 0 | 111.9 | M249 I250 Y251 V256 A257 | M249-S253 WeakPolarHBondContact O-CB 3.4Å; M249-S253 PolarHBondContact O-N 2.83Å; M249-S253 PolarHBondContact O-OG 3.43Å; I250-S253 WeakPolarHBondContact O-CB 3.37Å; I250-S253 PolarHBondContact O-N 3.4Å; Y251-S253 VanDerWaalsContact C-N 3.26Å; Y251-S253 PolarHBondContact O-N 2.91Å; S253-V256 PolarHBondContact O-N 3.44Å; S253-A257 VanDerWaalsContact O-CB 3.23Å; S253-A257 WeakPolarHBondContact O-CB 3.04Å; S253-A257 PolarHBondContact O-N 3.18Å |
| 254 | C | 98 | Very high | 96.5 | Very high | 23 Ų | 23 | 42.8 Ų | 42.8 | 16% | 0.155 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -59.9 | -46.3 | 172.2 | -66.7 | 0 | 0 | 0 | 0 | 112 | V55 A59 I250 Y251 L252 V256 A257 A258 | V55-C254 HydrophobicContact CG1-CB 3.75Å; V55-C254 VanDerWaalsContact CG1-O 3.29Å; V55-C254 WeakPolarHBondContact CG1-O 3.27Å; A59-C254 HydrophobicContact CB-CB 4.03Å; I250-C254 PolarHBondContact O-N 3.02Å; I250-C254 PolarHBondContact O-SG 3Å; I250-C254 VanDerWaalsContact O-SG 3.38Å; Y251-C254 WeakPolarHBondContact O-CB 3.26Å; Y251-C254 PolarHBondContact O-N 3.01Å; Y251-C254 VanDerWaalsContact O-N 3.15Å; L252-C254 VanDerWaalsContact C-N 3.34Å; L252-C254 PolarHBondContact O-N 2.78Å; C254-V256 PolarHBondContact O-N 2.74Å; C254-A257 PolarHBondContact O-N 2.89Å; C254-A258 WeakPolarHBondContact O-CB 3.44Å; C254-A258 PolarHBondContact O-N 3.47Å |
| 255 | I | 97.9 | Very high | 96.8 | Very high | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -60.1 | -48.7 | 178 | -59.9 | -63.9 | 0 | 0 | 0 | 110.8 | Q56 A59 A117 I120 Y251 L252 A257 A258 V259 | Q56-I255 HydrophobicContact CG-CD1 4.1Å; A59-I255 HydrophobicContact CB-CD1 3.73Å; A59-I255 HydrophobicContact CB-CG1 3.94Å; A117-I255 HydrophobicContact CB-CG2 3.98Å; I120-I255 HydrophobicContact CG1-CG1 4.08Å; Y251-I255 WeakPolarHBondContact O-CG1 3.32Å; Y251-I255 PolarHBondContact O-N 3.2Å; L252-I255 PolarHBondContact O-N 3.34Å; I255-A257 VanDerWaalsContact C-N 3.34Å; I255-A257 PolarHBondContact O-N 3.15Å; I255-A258 PolarHBondContact O-N 3.08Å; I255-V259 VanDerWaalsContact O-CG2 3.32Å; I255-V259 WeakPolarHBondContact O-CG2 3.41Å; I255-V259 PolarHBondContact O-N 3.45Å |
| 256 | V | 98.1 | Very high | 96.9 | Very high | 74 Ų | 74 | 43.2 Ų | 43.2 | 45% | 0.448 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -61.8 | -43.6 | 178.7 | 174 | 0 | 0 | 0 | 0 | 110.9 | L252 S253 C254 A258 V259 C260 | L252-V256 WeakPolarHBondContact O-CG2 3.32Å; L252-V256 PolarHBondContact O-N 2.85Å; S253-V256 PolarHBondContact O-N 3.44Å; C254-V256 PolarHBondContact O-N 2.74Å; V256-A258 PolarHBondContact O-N 2.85Å; V256-V259 PolarHBondContact O-N 3.22Å; V256-C260 WeakPolarHBondContact O-CB 3.27Å; V256-C260 PolarHBondContact O-N 3.36Å; V256-C260 PolarHBondContact O-SG 2.86Å; V256-C260 VanDerWaalsContact O-SG 3.35Å |
| 257 | A | 98.2 | Very high | 96.9 | Very high | 43 Ų | 43 | 39.8 Ų | 39.8 | 36% | 0.355 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -60.7 | -45.8 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | S253 C254 I255 V259 C260 I261 | S253-A257 VanDerWaalsContact O-CB 3.23Å; S253-A257 WeakPolarHBondContact O-CB 3.04Å; S253-A257 PolarHBondContact O-N 3.18Å; C254-A257 PolarHBondContact O-N 2.89Å; I255-A257 VanDerWaalsContact C-N 3.34Å; I255-A257 PolarHBondContact O-N 3.15Å; A257-V259 PolarHBondContact O-N 3.23Å; A257-C260 PolarHBondContact O-N 3.02Å; A257-I261 WeakPolarHBondContact O-CB 3.39Å; A257-I261 WeakPolarHBondContact O-CG1 3.3Å; A257-I261 PolarHBondContact O-N 3.31Å |
| 258 | A | 98.1 | Very high | 96.6 | Very high | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -60.3 | -43.3 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | A52 V55 Q56 M113 C254 I255 V256 I261 I262 | A52-A258 VanDerWaalsContact O-CB 3.3Å; A52-A258 WeakPolarHBondContact O-CB 3.31Å; V55-A258 HydrophobicContact CB-CB 4.28Å; V55-A258 HydrophobicContact CG1-CB 4.23Å; Q56-A258 HydrophobicContact CB-CB 3.95Å; M113-A258 HydrophobicContact CE-CB 3.72Å; C254-A258 WeakPolarHBondContact O-CB 3.44Å; C254-A258 PolarHBondContact O-N 3.47Å; I255-A258 PolarHBondContact O-N 3.08Å; V256-A258 PolarHBondContact O-N 2.85Å; A258-I261 PolarHBondContact O-N 3.15Å; A258-I262 PolarHBondContact O-N 3.32Å |
| 259 | V | 98.1 | Very high | 96.2 | Very high | 16 Ų | 16 | 41.2 Ų | 41.2 | 10% | 0.097 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -62.1 | -46.4 | 174.8 | 173.4 | 0 | 0 | 0 | 0 | 111 | V110 M113 L114 I255 V256 A257 I261 I262 A263 | V110-V259 HydrophobicContact CG1-CG1 3.97Å; M113-V259 HydrophobicContact CB-CG2 3.79Å; L114-V259 HydrophobicContact CB-CG2 4.4Å; I255-V259 VanDerWaalsContact O-CG2 3.32Å; I255-V259 WeakPolarHBondContact O-CG2 3.41Å; I255-V259 PolarHBondContact O-N 3.45Å; V256-V259 PolarHBondContact O-N 3.22Å; A257-V259 PolarHBondContact O-N 3.23Å; V259-I261 PolarHBondContact O-N 3.45Å; V259-I262 PolarHBondContact O-N 3.46Å; V259-A263 VanDerWaalsContact O-CB 3.3Å; V259-A263 WeakPolarHBondContact O-CB 3.31Å; V259-A263 PolarHBondContact O-N 2.94Å |
| 260 | C | 98.2 | Very high | 95.4 | Very high | 49 Ų | 49 | 43.2 Ų | 43.2 | 33% | 0.331 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -62.1 | -40.7 | 176.5 | -73.9 | 0 | 0 | 0 | 0 | 112.2 | V256 A257 I262 A263 F264 | V256-C260 WeakPolarHBondContact O-CB 3.27Å; V256-C260 PolarHBondContact O-N 3.36Å; V256-C260 PolarHBondContact O-SG 2.86Å; V256-C260 VanDerWaalsContact O-SG 3.35Å; A257-C260 PolarHBondContact O-N 3.02Å; C260-I262 VanDerWaalsContact C-N 3.31Å; C260-I262 PolarHBondContact O-N 3.41Å; C260-A263 PolarHBondContact O-N 2.86Å; C260-F264 HydrophobicContact CB-CD2 4.04Å; C260-F264 HydrophobicContact CB-CE2 4.13Å; C260-F264 VanDerWaalsContact O-CD2 3.23Å; C260-F264 WeakPolarHBondContact O-CD2 3.07Å; C260-F264 PolarHBondContact O-N 3.25Å |
| 261 | I | 98.1 | Very high | 94.3 | Very high | 40 Ų | 40 | 45.7 Ų | 45.7 | 21% | 0.205 | 24% | 0.241 | C | C | . | . | I | π-helix | trans | -55.8 | -48.1 | 176.9 | -73.3 | 163.8 | 0 | 0 | 0 | 110 | I48 I51 A52 A257 A258 V259 F265 | I48-I261 HydrophobicContact CG2-CG2 3.74Å; I51-I261 HydrophobicContact CG2-CD1 4.4Å; A52-I261 HydrophobicContact CB-CB 4.24Å; A52-I261 HydrophobicContact CB-CG2 3.86Å; A257-I261 WeakPolarHBondContact O-CB 3.39Å; A257-I261 WeakPolarHBondContact O-CG1 3.3Å; A257-I261 PolarHBondContact O-N 3.31Å; A258-I261 PolarHBondContact O-N 3.15Å; V259-I261 PolarHBondContact O-N 3.45Å; I261-F265 WeakPolarHBondContact O-CB 3.27Å; I261-F265 PolarHBondContact O-N 3Å |
| 262 | I | 97.6 | Very high | 93.3 | Very high | 0 Ų | 0 | 46.3 Ų | 46.3 | 0% | 0 | 24% | 0.244 | C | C | . | . | I | π-helix | trans | -69.7 | -46 | 177.6 | -62.2 | -65.8 | 0 | 0 | 0 | 111.5 | I48 I49 A52 K106 L109 V110 M113 A258 V259 C260 F264 L266 | I48-I262 HydrophobicContact CG2-CD1 4.4Å; I49-I262 HydrophobicContact CG1-CD1 4.09Å; A52-I262 HydrophobicContact CB-CD1 3.55Å; A52-I262 HydrophobicContact CB-CG1 3.59Å; K106-I262 VanDerWaalsContact CE-O 3.29Å; K106-I262 WeakPolarHBondContact CE-O 3.38Å; L109-I262 HydrophobicContact CB-CG2 3.99Å; V110-I262 HydrophobicContact CG2-CB 4.29Å; V110-I262 HydrophobicContact CG2-CG2 3.7Å; M113-I262 HydrophobicContact CE-CG1 4.5Å; M113-I262 HydrophobicContact SD-CG1 3.87Å; A258-I262 PolarHBondContact O-N 3.32Å; V259-I262 PolarHBondContact O-N 3.46Å; C260-I262 VanDerWaalsContact C-N 3.31Å; C260-I262 PolarHBondContact O-N 3.41Å; I262-F264 PolarHBondContact O-N 2.74Å; I262-L266 HydrophobicContact CD1-CD2 4.1Å; I262-L266 HydrophobicContact CG2-CB 4.25Å; I262-L266 HydrophobicContact CG2-CD2 3.89Å; I262-L266 WeakPolarHBondContact O-CB 3.33Å; I262-L266 PolarHBondContact O-N 3.44Å |
| 263 | A | 96.9 | Very high | 91.9 | Very high | 18 Ų | 18 | 44.8 Ų | 44.8 | 15% | 0.149 | 24% | 0.237 | C | C | . | . | I | π-helix | trans | -60.6 | -43.3 | -174.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | K106 V110 V259 C260 | K106-A263 WeakPolarHBondContact CE-O 3.15Å; K106-A263 PolarHBondContact NZ-O 2.67Å; V110-A263 HydrophobicContact CG2-CB 4.03Å; V259-A263 VanDerWaalsContact O-CB 3.3Å; V259-A263 WeakPolarHBondContact O-CB 3.31Å; V259-A263 PolarHBondContact O-N 2.94Å; C260-A263 PolarHBondContact O-N 2.86Å |
| 264 | F | 96.8 | Very high | 90.3 | Very high | 160 Ų | 160 | 43 Ų | 43 | 70% | 0.702 | 22% | 0.221 | S | C | * | . | I | π-helix | trans | -95 | -40.1 | -174.4 | -62.3 | -63.2 | 0 | 0 | 0 | 113.8 | C260 I262 | C260-F264 HydrophobicContact CB-CD2 4.04Å; C260-F264 HydrophobicContact CB-CE2 4.13Å; C260-F264 VanDerWaalsContact O-CD2 3.23Å; C260-F264 WeakPolarHBondContact O-CD2 3.07Å; C260-F264 PolarHBondContact O-N 3.25Å; I262-F264 PolarHBondContact O-N 2.74Å |
| 265 | F | 96.9 | Very high | 88.3 | Confident | 126 Ų | 126 | 48.3 Ų | 48.3 | 55% | 0.553 | 24% | 0.242 | S | C | * | . | I | π-helix | trans | -99.5 | -24.8 | -168.9 | -58 | -87.5 | 0 | 0 | 0 | 114.1 | I48 I261 D267 | I48-F265 HydrophobicContact CD1-CB 3.73Å; I48-F265 WeakPolarHBondContact CD1-O 3.39Å; I48-F265 HydrophobicContact CG1-CB 4.28Å; I48-F265 HydrophobicContact CG2-CB 4.27Å; I261-F265 WeakPolarHBondContact O-CB 3.27Å; I261-F265 PolarHBondContact O-N 3Å; F265-D267 PolarHBondContact O-N 3.11Å |
| 266 | L | 95.8 | Very high | 86.1 | Confident | 2 Ų | 2 | 54.8 Ų | 54.8 | 1% | 0.01 | 27% | 0.266 | C | S | . | . | S | Bend | trans | -74.6 | 126.2 | 180 | -170.8 | 63.5 | 0 | 0 | 0 | 111.1 | N45 I48 I49 K106 L109 Y152 I262 | N45-L266 HydrophobicContact CB-CD1 3.85Å; I48-L266 HydrophobicContact CG2-CB 4.12Å; I48-L266 HydrophobicContact CG2-CD1 4.24Å; I49-L266 HydrophobicContact CD1-CD1 3.82Å; I49-L266 HydrophobicContact CD1-CD2 3.94Å; I49-L266 HydrophobicContact CG1-CD1 3.6Å; I49-L266 HydrophobicContact CG1-CD2 3.84Å; I49-L266 HydrophobicContact CG1-CG 4.36Å; K106-L266 WeakPolarHBondContact CD-O 3.43Å; K106-L266 VanDerWaalsContact CE-O 3.26Å; K106-L266 WeakPolarHBondContact CE-O 3.16Å; K106-L266 HydrophobicContact CG-CD2 4.48Å; K106-L266 PolarHBondContact NZ-O 3.38Å; L109-L266 HydrophobicContact CD1-CD2 3.93Å; Y152-L266 HydrophobicContact CD2-CD2 4.15Å; Y152-L266 HydrophobicContact CE1-CD1 4.05Å; Y152-L266 HydrophobicContact CE2-CD1 3.94Å; Y152-L266 HydrophobicContact CE2-CD2 3.75Å; Y152-L266 HydrophobicContact CE2-CG 3.86Å; Y152-L266 WeakPolarHBondContact OH-CD1 3.48Å; I262-L266 HydrophobicContact CD1-CD2 4.1Å; I262-L266 HydrophobicContact CG2-CB 4.25Å; I262-L266 HydrophobicContact CG2-CD2 3.89Å; I262-L266 WeakPolarHBondContact O-CB 3.33Å; I262-L266 PolarHBondContact O-N 3.44Å |
| 267 | D | 93.1 | Very high | 83.1 | Confident | 23 Ų | 23 | 61.9 Ų | 61.9 | 12% | 0.123 | 29% | 0.291 | C | S | . | . | P | Polyproline II helix | trans | -75.6 | 137.9 | 174.6 | -62.5 | -58.6 | 0 | 0 | 0 | 111.5 | R41 K44 N45 Y152 F265 | R41-D267 VanDerWaalsContact CG-OD2 3.29Å; R41-D267 WeakPolarHBondContact CG-OD2 3.42Å; R41-D267 IonicContact CZ-OD1 3.09Å; R41-D267 IonicContact CZ-OD2 3.55Å; R41-D267 VanDerWaalsContact NE-CG 3.25Å; R41-D267 IonicContact NE-OD1 3.65Å; R41-D267 IonicContact NE-OD2 3.91Å; R41-D267 PolarHBondContact NE-OD2 2.75Å; R41-D267 IonicContact NH2-OD1 3.75Å; R41-D267 PolarHBondContact NH2-OD1 3.12Å; R41-D267 IonicContact NH2-OD2 3.93Å; K44-D267 IonicContact NZ-OD1 3.96Å; K44-D267 IonicContact NZ-OD2 2.73Å; K44-D267 PolarHBondContact NZ-OD2 3.3Å; N45-D267 WeakPolarHBondContact ND2-CB 3.44Å; N45-D267 PolarHBondContact ND2-OD2 2.85Å; N45-D267 PolarHBondContact OD1-N 3.26Å; N45-D267 VanDerWaalsContact OD1-N 3.15Å; N45-D267 PolarHBondContact OD1-OD2 3.28Å; Y152-D267 WeakPolarHBondContact CE2-O 3.44Å; Y152-D267 PolarHBondContact OH-O 3.03Å; F265-D267 PolarHBondContact O-N 3.11Å |
| 268 | P | 88.8 | Confident | 80.4 | Confident | 49 Ų | 49 | 62.3 Ų | 62.3 | 32% | 0.318 | 30% | 0.3 | S | S | . | . | P | Polyproline II helix | trans | -70.1 | 141.9 | 178.8 | 28.6 | -34.1 | 0 | 0 | 0 | 112.2 | K106 K270 R271 | K106-P268 HydrophobicContact CD-CB 4.29Å; P268-K270 HydrophobicContact CB-CG 4.45Å; P268-K270 PolarHBondContact O-N 3.44Å; P268-K270 VanDerWaalsContact O-N 3.17Å; P268-R271 PolarHBondContact O-N 3.37Å |
| 269 | L | 84.7 | Confident | 77.6 | Confident | 0 Ų | 0 | 64.1 Ų | 64.1 | 0% | 0 | 31% | 0.312 | C | S | . | . | G | 310 helix | trans | -69.4 | -8.6 | 176.9 | -65.9 | 172.4 | 0 | 0 | 0 | 113.5 | V105 Y152 Q155 V156 R271 Y272 G273 E274 | V105-L269 HydrophobicContact CB-CD1 3.75Å; V105-L269 HydrophobicContact CG1-CD1 3.78Å; V105-L269 HydrophobicContact CG2-CD1 3.83Å; Y152-L269 HydrophobicContact CD1-CD2 4.19Å; Y152-L269 HydrophobicContact CD2-CD1 3.54Å; Y152-L269 HydrophobicContact CD2-CD2 3.65Å; Y152-L269 HydrophobicContact CD2-CG 3.42Å; Y152-L269 VanDerWaalsContact CD2-CG 3.42Å; Y152-L269 HydrophobicContact CE1-CD2 4.14Å; Y152-L269 HydrophobicContact CE2-CD1 4.19Å; Y152-L269 HydrophobicContact CE2-CD2 3.59Å; Y152-L269 HydrophobicContact CE2-CG 3.52Å; Y152-L269 HydrophobicContact CG-CD1 3.95Å; Y152-L269 HydrophobicContact CG-CD2 3.94Å; Y152-L269 HydrophobicContact CG-CG 4.1Å; Q155-L269 HydrophobicContact CB-CD2 4.43Å; V156-L269 HydrophobicContact CG1-CD2 3.64Å; L269-R271 PolarHBondContact O-N 2.9Å; L269-Y272 HydrophobicContact CD2-CD2 3.78Å; L269-Y272 HydrophobicContact CD2-CE2 4.38Å; L269-Y272 CarbonylContact O-C 3.6Å; L269-Y272 WeakPolarHBondContact O-CA 3.39Å; L269-Y272 PolarHBondContact O-N 3.33Å; L269-G273 PolarHBondContact O-N 3Å; L269-E274 HydrophobicContact CB-CB 3.83Å; L269-E274 HydrophobicContact CB-CG 4.11Å; L269-E274 WeakPolarHBondContact O-CB 3.3Å; L269-E274 PolarHBondContact O-N 3.45Å |
| 270 | K | 79.3 | Confident | 74.8 | Confident | 117 Ų | 117 | 66.3 Ų | 66.3 | 51% | 0.509 | 32% | 0.324 | S | S | . | . | G | 310 helix | trans | -44.6 | -34.7 | 169.8 | -67.6 | -176.1 | -175.4 | 175.8 | 0 | 112.6 | P268 Y272 G273 E274 | P268-K270 HydrophobicContact CB-CG 4.45Å; P268-K270 PolarHBondContact O-N 3.44Å; P268-K270 VanDerWaalsContact O-N 3.17Å; K270-Y272 VanDerWaalsContact C-N 3.28Å; K270-Y272 PolarHBondContact O-N 3.16Å; K270-G273 PolarHBondContact O-N 3.48Å; K270-E274 PolarHBondContact N-OE2 3.04Å |
| 271 | R | 73.9 | Confident | 72.2 | Confident | 109 Ų | 109 | 65.2 Ų | 65.2 | 41% | 0.411 | 32% | 0.317 | S | S | . | . | G | 310 helix | trans | -64 | -29.4 | 176.6 | -166.7 | 173.9 | -168.6 | -149.6 | -5.3 | 114 | E38 P268 L269 | E38-R271 IonicContact OE1-CZ 2.88Å; E38-R271 IonicContact OE1-NH1 2.68Å; E38-R271 PolarHBondContact OE1-NH1 3.07Å; E38-R271 IonicContact OE2-CZ 3.44Å; E38-R271 IonicContact OE2-NH1 2.73Å; E38-R271 PolarHBondContact OE2-NH1 3.31Å; E38-R271 IonicContact OE2-NH2 3.72Å; E38-R271 PolarHBondContact OE2-NH2 3.01Å; E38-R271 VanDerWaalsContact OE2-NH2 3.07Å; P268-R271 PolarHBondContact O-N 3.37Å; L269-R271 PolarHBondContact O-N 2.9Å |
| 272 | Y | 76.4 | Confident | 69.5 | Low | 14 Ų | 14 | 66.4 Ų | 66.4 | 6% | 0.055 | 33% | 0.332 | C | S | . | . | G | 310 helix | trans | -101.4 | 9.7 | 179.8 | -51.7 | -60.4 | 0 | 0 | 0 | 113.4 | E38 V156 V159 L269 K270 | E38-Y272 VanDerWaalsContact OE1-CE1 3.26Å; E38-Y272 WeakPolarHBondContact OE1-CE1 3.38Å; E38-Y272 VanDerWaalsContact OE1-CZ 3.28Å; E38-Y272 PolarHBondContact OE1-OH 3.09Å; V156-Y272 HydrophobicContact CG1-CD2 4.1Å; V156-Y272 HydrophobicContact CG1-CE2 3.85Å; V159-Y272 HydrophobicContact CB-CD1 4.48Å; V159-Y272 HydrophobicContact CG1-CD1 4.16Å; V159-Y272 HydrophobicContact CG1-CE1 4.1Å; V159-Y272 HydrophobicContact CG2-CD1 3.92Å; V159-Y272 HydrophobicContact CG2-CG 4.26Å; L269-Y272 HydrophobicContact CD2-CD2 3.78Å; L269-Y272 HydrophobicContact CD2-CE2 4.38Å; L269-Y272 CarbonylContact O-C 3.6Å; L269-Y272 WeakPolarHBondContact O-CA 3.39Å; L269-Y272 PolarHBondContact O-N 3.33Å; K270-Y272 VanDerWaalsContact C-N 3.28Å; K270-Y272 PolarHBondContact O-N 3.16Å |
| 273 | G | 66.8 | Low | 67 | Low | 7 Ų | 7 | 70.3 Ų | 70.3 | 7% | 0.072 | 37% | 0.365 | C | S | . | . | T | Hydrogen-bonded Turn | trans | 103.2 | 11.2 | 170 | 0 | 0 | 0 | 0 | 0 | 116.8 | L269 K270 K275 R276 S279 | L269-G273 PolarHBondContact O-N 3Å; K270-G273 PolarHBondContact O-N 3.48Å; G273-K275 PolarHBondContact O-N 2.95Å; G273-R276 PolarHBondContact O-N 3.29Å; G273-S279 WeakPolarHBondContact O-CB 3.29Å; G273-S279 PolarHBondContact O-OG 3.21Å |
| 274 | E | 65 | Low | 64.9 | Low | 32 Ų | 32 | 74.1 Ų | 74.1 | 15% | 0.15 | 38% | 0.379 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -46.6 | -19.6 | -177.9 | -176.6 | -178.2 | -147 | 0 | 0 | 117.1 | T104 V105 L269 K270 | T104-E274 WeakPolarHBondContact CB-OE1 3.35Å; V105-E274 WeakPolarHBondContact CA-OE1 3.33Å; V105-E274 WeakPolarHBondContact CB-OE1 3.45Å; V105-E274 WeakPolarHBondContact CG2-OE1 3.46Å; V105-E274 PolarHBondContact N-OE1 3.35Å; L269-E274 HydrophobicContact CB-CB 3.83Å; L269-E274 HydrophobicContact CB-CG 4.11Å; L269-E274 WeakPolarHBondContact O-CB 3.3Å; L269-E274 PolarHBondContact O-N 3.45Å; K270-E274 PolarHBondContact N-OE2 3.04Å |
| 275 | K | 55.5 | Low | 63 | Low | 136 Ų | 136 | 69.6 Ų | 69.6 | 59% | 0.591 | 36% | 0.362 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -121.7 | 8.2 | 179 | -76.5 | -167.6 | 169.3 | -173.3 | 0 | 115.3 | T104 G273 K277 | T104-K275 HydrophobicContact CG2-CD 4.32Å; G273-K275 PolarHBondContact O-N 2.95Å; K275-K277 PolarHBondContact O-N 3.34Å |
| 276 | R | 51.5 | Low | 61.5 | Low | 135 Ų | 135 | 66.2 Ų | 66.2 | 51% | 0.509 | 35% | 0.354 | S | S | . | . | trans | -74.9 | 127.7 | 180 | -72.9 | -177.2 | 179.2 | 175.2 | 2.3 | 110.3 | G273 G278 S279 | G273-R276 PolarHBondContact O-N 3.29Å; R276-G278 PolarHBondContact O-N 3Å; R276-G278 VanDerWaalsContact O-N 3.09Å; R276-S279 PolarHBondContact O-N 2.65Å | ||
| 277 | K | 35.8 | Very low | 60 | Low | 223 Ų | 223 | 66.5 Ų | 66.5 | 97% | 0.97 | 36% | 0.358 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -56.5 | 113 | 162.8 | -91.5 | -177.2 | 173.5 | 179.8 | 0 | 106.9 | K275 | K275-K277 PolarHBondContact O-N 3.34Š|
| 278 | G | 41.3 | Very low | 58.8 | Low | 53 Ų | 53 | 71 Ų | 71 | 55% | 0.546 | 38% | 0.381 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 92.3 | 9.6 | -175.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | R276 N280 | R276-G278 PolarHBondContact O-N 3Å; R276-G278 VanDerWaalsContact O-N 3.09Å; G278-N280 PolarHBondContact O-N 2.95Å |
| 279 | S | 39.8 | Very low | 57.9 | Low | 37 Ų | 37 | 74.1 Ų | 74.1 | 26% | 0.259 | 39% | 0.392 | S | S | . | . | trans | -57.5 | 112.5 | 163.7 | -176.1 | 0 | 0 | 0 | 0 | 107.8 | G273 R276 S281 | G273-S279 WeakPolarHBondContact O-CB 3.29Å; G273-S279 PolarHBondContact O-OG 3.21Å; R276-S279 PolarHBondContact O-N 2.65Å; S279-S281 PolarHBondContact O-N 2.86Å; S279-S281 PolarHBondContact OG-OG 3.48Å | ||
| 280 | N | 39.4 | Very low | 57.2 | Low | 63 Ų | 63 | 75.8 Ų | 75.8 | 34% | 0.337 | 40% | 0.4 | S | S | . | . | trans | -69.1 | 50.9 | 173.1 | -78.1 | -38.2 | 0 | 0 | 0 | 111.2 | D24 G278 A282 | D24-N280 VanDerWaalsContact C-ND2 3.3Å; D24-N280 PolarHBondContact N-ND2 2.84Å; D24-N280 PolarHBondContact O-ND2 3.32Å; G278-N280 PolarHBondContact O-N 2.95Å; N280-A282 PolarHBondContact O-N 3.23Å | ||
| 281 | S | 42.9 | Very low | 56.8 | Low | 26 Ų | 26 | 72 Ų | 72 | 18% | 0.182 | 39% | 0.385 | C | S | . | . | S | Bend | trans | -67.3 | 76.6 | 156.6 | -59.7 | 0 | 0 | 0 | 0 | 106.4 | Q155 S279 A283 E284 | Q155-S281 PolarHBondContact NE2-OG 2.68Å; Q155-S281 VanDerWaalsContact NE2-OG 3.12Å; S279-S281 PolarHBondContact O-N 2.86Å; S279-S281 PolarHBondContact OG-OG 3.48Å; S281-A283 VanDerWaalsContact C-N 3.32Å; S281-A283 PolarHBondContact O-N 3.36Å; S281-E284 PolarHBondContact O-N 3.26Å |
| 282 | A | 41.2 | Very low | 57.1 | Low | 64 Ų | 64 | 69.9 Ų | 69.9 | 53% | 0.529 | 39% | 0.387 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 24.5 | 62.7 | 172.9 | 0 | 0 | 0 | 0 | 0 | 114.5 | N280 E284 | N280-A282 PolarHBondContact O-N 3.23Å; A282-E284 PolarHBondContact O-N 2.9Å |
| 283 | A | 44.8 | Very low | 57.1 | Low | 83 Ų | 83 | 70.1 Ų | 70.1 | 69% | 0.686 | 39% | 0.392 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 26.8 | 59.8 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | S281 L285 | S281-A283 VanDerWaalsContact C-N 3.32Å; S281-A283 PolarHBondContact O-N 3.36Å; A283-L285 PolarHBondContact O-N 3.4Å |
| 284 | E | 53.9 | Low | 57.5 | Low | 97 Ų | 97 | 70.4 Ų | 70.4 | 45% | 0.453 | 39% | 0.393 | S | S | . | . | trans | -50.7 | 113.6 | -175.6 | -77.2 | -161.3 | 171 | 0 | 0 | 108.9 | S281 A282 S286 | S281-E284 PolarHBondContact O-N 3.26Å; A282-E284 PolarHBondContact O-N 2.9Å; E284-S286 PolarHBondContact O-N 3.4Å | ||
| 285 | L | 57.2 | Low | 58.3 | Low | 65 Ų | 65 | 74.4 Ų | 74.4 | 34% | 0.34 | 41% | 0.41 | S | S | . | . | trans | -57.7 | 132 | 176.4 | -73.3 | 111 | 0 | 0 | 0 | 107.3 | A283 Q289 L290 A293 | A283-L285 PolarHBondContact O-N 3.4Å; L285-Q289 HydrophobicContact CB-CB 4.02Å; L285-Q289 HydrophobicContact CD2-CB 3.88Å; L285-Q289 HydrophobicContact CG-CB 4.5Å; L285-L290 HydrophobicContact CB-CB 4.11Å; L285-A293 HydrophobicContact CD2-CB 4.3Å | ||
| 286 | S | 64.4 | Low | 59.7 | Low | 55 Ų | 55 | 76.7 Ų | 76.7 | 39% | 0.385 | 42% | 0.415 | S | S | . | . | trans | -51.5 | 147 | 167.9 | 172.2 | 0 | 0 | 0 | 0 | 109.2 | E284 L288 Q289 L290 | E284-S286 PolarHBondContact O-N 3.4Å; S286-L288 PolarHBondContact O-N 3.01Å; S286-Q289 CarbonylContact O-C 3.57Å; S286-Q289 VanDerWaalsContact O-CA 3.31Å; S286-Q289 WeakPolarHBondContact O-CA 3.06Å; S286-Q289 WeakPolarHBondContact O-CB 3.39Å; S286-Q289 PolarHBondContact O-N 3.4Å; S286-L290 PolarHBondContact O-N 2.69Å | ||
| 287 | G | 64.3 | Low | 61.2 | Low | 8 Ų | 8 | 70.4 Ų | 70.4 | 8% | 0.082 | 39% | 0.391 | C | S | . | . | H | α-helix | trans | -51.6 | -36.2 | -177.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | T97 L290 L291 | T97-G287 WeakPolarHBondContact OG1-CA 3.49Å; T97-G287 PolarHBondContact OG1-N 3.27Å; G287-L290 PolarHBondContact O-N 2.87Å; G287-L291 VanDerWaalsContact O-CB 3.25Å; G287-L291 WeakPolarHBondContact O-CB 3.41Å; G287-L291 PolarHBondContact O-N 2.92Å |
| 288 | L | 67.5 | Low | 63.5 | Low | 119 Ų | 119 | 61.2 Ų | 61.2 | 62% | 0.623 | 35% | 0.352 | S | S | * | . | H | α-helix | trans | -68.9 | -35.8 | 173.4 | -69.5 | 169.5 | 0 | 0 | 0 | 113.5 | S286 S292 | S286-L288 PolarHBondContact O-N 3.01Å; L288-S292 VanDerWaalsContact O-CB 3.29Å; L288-S292 WeakPolarHBondContact O-CB 3.32Å; L288-S292 PolarHBondContact O-N 3.49Å |
| 289 | Q | 71 | Confident | 65.7 | Low | 114 Ų | 114 | 66.8 Ų | 66.8 | 53% | 0.533 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -72.5 | -38.3 | 174.7 | -65.8 | 173.4 | -37 | 0 | 0 | 111.1 | L285 S286 S292 A293 | L285-Q289 HydrophobicContact CB-CB 4.02Å; L285-Q289 HydrophobicContact CD2-CB 3.88Å; L285-Q289 HydrophobicContact CG-CB 4.5Å; S286-Q289 CarbonylContact O-C 3.57Å; S286-Q289 VanDerWaalsContact O-CA 3.31Å; S286-Q289 WeakPolarHBondContact O-CA 3.06Å; S286-Q289 WeakPolarHBondContact O-CB 3.39Å; S286-Q289 PolarHBondContact O-N 3.4Å; Q289-S292 PolarHBondContact O-N 3.14Å; Q289-A293 WeakPolarHBondContact O-CB 3.15Å; Q289-A293 PolarHBondContact O-N 3.25Å |
| 290 | L | 68.7 | Low | 68 | Low | 34 Ų | 34 | 69 Ų | 69 | 18% | 0.178 | 37% | 0.366 | C | S | . | . | H | α-helix | trans | -65.7 | -41.9 | 173.6 | -176.2 | 64.3 | 0 | 0 | 0 | 110.5 | L285 S286 G287 A293 T294 E427 A428 | L285-L290 HydrophobicContact CB-CB 4.11Å; S286-L290 PolarHBondContact O-N 2.69Å; G287-L290 PolarHBondContact O-N 2.87Å; L290-A293 PolarHBondContact O-N 3.38Å; L290-T294 VanDerWaalsContact O-CB 3.24Å; L290-T294 WeakPolarHBondContact O-CB 3.41Å; L290-T294 PolarHBondContact O-N 2.95Å; L290-T294 PolarHBondContact O-OG1 3.4Å; L290-E427 HydrophobicContact CD1-CB 4.33Å; L290-A428 HydrophobicContact CD1-CB 4.44Å |
| 291 | L | 71.3 | Confident | 70.3 | Confident | 38 Ų | 38 | 70 Ų | 70 | 20% | 0.199 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -59.6 | -51.2 | 173.4 | -174.4 | 61.9 | 0 | 0 | 0 | 110.8 | I93 G287 A293 T294 F295 | I93-L291 HydrophobicContact CB-CD1 4.3Å; I93-L291 HydrophobicContact CD1-CD1 4.31Å; I93-L291 HydrophobicContact CG1-CD1 4Å; I93-L291 HydrophobicContact CG2-CB 4.41Å; I93-L291 HydrophobicContact CG2-CD1 3.49Å; I93-L291 VanDerWaalsContact CG2-CD1 3.49Å; I93-L291 HydrophobicContact CG2-CD2 3.62Å; I93-L291 HydrophobicContact CG2-CG 4.01Å; G287-L291 VanDerWaalsContact O-CB 3.25Å; G287-L291 WeakPolarHBondContact O-CB 3.41Å; G287-L291 PolarHBondContact O-N 2.92Å; L291-A293 VanDerWaalsContact C-N 3.31Å; L291-A293 PolarHBondContact O-N 3.41Å; L291-T294 WeakPolarHBondContact O-CB 3.42Å; L291-T294 PolarHBondContact O-N 2.7Å; L291-T294 VanDerWaalsContact O-N 3.14Å; L291-F295 HydrophobicContact CD1-CD2 3.71Å; L291-F295 HydrophobicContact CD1-CE2 3.37Å; L291-F295 HydrophobicContact CD2-CE2 4.39Å; L291-F295 HydrophobicContact CG-CD2 3.82Å; L291-F295 HydrophobicContact CG-CE2 3.77Å; L291-F295 VanDerWaalsContact O-CD2 3.31Å; L291-F295 WeakPolarHBondContact O-CD2 3.23Å; L291-F295 PolarHBondContact O-N 2.66Å |
| 292 | S | 80.3 | Confident | 72.5 | Confident | 64 Ų | 64 | 71 Ų | 71 | 45% | 0.448 | 38% | 0.38 | S | S | . | . | H | α-helix | trans | -58.4 | -43.2 | 176.3 | -173.7 | 0 | 0 | 0 | 0 | 111.9 | L288 Q289 R296 | L288-S292 VanDerWaalsContact O-CB 3.29Å; L288-S292 WeakPolarHBondContact O-CB 3.32Å; L288-S292 PolarHBondContact O-N 3.49Å; Q289-S292 PolarHBondContact O-N 3.14Å; S292-R296 WeakPolarHBondContact O-CB 3.3Å; S292-R296 PolarHBondContact O-N 3.49Å |
| 293 | A | 75.9 | Confident | 74.8 | Confident | 20 Ų | 20 | 68 Ų | 68 | 17% | 0.165 | 35% | 0.354 | C | S | . | . | H | α-helix | trans | -64.8 | -39.6 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | L285 Q289 L290 L291 R296 Q297 A428 | L285-A293 HydrophobicContact CD2-CB 4.3Å; Q289-A293 WeakPolarHBondContact O-CB 3.15Å; Q289-A293 PolarHBondContact O-N 3.25Å; L290-A293 PolarHBondContact O-N 3.38Å; L291-A293 VanDerWaalsContact C-N 3.31Å; L291-A293 PolarHBondContact O-N 3.41Å; A293-R296 PolarHBondContact O-N 3.36Å; A293-Q297 VanDerWaalsContact O-CB 3.24Å; A293-Q297 WeakPolarHBondContact O-CB 3.29Å; A293-Q297 PolarHBondContact O-N 2.82Å; A293-A428 HydrophobicContact CB-CB 4.2Å |
| 294 | T | 76.2 | Confident | 77.2 | Confident | 13 Ų | 13 | 69 Ų | 69 | 8% | 0.08 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -63.5 | -50.2 | 177 | -60.2 | 0 | 0 | 0 | 0 | 110.3 | L290 L291 R296 Q297 M298 N432 | L290-T294 VanDerWaalsContact O-CB 3.24Å; L290-T294 WeakPolarHBondContact O-CB 3.41Å; L290-T294 PolarHBondContact O-N 2.95Å; L290-T294 PolarHBondContact O-OG1 3.4Å; L291-T294 WeakPolarHBondContact O-CB 3.42Å; L291-T294 PolarHBondContact O-N 2.7Å; L291-T294 VanDerWaalsContact O-N 3.14Å; T294-R296 PolarHBondContact O-N 2.85Å; T294-Q297 WeakPolarHBondContact O-CB 3.16Å; T294-Q297 PolarHBondContact O-N 3.25Å; T294-M298 WeakPolarHBondContact O-CG 3.13Å; T294-M298 PolarHBondContact O-N 3.2Å; T294-N432 VanDerWaalsContact CG2-ND2 3.27Å; T294-N432 WeakPolarHBondContact CG2-ND2 3.31Å; T294-N432 PolarHBondContact O-ND2 3.33Å |
| 295 | F | 82.1 | Confident | 79.1 | Confident | 116 Ų | 116 | 66.8 Ų | 66.8 | 51% | 0.509 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -63.5 | -40.2 | 175 | -84.5 | -77.5 | 0 | 0 | 0 | 113 | L291 Q297 M298 | L291-F295 HydrophobicContact CD1-CD2 3.71Å; L291-F295 HydrophobicContact CD1-CE2 3.37Å; L291-F295 HydrophobicContact CD2-CE2 4.39Å; L291-F295 HydrophobicContact CG-CD2 3.82Å; L291-F295 HydrophobicContact CG-CE2 3.77Å; L291-F295 VanDerWaalsContact O-CD2 3.31Å; L291-F295 WeakPolarHBondContact O-CD2 3.23Å; L291-F295 PolarHBondContact O-N 2.66Å; F295-Q297 VanDerWaalsContact C-N 3.27Å; F295-Q297 PolarHBondContact O-N 3.45Å; F295-M298 HydrophobicContact CB-CE 4.24Å; F295-M298 HydrophobicContact CD1-CE 3.05Å; F295-M298 HydrophobicContact CE1-CE 3.34Å; F295-M298 HydrophobicContact CG-CE 3.7Å; F295-M298 HydrophobicContact CZ-CE 4.2Å; F295-M298 WeakPolarHBondContact O-CB 3.23Å; F295-M298 PolarHBondContact O-N 3.38Å |
| 296 | R | 84.8 | Confident | 80.9 | Confident | 184 Ų | 184 | 63.7 Ų | 63.7 | 69% | 0.694 | 32% | 0.319 | S | S | * | . | H | α-helix | trans | -63.7 | -37.7 | 174.9 | -173.8 | -178.6 | -71.2 | -171.9 | -3.2 | 110.9 | S292 A293 T294 K299 | S292-R296 WeakPolarHBondContact O-CB 3.3Å; S292-R296 PolarHBondContact O-N 3.49Å; A293-R296 PolarHBondContact O-N 3.36Å; T294-R296 PolarHBondContact O-N 2.85Å; R296-K299 WeakPolarHBondContact O-CB 3.44Å; R296-K299 PolarHBondContact O-N 3.48Å |
| 297 | Q | 82.9 | Confident | 82.4 | Confident | 3 Ų | 3 | 62.5 Ų | 62.5 | 1% | 0.014 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -65.8 | -37.6 | 176.3 | -164.8 | 80.7 | -8.4 | 0 | 0 | 111.5 | A293 T294 F295 K299 K300 L303 | A293-Q297 VanDerWaalsContact O-CB 3.24Å; A293-Q297 WeakPolarHBondContact O-CB 3.29Å; A293-Q297 PolarHBondContact O-N 2.82Å; T294-Q297 WeakPolarHBondContact O-CB 3.16Å; T294-Q297 PolarHBondContact O-N 3.25Å; F295-Q297 VanDerWaalsContact C-N 3.27Å; F295-Q297 PolarHBondContact O-N 3.45Å; Q297-K299 PolarHBondContact O-N 3.32Å; Q297-K299 VanDerWaalsContact O-N 3.11Å; Q297-K300 HydrophobicContact CG-CD 4.48Å; Q297-K300 VanDerWaalsContact O-CB 3.28Å; Q297-K300 WeakPolarHBondContact O-CB 3.47Å; Q297-K300 WeakPolarHBondContact O-CG 3.4Å; Q297-K300 PolarHBondContact O-N 3.36Å; Q297-L303 HydrophobicContact CB-CD2 4.29Å; Q297-L303 HydrophobicContact CG-CD2 3.86Å |
| 298 | M | 84.1 | Confident | 84 | Confident | 30 Ų | 30 | 63.3 Ų | 63.3 | 15% | 0.148 | 31% | 0.313 | C | S | . | . | H | α-helix | trans | -59.3 | -19.3 | 175.5 | -71.5 | -163.9 | -70.6 | 0 | 0 | 114.2 | T294 F295 K300 L303 Q304 N432 W436 | T294-M298 WeakPolarHBondContact O-CG 3.13Å; T294-M298 PolarHBondContact O-N 3.2Å; F295-M298 HydrophobicContact CB-CE 4.24Å; F295-M298 HydrophobicContact CD1-CE 3.05Å; F295-M298 HydrophobicContact CE1-CE 3.34Å; F295-M298 HydrophobicContact CG-CE 3.7Å; F295-M298 HydrophobicContact CZ-CE 4.2Å; F295-M298 WeakPolarHBondContact O-CB 3.23Å; F295-M298 PolarHBondContact O-N 3.38Å; M298-K300 PolarHBondContact O-N 2.91Å; M298-L303 HydrophobicContact CG-CD2 4.17Å; M298-Q304 VanDerWaalsContact O-CG 3.24Å; M298-Q304 WeakPolarHBondContact O-CG 3.48Å; M298-Q304 PolarHBondContact O-NE2 2.7Å; M298-N432 WeakPolarHBondContact CG-OD1 3.49Å; M298-W436 HydrophobicContact SD-CZ2 3.77Å |
| 299 | K | 86.2 | Confident | 85.4 | Confident | 170 Ų | 170 | 57.7 Ų | 57.7 | 74% | 0.739 | 28% | 0.283 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -74.4 | -8.9 | 173 | -62.3 | -173.8 | 175.4 | -172.8 | 0 | 113.3 | R296 Q297 | R296-K299 WeakPolarHBondContact O-CB 3.44Å; R296-K299 PolarHBondContact O-N 3.48Å; Q297-K299 PolarHBondContact O-N 3.32Å; Q297-K299 VanDerWaalsContact O-N 3.11Å |
| 300 | K | 88.3 | Confident | 86.6 | Confident | 82 Ų | 82 | 52.3 Ų | 52.3 | 36% | 0.357 | 26% | 0.258 | S | S | . | . | S | Bend | trans | -78.5 | 130.2 | 179.4 | -67.1 | -176.5 | 176.6 | 169.1 | 0 | 110.3 | Q297 M298 N302 L303 Q304 F422 | Q297-K300 HydrophobicContact CG-CD 4.48Å; Q297-K300 VanDerWaalsContact O-CB 3.28Å; Q297-K300 WeakPolarHBondContact O-CB 3.47Å; Q297-K300 WeakPolarHBondContact O-CG 3.4Å; Q297-K300 PolarHBondContact O-N 3.36Å; M298-K300 PolarHBondContact O-N 2.91Å; K300-N302 VanDerWaalsContact C-N 3.31Å; K300-N302 PolarHBondContact O-N 2.94Å; K300-L303 HydrophobicContact CB-CB 4.44Å; K300-L303 WeakPolarHBondContact O-CB 3.07Å; K300-L303 PolarHBondContact O-N 2.86Å; K300-Q304 PolarHBondContact O-N 3.34Å; K300-F422 HydrophobicContact CB-CE1 4.41Å; K300-F422 HydrophobicContact CD-CD1 4.18Å; K300-F422 HydrophobicContact CD-CE1 3.7Å |
| 301 | P | 88.6 | Confident | 88 | Confident | 85 Ų | 85 | 51.4 Ų | 51.4 | 55% | 0.552 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -61.8 | -38.3 | -175.3 | 23.7 | -33.8 | 0 | 0 | 0 | 112.3 | L303 Q304 L305 | P301-L303 PolarHBondContact O-N 3.27Å; P301-Q304 PolarHBondContact O-N 3.39Å; P301-L305 WeakPolarHBondContact O-CG 3.24Å; P301-L305 PolarHBondContact O-N 3.1Å |
| 302 | N | 89.1 | Confident | 89.2 | Confident | 48 Ų | 48 | 49.6 Ų | 49.6 | 26% | 0.257 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -61.7 | -32 | 176.8 | -64.6 | -11.3 | 0 | 0 | 0 | 112.9 | K300 L306 L421 F422 | K300-N302 VanDerWaalsContact C-N 3.31Å; K300-N302 PolarHBondContact O-N 2.94Å; N302-L306 WeakPolarHBondContact O-CG 3.26Å; N302-L421 HydrophobicContact CB-CD1 4.43Å; N302-F422 HydrophobicContact CB-CZ 4.3Å |
| 303 | L | 89.8 | Confident | 90 | Very high | 0 Ų | 0 | 46.5 Ų | 46.5 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -74.4 | -44.6 | 177.1 | -178.7 | 56.5 | 0 | 0 | 0 | 110.1 | Q297 M298 K300 P301 L305 L306 I307 Y418 F422 N432 | Q297-L303 HydrophobicContact CB-CD2 4.29Å; Q297-L303 HydrophobicContact CG-CD2 3.86Å; M298-L303 HydrophobicContact CG-CD2 4.17Å; K300-L303 HydrophobicContact CB-CB 4.44Å; K300-L303 WeakPolarHBondContact O-CB 3.07Å; K300-L303 PolarHBondContact O-N 2.86Å; P301-L303 PolarHBondContact O-N 3.27Å; L303-L305 VanDerWaalsContact C-N 3.27Å; L303-L305 PolarHBondContact O-N 3.47Å; L303-L306 CarbonylContact O-C 3.43Å; L303-L306 WeakPolarHBondContact O-CA 3.47Å; L303-L306 PolarHBondContact O-N 3.45Å; L303-I307 WeakPolarHBondContact O-CG1 3.39Å; L303-I307 PolarHBondContact O-N 3.02Å; L303-I307 VanDerWaalsContact O-N 3.12Å; L303-Y418 HydrophobicContact CD1-CD1 4.26Å; L303-Y418 HydrophobicContact CD1-CE1 3.29Å; L303-Y418 VanDerWaalsContact CD1-OH 3.29Å; L303-Y418 WeakPolarHBondContact CD1-OH 3.33Å; L303-F422 HydrophobicContact CB-CE2 4.2Å; L303-F422 HydrophobicContact CB-CZ 3.79Å; L303-F422 HydrophobicContact CD1-CE2 4.16Å; L303-N432 HydrophobicContact CD1-CB 4.33Å; L303-N432 HydrophobicContact CD2-CB 4.01Å |
| 304 | Q | 93.9 | Very high | 91 | Very high | 104 Ų | 104 | 45.6 Ų | 45.6 | 49% | 0.486 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -57.9 | -40.2 | 179.5 | -66.7 | 176.7 | -14.6 | 0 | 0 | 112.5 | M298 K300 P301 L306 I307 P308 | M298-Q304 VanDerWaalsContact O-CG 3.24Å; M298-Q304 WeakPolarHBondContact O-CG 3.48Å; M298-Q304 PolarHBondContact O-NE2 2.7Å; K300-Q304 PolarHBondContact O-N 3.34Å; P301-Q304 PolarHBondContact O-N 3.39Å; Q304-L306 VanDerWaalsContact C-N 3.26Å; Q304-L306 PolarHBondContact O-N 3.3Å; Q304-I307 WeakPolarHBondContact O-CB 3.48Å; Q304-I307 PolarHBondContact O-N 2.75Å; Q304-P308 WeakPolarHBondContact O-CD 3.45Å |
| 305 | L | 94.8 | Very high | 92 | Very high | 50 Ų | 50 | 45 Ų | 45 | 26% | 0.262 | 21% | 0.212 | S | C | . | . | H | α-helix | trans | -68.5 | -22 | 175.9 | -68.6 | 169 | 0 | 0 | 0 | 113.6 | P301 L303 G470 I473 V474 L477 | P301-L305 WeakPolarHBondContact O-CG 3.24Å; P301-L305 PolarHBondContact O-N 3.1Å; L303-L305 VanDerWaalsContact C-N 3.27Å; L303-L305 PolarHBondContact O-N 3.47Å; L305-G470 CarbonylContact O-C 3.59Å; L305-G470 WeakPolarHBondContact O-CA 3.46Å; L305-I473 HydrophobicContact CD1-CB 4.34Å; L305-I473 HydrophobicContact CD1-CG2 3.69Å; L305-I473 HydrophobicContact CD2-CD1 4.41Å; L305-V474 HydrophobicContact CB-CG2 3.46Å; L305-V474 VanDerWaalsContact CB-CG2 3.46Å; L305-V474 HydrophobicContact CD1-CG2 3.76Å; L305-V474 HydrophobicContact CG-CG2 4.27Å; L305-L477 HydrophobicContact CD1-CD1 4.34Å |
| 306 | L | 94.9 | Very high | 92.7 | Very high | 0 Ų | 0 | 39.5 Ų | 39.5 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -91.9 | -9.5 | 175.7 | -67.6 | 176 | 0 | 0 | 0 | 113.3 | N302 L303 Q304 I309 T310 L417 Y418 L421 Y471 V474 | N302-L306 WeakPolarHBondContact O-CG 3.26Å; L303-L306 CarbonylContact O-C 3.43Å; L303-L306 WeakPolarHBondContact O-CA 3.47Å; L303-L306 PolarHBondContact O-N 3.45Å; Q304-L306 VanDerWaalsContact C-N 3.26Å; Q304-L306 PolarHBondContact O-N 3.3Å; L306-I309 HydrophobicContact CB-CG2 4.47Å; L306-I309 HydrophobicContact CD2-CG2 4.15Å; L306-I309 VanDerWaalsContact O-CG2 3.23Å; L306-I309 WeakPolarHBondContact O-CG2 3.38Å; L306-T310 WeakPolarHBondContact O-CB 3.43Å; L306-T310 PolarHBondContact O-N 3.44Å; L306-T310 VanDerWaalsContact O-N 3.08Å; L306-T310 PolarHBondContact O-OG1 3.3Å; L306-L417 HydrophobicContact CD1-CD2 3.79Å; L306-L417 HydrophobicContact CD1-CG 4.15Å; L306-L417 HydrophobicContact CD2-CD2 3.69Å; L306-L417 HydrophobicContact CG-CD2 4.41Å; L306-Y418 HydrophobicContact CB-CE2 3.94Å; L306-Y418 HydrophobicContact CD1-CD2 4.17Å; L306-Y418 HydrophobicContact CD1-CE2 3.84Å; L306-Y418 HydrophobicContact CG-CE2 4.5Å; L306-L421 HydrophobicContact CD1-CD1 3.65Å; L306-Y471 HydrophobicContact CD2-CD2 4.4Å; L306-V474 HydrophobicContact CD1-CG1 4.5Å; L306-V474 HydrophobicContact CD2-CB 4.48Å; L306-V474 HydrophobicContact CD2-CG1 4.49Å; L306-V474 HydrophobicContact CD2-CG2 4.37Å; L306-V474 HydrophobicContact CG-CG2 4.25Å |
| 307 | I | 95.6 | Very high | 93.2 | Very high | 30 Ų | 30 | 32.3 Ų | 32.3 | 15% | 0.154 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -57.9 | -49.8 | 178.1 | -68.2 | 171 | 0 | 0 | 0 | 111.1 | L303 Q304 I309 T310 V311 W436 | L303-I307 WeakPolarHBondContact O-CG1 3.39Å; L303-I307 PolarHBondContact O-N 3.02Å; L303-I307 VanDerWaalsContact O-N 3.12Å; Q304-I307 WeakPolarHBondContact O-CB 3.48Å; Q304-I307 PolarHBondContact O-N 2.75Å; I307-I309 PolarHBondContact O-N 3.46Å; I307-T310 PolarHBondContact O-N 3.27Å; I307-T310 VanDerWaalsContact O-N 3.07Å; I307-V311 HydrophobicContact CG2-CG2 3.99Å; I307-V311 WeakPolarHBondContact O-CG2 3.38Å; I307-V311 PolarHBondContact O-N 3.49Å; I307-W436 HydrophobicContact CB-CD2 4.41Å; I307-W436 HydrophobicContact CD1-CD2 4.39Å; I307-W436 HydrophobicContact CD1-CH2 4.3Å; I307-W436 HydrophobicContact CD1-CZ2 3.62Å; I307-W436 HydrophobicContact CG1-CD2 4.09Å; I307-W436 HydrophobicContact CG1-CG 4.23Å; I307-W436 HydrophobicContact CG1-CZ2 4.24Å; I307-W436 HydrophobicContact CG2-CD2 3.58Å; I307-W436 HydrophobicContact CG2-CE3 3.52Å; I307-W436 HydrophobicContact CG2-CG 4.12Å; I307-W436 HydrophobicContact CG2-CH2 4.18Å; I307-W436 HydrophobicContact CG2-CZ2 4.26Å; I307-W436 HydrophobicContact CG2-CZ3 3.83Å |
| 308 | P | 97.4 | Very high | 93.7 | Very high | 26 Ų | 26 | 32.2 Ų | 32.2 | 17% | 0.169 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -62.1 | -41 | -175.1 | -23.5 | 34.6 | 0 | 0 | 0 | 113.3 | Q304 T310 V311 F312 V463 L466 | Q304-P308 WeakPolarHBondContact O-CD 3.45Å; P308-T310 VanDerWaalsContact C-N 3.32Å; P308-T310 PolarHBondContact O-N 3.49Å; P308-V311 PolarHBondContact O-N 2.87Å; P308-F312 PolarHBondContact O-N 3.43Å; P308-V463 WeakPolarHBondContact O-CG1 3.39Å; P308-L466 HydrophobicContact CB-CB 4.35Å; P308-L466 HydrophobicContact CB-CD2 3.97Å; P308-L466 HydrophobicContact CB-CG 3.86Å; P308-L466 HydrophobicContact CG-CD2 4.01Å; P308-L466 HydrophobicContact CG-CG 3.98Å |
| 309 | I | 97.4 | Very high | 94.3 | Very high | 1 Ų | 1 | 30.9 Ų | 30.9 | 1% | 0.005 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -68.2 | -33.8 | 176.2 | -164.7 | 66.5 | 0 | 0 | 0 | 111.6 | L306 I307 F312 I313 W410 I414 L464 | L306-I309 HydrophobicContact CB-CG2 4.47Å; L306-I309 HydrophobicContact CD2-CG2 4.15Å; L306-I309 VanDerWaalsContact O-CG2 3.23Å; L306-I309 WeakPolarHBondContact O-CG2 3.38Å; I307-I309 PolarHBondContact O-N 3.46Å; I309-F312 HydrophobicContact CD1-CD1 4.2Å; I309-F312 WeakPolarHBondContact O-CB 3.37Å; I309-F312 PolarHBondContact O-N 2.93Å; I309-I313 WeakPolarHBondContact O-CG1 3.49Å; I309-I313 PolarHBondContact O-N 3.39Å; I309-I313 VanDerWaalsContact O-N 3.11Å; I309-W410 HydrophobicContact CD1-CE3 4.21Å; I309-W410 HydrophobicContact CD1-CH2 4.39Å; I309-W410 HydrophobicContact CD1-CZ3 4.03Å; I309-W410 HydrophobicContact CG1-CE3 4.37Å; I309-W410 HydrophobicContact CG1-CZ3 4.44Å; I309-I414 HydrophobicContact CG1-CD1 4.38Å; I309-I414 HydrophobicContact CG1-CG1 4.4Å; I309-I414 HydrophobicContact CG2-CD1 4.45Å; I309-I414 HydrophobicContact CG2-CG2 4.27Å; I309-L464 HydrophobicContact CD1-CD1 4.14Å |
| 310 | T | 96.2 | Very high | 94.8 | Very high | 0 Ų | 0 | 22.9 Ų | 22.9 | 0% | 0 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -71.6 | -36.3 | 177.4 | -49.9 | 0 | 0 | 0 | 0 | 111.6 | L306 I307 P308 I313 G314 Y418 Y433 W436 E437 | L306-T310 WeakPolarHBondContact O-CB 3.43Å; L306-T310 PolarHBondContact O-N 3.44Å; L306-T310 VanDerWaalsContact O-N 3.08Å; L306-T310 PolarHBondContact O-OG1 3.3Å; I307-T310 PolarHBondContact O-N 3.27Å; I307-T310 VanDerWaalsContact O-N 3.07Å; P308-T310 VanDerWaalsContact C-N 3.32Å; P308-T310 PolarHBondContact O-N 3.49Å; T310-I313 PolarHBondContact O-N 3.48Å; T310-G314 PolarHBondContact O-N 3.26Å; T310-Y418 PolarHBondContact OG1-OH 3.25Å; T310-Y433 HydrophobicContact CG2-CD2 3.79Å; T310-Y433 HydrophobicContact CG2-CE2 4.02Å; T310-Y433 HydrophobicContact CG2-CG 4.3Å; T310-Y433 VanDerWaalsContact CG2-O 3.29Å; T310-Y433 WeakPolarHBondContact CG2-O 3.47Å; T310-W436 HydrophobicContact CG2-CB 3.75Å; T310-E437 HydrophobicContact CG2-CB 4.3Å; T310-E437 WeakPolarHBondContact O-CA 3.28Å |
| 311 | V | 97.4 | Very high | 95 | Very high | 15 Ų | 15 | 19.3 Ų | 19.3 | 9% | 0.091 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -64.8 | -42.6 | 171.6 | 169.4 | 0 | 0 | 0 | 0 | 110.2 | I307 P308 I313 G314 M315 W436 G440 I443 V463 | I307-V311 HydrophobicContact CG2-CG2 3.99Å; I307-V311 WeakPolarHBondContact O-CG2 3.38Å; I307-V311 PolarHBondContact O-N 3.49Å; P308-V311 PolarHBondContact O-N 2.87Å; V311-I313 VanDerWaalsContact C-N 3.32Å; V311-I313 PolarHBondContact O-N 3.21Å; V311-G314 PolarHBondContact O-N 3.03Å; V311-G314 VanDerWaalsContact O-N 3.12Å; V311-M315 HydrophobicContact CG1-CG 4.25Å; V311-M315 HydrophobicContact CG1-SD 3.65Å; V311-M315 WeakPolarHBondContact O-CG 3.46Å; V311-M315 PolarHBondContact O-N 2.92Å; V311-W436 HydrophobicContact CG2-CB 4.29Å; V311-W436 HydrophobicContact CG2-CE3 3.83Å; V311-G440 WeakPolarHBondContact O-CA 3.47Å; V311-I443 HydrophobicContact CG1-CD1 4.14Å; V311-V463 HydrophobicContact CG1-CG1 4.44Å |
| 312 | F | 98.1 | Very high | 95.1 | Very high | 0 Ų | 0 | 15.2 Ų | 15.2 | 0% | 0 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -55.1 | -44.5 | 174 | 174.1 | -99.6 | 0 | 0 | 0 | 112.4 | P308 I309 G314 M315 E316 H376 I380 W410 L460 V463 L464 | P308-F312 PolarHBondContact O-N 3.43Å; I309-F312 HydrophobicContact CD1-CD1 4.2Å; I309-F312 WeakPolarHBondContact O-CB 3.37Å; I309-F312 PolarHBondContact O-N 2.93Å; F312-G314 VanDerWaalsContact C-N 3.26Å; F312-G314 PolarHBondContact O-N 2.96Å; F312-M315 PolarHBondContact O-N 3.18Å; F312-E316 HydrophobicContact CD1-CG 4.34Å; F312-E316 HydrophobicContact CE1-CB 4.23Å; F312-E316 HydrophobicContact CE1-CG 4.02Å; F312-E316 HydrophobicContact CE2-CB 4.3Å; F312-E316 HydrophobicContact CZ-CB 3.99Å; F312-E316 HydrophobicContact CZ-CG 4.3Å; F312-E316 VanDerWaalsContact O-CG 3.24Å; F312-E316 WeakPolarHBondContact O-CG 3.43Å; F312-E316 PolarHBondContact O-N 3.39Å; F312-H376 AromaticContact CE1-ND1 3.6Å; F312-H376 HydrophobicContact CZ-CB 4.36Å; F312-H376 AromaticContact CZ-ND1 3.59Å; F312-I380 HydrophobicContact CE2-CD1 4.4Å; F312-W410 AromaticContact CE1-NE1 3.81Å; F312-L460 HydrophobicContact CD2-CD2 4.28Å; F312-L460 HydrophobicContact CE2-CB 4.49Å; F312-L460 HydrophobicContact CE2-CD2 4.12Å; F312-V463 HydrophobicContact CB-CG1 3.97Å; F312-L464 HydrophobicContact CD1-CD1 3.93Å; F312-L464 HydrophobicContact CD2-CB 3.75Å; F312-L464 HydrophobicContact CD2-CD1 4.46Å; F312-L464 HydrophobicContact CE1-CD1 3.69Å; F312-L464 HydrophobicContact CE2-CB 3.62Å; F312-L464 HydrophobicContact CE2-CD1 4.24Å; F312-L464 HydrophobicContact CE2-CD2 4.28Å; F312-L464 HydrophobicContact CE2-CG 4.24Å; F312-L464 HydrophobicContact CG-CB 4.31Å; F312-L464 HydrophobicContact CG-CD1 4.32Å; F312-L464 HydrophobicContact CZ-CB 4.07Å; F312-L464 HydrophobicContact CZ-CD1 3.85Å; F312-L464 HydrophobicContact CZ-CD2 4Å; F312-L464 HydrophobicContact CZ-CG 4.18Å |
| 313 | I | 96.8 | Very high | 95.3 | Very high | 0 Ų | 0 | 13.1 Ų | 13.1 | 0% | 0 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -56.2 | -39.6 | 177.2 | -65.8 | 168.6 | 0 | 0 | 0 | 112 | I309 T310 V311 E316 Q317 W410 Q411 I414 Y433 E437 | I309-I313 WeakPolarHBondContact O-CG1 3.49Å; I309-I313 PolarHBondContact O-N 3.39Å; I309-I313 VanDerWaalsContact O-N 3.11Å; T310-I313 PolarHBondContact O-N 3.48Å; V311-I313 VanDerWaalsContact C-N 3.32Å; V311-I313 PolarHBondContact O-N 3.21Å; I313-E316 WeakPolarHBondContact O-CG 3.45Å; I313-Q317 WeakPolarHBondContact O-CG 3.38Å; I313-Q317 PolarHBondContact O-N 2.98Å; I313-W410 HydrophobicContact CD1-CB 3.78Å; I313-W410 HydrophobicContact CG1-CB 3.62Å; I313-W410 HydrophobicContact CG1-CG 4.35Å; I313-Q411 HydrophobicContact CG2-CG 4.42Å; I313-I414 HydrophobicContact CD1-CB 4.04Å; I313-I414 HydrophobicContact CD1-CG1 4.18Å; I313-I414 HydrophobicContact CD1-CG2 4.23Å; I313-Y433 HydrophobicContact CD1-CE2 4.18Å; I313-E437 HydrophobicContact CG2-CG 4.27Å |
| 314 | G | 96 | Very high | 95.6 | Very high | 0 Ų | 0 | 13.1 Ų | 13.1 | 0% | 0 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -70.4 | -40.6 | 174.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | T310 V311 F312 A318 E437 | T310-G314 PolarHBondContact O-N 3.26Å; V311-G314 PolarHBondContact O-N 3.03Å; V311-G314 VanDerWaalsContact O-N 3.12Å; F312-G314 VanDerWaalsContact C-N 3.26Å; F312-G314 PolarHBondContact O-N 2.96Å; G314-A318 WeakPolarHBondContact O-CB 3.47Å; G314-A318 PolarHBondContact O-N 3.34Å; G314-A318 VanDerWaalsContact O-N 3.07Å; G314-E437 VanDerWaalsContact CA-O 3.25Å; G314-E437 WeakPolarHBondContact CA-O 3.5Å |
| 315 | M | 97.4 | Very high | 95.6 | Very high | 2 Ų | 2 | 8.2 Ų | 8.2 | 1% | 0.01 | 5% | 0.045 | C | C | . | . | H | α-helix | trans | -68.9 | -39.5 | -178.5 | -65.6 | 170.1 | 71.8 | 0 | 0 | 112.4 | V311 F312 A318 F319 G440 I443 A444 Y447 I459 L460 V463 | V311-M315 HydrophobicContact CG1-CG 4.25Å; V311-M315 HydrophobicContact CG1-SD 3.65Å; V311-M315 WeakPolarHBondContact O-CG 3.46Å; V311-M315 PolarHBondContact O-N 2.92Å; F312-M315 PolarHBondContact O-N 3.18Å; M315-A318 PolarHBondContact O-N 2.91Å; M315-F319 WeakPolarHBondContact O-CB 3.25Å; M315-F319 PolarHBondContact O-N 3.3Å; M315-G440 VanDerWaalsContact CG-O 3.3Å; M315-G440 WeakPolarHBondContact CG-O 3.45Å; M315-I443 HydrophobicContact CE-CG2 4.3Å; M315-I443 HydrophobicContact SD-CG2 4.48Å; M315-A444 HydrophobicContact CB-CB 4.29Å; M315-A444 HydrophobicContact CG-CB 4.29Å; M315-Y447 HydrophobicContact CE-CE1 4.36Å; M315-Y447 WeakPolarHBondContact CE-OH 3.45Å; M315-I459 HydrophobicContact CE-CG2 3.59Å; M315-L460 HydrophobicContact CB-CD2 3.63Å; M315-L460 HydrophobicContact CE-CD2 4.35Å; M315-V463 HydrophobicContact CE-CG2 4.1Å; M315-V463 HydrophobicContact SD-CB 4.33Å; M315-V463 HydrophobicContact SD-CG1 4.06Å; M315-V463 HydrophobicContact SD-CG2 4.09Å |
| 316 | E | 96.8 | Very high | 95.5 | Very high | 0 Ų | 0 | 6 Ų | 6 | 0% | 0 | 3% | 0.034 | C | C | . | . | H | α-helix | trans | -69.1 | -38.3 | 178.4 | 63.1 | 122.9 | 158.4 | 0 | 0 | 112.4 | F312 I313 A318 F319 I320 H376 W403 W410 | F312-E316 HydrophobicContact CD1-CG 4.34Å; F312-E316 HydrophobicContact CE1-CB 4.23Å; F312-E316 HydrophobicContact CE1-CG 4.02Å; F312-E316 HydrophobicContact CE2-CB 4.3Å; F312-E316 HydrophobicContact CZ-CB 3.99Å; F312-E316 HydrophobicContact CZ-CG 4.3Å; F312-E316 VanDerWaalsContact O-CG 3.24Å; F312-E316 WeakPolarHBondContact O-CG 3.43Å; F312-E316 PolarHBondContact O-N 3.39Å; I313-E316 WeakPolarHBondContact O-CG 3.45Å; E316-A318 VanDerWaalsContact C-N 3.34Å; E316-A318 PolarHBondContact O-N 2.84Å; E316-F319 WeakPolarHBondContact O-CB 3.49Å; E316-F319 PolarHBondContact O-N 3.01Å; E316-I320 WeakPolarHBondContact O-CG2 3.38Å; E316-I320 PolarHBondContact O-N 3.31Å; E316-H376 IonicContact OE1-CE1 2.92Å; E316-H376 IonicContact OE2-CE1 3.07Å; E316-H376 PolarHBondContact OE2-CE1 2.97Å; E316-H376 IonicContact OE2-ND1 3.15Å; E316-H376 IonicContact OE2-NE2 2.67Å; E316-W403 HydrophobicContact CB-CH2 4.45Å; E316-W403 HydrophobicContact CB-CZ3 3.73Å; E316-W410 VanDerWaalsContact OE1-CD1 3.31Å |
| 317 | Q | 94.8 | Very high | 95.4 | Very high | 33 Ų | 33 | 6 Ų | 6 | 15% | 0.154 | 3% | 0.034 | C | C | . | . | H | α-helix | trans | -65.5 | -37.5 | 173.1 | -74.3 | 171.4 | 22 | 0 | 0 | 112.2 | I313 I320 G321 D407 F441 | I313-Q317 WeakPolarHBondContact O-CG 3.38Å; I313-Q317 PolarHBondContact O-N 2.98Å; Q317-I320 WeakPolarHBondContact O-CG2 3.33Å; Q317-G321 PolarHBondContact O-N 2.81Å; Q317-G321 VanDerWaalsContact O-N 3.08Å; Q317-D407 WeakPolarHBondContact CG-OD1 3.32Å; Q317-D407 PolarHBondContact NE2-OD1 3.29Å; Q317-F441 HydrophobicContact CB-CE1 3.66Å; Q317-F441 HydrophobicContact CB-CE2 4.15Å; Q317-F441 HydrophobicContact CB-CZ 3.33Å; Q317-F441 HydrophobicContact CG-CZ 4.26Å |
| 318 | A | 95.1 | Very high | 95.3 | Very high | 0 Ų | 0 | 4.6 Ų | 4.6 | 0% | 0 | 3% | 0.026 | C | C | . | . | H | α-helix | trans | -65.6 | -41.1 | 172.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | G314 M315 E316 A322 F441 A444 Y445 | G314-A318 WeakPolarHBondContact O-CB 3.47Å; G314-A318 PolarHBondContact O-N 3.34Å; G314-A318 VanDerWaalsContact O-N 3.07Å; M315-A318 PolarHBondContact O-N 2.91Å; E316-A318 VanDerWaalsContact C-N 3.34Å; E316-A318 PolarHBondContact O-N 2.84Å; A318-A322 WeakPolarHBondContact O-CB 3.49Å; A318-A322 PolarHBondContact O-N 2.92Å; A318-F441 HydrophobicContact CB-CD1 3.72Å; A318-F441 HydrophobicContact CB-CE1 4.25Å; A318-A444 HydrophobicContact CB-CB 3.48Å; A318-A444 VanDerWaalsContact CB-CB 3.48Å; A318-Y445 HydrophobicContact CB-CD1 4.25Å; A318-Y445 HydrophobicContact CB-CE1 3.75Å; A318-Y445 HydrophobicContact CB-CE2 4.13Å |
| 319 | F | 96.5 | Very high | 95.2 | Very high | 2 Ų | 2 | 3.3 Ų | 3.3 | 1% | 0.009 | 2% | 0.018 | C | C | . | . | I | π-helix | trans | -63 | -53.6 | 178 | 178.3 | -94.8 | 0 | 0 | 0 | 111.2 | M315 E316 G321 A322 D323 F324 Y328 E383 W403 T453 L457 L460 | M315-F319 WeakPolarHBondContact O-CB 3.25Å; M315-F319 PolarHBondContact O-N 3.3Å; E316-F319 WeakPolarHBondContact O-CB 3.49Å; E316-F319 PolarHBondContact O-N 3.01Å; F319-G321 VanDerWaalsContact C-N 3.3Å; F319-G321 PolarHBondContact O-N 3.25Å; F319-A322 PolarHBondContact O-N 3.35Å; F319-D323 HydrophobicContact CD2-CB 3.52Å; F319-D323 HydrophobicContact CE2-CB 3.72Å; F319-D323 HydrophobicContact CG-CB 4.26Å; F319-D323 CarbonylContact O-C 3.55Å; F319-D323 WeakPolarHBondContact O-CA 3.41Å; F319-D323 PolarHBondContact O-N 2.84Å; F319-F324 HydrophobicContact CD1-CB 4.38Å; F319-F324 HydrophobicContact CE1-CB 4.04Å; F319-F324 PolarHBondContact O-N 3.28Å; F319-Y328 HydrophobicContact CZ-CE2 4.19Å; F319-E383 VanDerWaalsContact CE1-OE2 3.26Å; F319-E383 WeakPolarHBondContact CE1-OE2 3.46Å; F319-W403 AromaticContact CD1-CH2 3.93Å; F319-W403 HydrophobicContact CD1-CH2 3.93Å; F319-W403 AromaticContact CD1-CZ2 3.61Å; F319-W403 HydrophobicContact CD1-CZ2 3.61Å; F319-W403 HydrophobicContact CE1-CH2 4.34Å; F319-W403 AromaticContact CE1-CZ2 3.61Å; F319-W403 HydrophobicContact CE1-CZ2 3.61Å; F319-T453 HydrophobicContact CE2-CG2 4.25Å; F319-L457 HydrophobicContact CD2-CD2 4.36Å; F319-L457 HydrophobicContact CE1-CD2 4.02Å; F319-L457 HydrophobicContact CE2-CD2 3.49Å; F319-L457 VanDerWaalsContact CE2-CD2 3.49Å; F319-L457 HydrophobicContact CE2-CG 4.25Å; F319-L457 HydrophobicContact CZ-CD2 3.3Å; F319-L457 HydrophobicContact CZ-CG 4.3Å; F319-L460 HydrophobicContact CB-CD1 3.81Å; F319-L460 HydrophobicContact CD1-CD1 4.19Å; F319-L460 HydrophobicContact CD2-CD1 3.62Å; F319-L460 HydrophobicContact CE2-CD1 4.27Å; F319-L460 HydrophobicContact CG-CD1 3.58Å |
| 320 | I | 95.8 | Very high | 94.8 | Very high | 3 Ų | 3 | 3.3 Ų | 3.3 | 2% | 0.015 | 2% | 0.019 | C | C | . | . | I | π-helix | trans | -62.7 | -37.7 | -179.5 | -168.8 | 61.5 | 0 | 0 | 0 | 111.8 | E316 Q317 F324 T325 M342 F345 W403 | E316-I320 WeakPolarHBondContact O-CG2 3.38Å; E316-I320 PolarHBondContact O-N 3.31Å; Q317-I320 WeakPolarHBondContact O-CG2 3.33Å; I320-F324 HydrophobicContact CD1-CB 3.9Å; I320-F324 HydrophobicContact CD1-CD1 3.41Å; I320-F324 VanDerWaalsContact CD1-CD1 3.41Å; I320-F324 HydrophobicContact CD1-CD2 4.36Å; I320-F324 HydrophobicContact CD1-CE1 3.95Å; I320-F324 HydrophobicContact CD1-CG 3.64Å; I320-T325 WeakPolarHBondContact O-CG2 3.34Å; I320-M342 HydrophobicContact CG1-CE 4.1Å; I320-M342 HydrophobicContact CG1-SD 4.24Å; I320-F345 HydrophobicContact CG1-CD2 4.06Å; I320-F345 HydrophobicContact CG1-CE2 4.29Å; I320-F345 HydrophobicContact CG2-CE2 4.24Å; I320-F345 HydrophobicContact CG2-CZ 4.31Å; I320-W403 HydrophobicContact CD1-CB 3.91Å; I320-W403 HydrophobicContact CD1-CD2 4.37Å; I320-W403 HydrophobicContact CD1-CG 3.73Å; I320-W403 HydrophobicContact CG1-CB 4.22Å; I320-W403 HydrophobicContact CG1-CG 4.37Å |
| 321 | G | 91.8 | Very high | 94.5 | Very high | 6 Ų | 6 | 3.4 Ų | 3.4 | 6% | 0.062 | 2% | 0.019 | C | C | . | . | I | π-helix | trans | -80.2 | -18.2 | -177.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | Q317 F319 T325 | Q317-G321 PolarHBondContact O-N 2.81Å; Q317-G321 VanDerWaalsContact O-N 3.08Å; F319-G321 VanDerWaalsContact C-N 3.3Å; F319-G321 PolarHBondContact O-N 3.25Å; G321-T325 PolarHBondContact O-OG1 3.39Å |
| 322 | A | 92.1 | Very high | 94.1 | Very high | 0 Ų | 0 | 2.9 Ų | 2.9 | 0% | 0 | 2% | 0.016 | C | C | . | . | I | π-helix | trans | -130 | -55.7 | -177.1 | 0 | 0 | 0 | 0 | 0 | 114.2 | S68 T78 A318 F319 T325 Q326 Y445 | S68-A322 WeakPolarHBondContact CB-O 3.2Å; S68-A322 WeakPolarHBondContact OG-CA 3.01Å; S68-A322 PolarHBondContact OG-O 3.4Å; T78-A322 HydrophobicContact CG2-CB 4.29Å; A318-A322 WeakPolarHBondContact O-CB 3.49Å; A318-A322 PolarHBondContact O-N 2.92Å; F319-A322 PolarHBondContact O-N 3.35Å; A322-T325 WeakPolarHBondContact CA-OG1 3.44Å; A322-T325 PolarHBondContact O-OG1 3.04Å; A322-Q326 WeakPolarHBondContact O-CB 3.44Å; A322-Q326 PolarHBondContact O-N 3.01Å; A322-Y445 HydrophobicContact CB-CD1 4.4Å; A322-Y445 HydrophobicContact CB-CE1 3.64Å |
| 323 | D | 93.6 | Very high | 93.7 | Very high | 4 Ų | 4 | 4.3 Ų | 4.3 | 2% | 0.021 | 2% | 0.024 | C | C | . | . | I | π-helix | trans | -76 | -43.3 | -174.2 | -70.4 | -60.9 | 0 | 0 | 0 | 111.5 | F319 Q326 A327 K456 | F319-D323 HydrophobicContact CD2-CB 3.52Å; F319-D323 HydrophobicContact CE2-CB 3.72Å; F319-D323 HydrophobicContact CG-CB 4.26Å; F319-D323 CarbonylContact O-C 3.55Å; F319-D323 WeakPolarHBondContact O-CA 3.41Å; F319-D323 PolarHBondContact O-N 2.84Å; D323-Q326 PolarHBondContact O-N 3.36Å; D323-A327 WeakPolarHBondContact O-CA 3.3Å; D323-A327 WeakPolarHBondContact O-CB 3.28Å; D323-A327 PolarHBondContact O-N 2.87Å; D323-K456 WeakPolarHBondContact OD1-CD 3.42Å; D323-K456 IonicContact OD1-NZ 3.99Å; D323-K456 PolarHBondContact OD1-NZ 3.21Å |
| 324 | F | 95.6 | Very high | 93.2 | Very high | 0 Ų | 0 | 5.4 Ų | 5.4 | 0% | 0 | 4% | 0.035 | C | C | . | . | I | π-helix | trans | -64.8 | -46.8 | 175.9 | 179.4 | -98.7 | 0 | 0 | 0 | 111.4 | F319 I320 Q326 Y328 V329 V341 E383 M399 | F319-F324 HydrophobicContact CD1-CB 4.38Å; F319-F324 HydrophobicContact CE1-CB 4.04Å; F319-F324 PolarHBondContact O-N 3.28Å; I320-F324 HydrophobicContact CD1-CB 3.9Å; I320-F324 HydrophobicContact CD1-CD1 3.41Å; I320-F324 VanDerWaalsContact CD1-CD1 3.41Å; I320-F324 HydrophobicContact CD1-CD2 4.36Å; I320-F324 HydrophobicContact CD1-CE1 3.95Å; I320-F324 HydrophobicContact CD1-CG 3.64Å; F324-Q326 VanDerWaalsContact C-N 3.29Å; F324-Q326 PolarHBondContact O-N 2.87Å; F324-Y328 HydrophobicContact CD2-CD2 4.04Å; F324-Y328 HydrophobicContact CD2-CG 4.04Å; F324-Y328 HydrophobicContact CE2-CG 4.28Å; F324-Y328 WeakPolarHBondContact O-CB 3.43Å; F324-Y328 PolarHBondContact O-N 3.12Å; F324-Y328 VanDerWaalsContact O-N 3.11Å; F324-V329 HydrophobicContact CD1-CG2 3.86Å; F324-V329 HydrophobicContact CE1-CG2 3.5Å; F324-V329 VanDerWaalsContact CE1-CG2 3.5Å; F324-V329 HydrophobicContact CZ-CG2 4.06Å; F324-V329 PolarHBondContact O-N 3.03Å; F324-V329 VanDerWaalsContact O-N 3.1Å; F324-V341 HydrophobicContact CE1-CG1 3.85Å; F324-V341 HydrophobicContact CZ-CG1 4.47Å; F324-E383 WeakPolarHBondContact CD2-OE1 3.37Å; F324-M399 HydrophobicContact CE2-CB 4.2Å; F324-M399 HydrophobicContact CE2-SD 4.49Å; F324-M399 HydrophobicContact CZ-CB 4.14Å |
| 325 | T | 94.1 | Very high | 92.9 | Very high | 0 Ų | 0 | 5.5 Ų | 5.5 | 0% | 0 | 4% | 0.036 | C | C | . | . | I | π-helix | trans | -60.6 | -39.3 | 177.4 | 52.9 | 0 | 0 | 0 | 0 | 111.7 | N65 S68 I320 G321 A322 A330 I338 M342 | N65-T325 PolarHBondContact O-OG1 3.49Å; S68-T325 PolarHBondContact OG-OG1 2.82Å; I320-T325 WeakPolarHBondContact O-CG2 3.34Å; G321-T325 PolarHBondContact O-OG1 3.39Å; A322-T325 WeakPolarHBondContact CA-OG1 3.44Å; A322-T325 PolarHBondContact O-OG1 3.04Å; T325-A330 WeakPolarHBondContact O-CB 3.34Å; T325-A330 PolarHBondContact O-N 3.35Å; T325-I338 HydrophobicContact CG2-CG2 3.64Å; T325-M342 HydrophobicContact CG2-CG 3.88Å; T325-M342 HydrophobicContact CG2-SD 3.82Å |
| 326 | Q | 91.8 | Very high | 92.4 | Very high | 4 Ų | 4 | 6.5 Ų | 6.5 | 2% | 0.019 | 4% | 0.041 | C | C | . | . | I | π-helix | trans | -81.1 | -56.5 | -179.2 | -172.2 | -178.9 | 8.5 | 0 | 0 | 113.1 | S68 F225 L236 A322 D323 F324 C331 | S68-Q326 VanDerWaalsContact O-CD 3.22Å; S68-Q326 PolarHBondContact O-NE2 3.07Å; S68-Q326 PolarHBondContact O-OE1 3.28Å; F225-Q326 HydrophobicContact CE1-CG 4.11Å; F225-Q326 HydrophobicContact CZ-CG 3.84Å; L236-Q326 HydrophobicContact CD1-CG 3.72Å; L236-Q326 HydrophobicContact CD2-CG 4.29Å; A322-Q326 WeakPolarHBondContact O-CB 3.44Å; A322-Q326 PolarHBondContact O-N 3.01Å; D323-Q326 PolarHBondContact O-N 3.36Å; F324-Q326 VanDerWaalsContact C-N 3.29Å; F324-Q326 PolarHBondContact O-N 2.87Å; Q326-C331 WeakPolarHBondContact O-CB 3.44Å; Q326-C331 PolarHBondContact O-N 3.49Å; Q326-C331 VanDerWaalsContact O-N 3.16Å |
| 327 | A | 92.9 | Very high | 92.1 | Very high | 0 Ų | 0 | 10 Ų | 10 | 0% | 0 | 6% | 0.056 | C | C | . | . | I | π-helix | trans | -77.2 | -30.1 | -169.5 | 0 | 0 | 0 | 0 | 0 | 113.5 | G222 F225 D323 C331 T453 | G222-A327 PolarHBondContact N-O 2.82Å; F225-A327 HydrophobicContact CB-CB 3.55Å; F225-A327 HydrophobicContact CD1-CB 3.68Å; F225-A327 HydrophobicContact CD2-CB 4.24Å; F225-A327 HydrophobicContact CE1-CB 4.47Å; F225-A327 HydrophobicContact CG-CB 3.56Å; D323-A327 WeakPolarHBondContact O-CA 3.3Å; D323-A327 WeakPolarHBondContact O-CB 3.28Å; D323-A327 PolarHBondContact O-N 2.87Å; A327-C331 WeakPolarHBondContact O-CB 3.24Å; A327-T453 HydrophobicContact CB-CG2 4.16Å; A327-T453 WeakPolarHBondContact CB-OG1 3.29Å |
| 328 | Y | 94.2 | Very high | 92 | Very high | 0 Ų | 0 | 8.4 Ų | 8.4 | 0% | 0 | 5% | 0.049 | C | C | . | . | I | π-helix | trans | -103.4 | -61.6 | -178.9 | -65.2 | -104.1 | 0 | 0 | 0 | 110.2 | G222 A223 F319 F324 A332 E383 W386 P388 F396 T453 L457 | G222-Y328 VanDerWaalsContact CA-CE1 3.44Å; G222-Y328 VanDerWaalsContact CA-CZ 3.49Å; A223-Y328 PolarHBondContact N-OH 2.93Å; F319-Y328 HydrophobicContact CZ-CE2 4.19Å; F324-Y328 HydrophobicContact CD2-CD2 4.04Å; F324-Y328 HydrophobicContact CD2-CG 4.04Å; F324-Y328 HydrophobicContact CE2-CG 4.28Å; F324-Y328 WeakPolarHBondContact O-CB 3.43Å; F324-Y328 PolarHBondContact O-N 3.12Å; F324-Y328 VanDerWaalsContact O-N 3.11Å; Y328-A332 WeakPolarHBondContact O-CB 3.29Å; Y328-A332 PolarHBondContact O-N 3.45Å; Y328-E383 HydrophobicContact CE1-CB 4.1Å; Y328-E383 HydrophobicContact CE1-CG 4.18Å; Y328-E383 PolarHBondContact OH-O 3.34Å; Y328-W386 HydrophobicContact CD1-CE3 4.27Å; Y328-W386 HydrophobicContact CD1-CZ3 4.07Å; Y328-W386 HydrophobicContact CE1-CE3 4.47Å; Y328-P388 HydrophobicContact CD1-CG 3.59Å; Y328-P388 HydrophobicContact CE1-CG 4.19Å; Y328-P388 HydrophobicContact CG-CG 4.23Å; Y328-F396 WeakPolarHBondContact O-CE1 3.44Å; Y328-T453 HydrophobicContact CE2-CG2 3.72Å; Y328-L457 WeakPolarHBondContact OH-CD1 3.38Å |
| 329 | V | 93.9 | Very high | 91.9 | Very high | 0 Ų | 0 | 8.5 Ų | 8.5 | 0% | 0 | 5% | 0.049 | C | C | . | . | I | π-helix | trans | -72.2 | -60.5 | -169.8 | -174.9 | 0 | 0 | 0 | 0 | 111.4 | F324 C331 A332 L333 G334 K337 I338 V341 F396 | F324-V329 HydrophobicContact CD1-CG2 3.86Å; F324-V329 HydrophobicContact CE1-CG2 3.5Å; F324-V329 VanDerWaalsContact CE1-CG2 3.5Å; F324-V329 HydrophobicContact CZ-CG2 4.06Å; F324-V329 PolarHBondContact O-N 3.03Å; F324-V329 VanDerWaalsContact O-N 3.1Å; V329-C331 VanDerWaalsContact C-N 3.35Å; V329-C331 PolarHBondContact O-N 3.37Å; V329-A332 PolarHBondContact O-N 3.3Å; V329-L333 HydrophobicContact CG1-CD1 4.42Å; V329-L333 WeakPolarHBondContact O-CA 3.31Å; V329-L333 WeakPolarHBondContact O-CB 3.34Å; V329-L333 PolarHBondContact O-N 2.78Å; V329-G334 PolarHBondContact O-N 3.06Å; V329-K337 HydrophobicContact CG1-CB 4.43Å; V329-I338 HydrophobicContact CG1-CG1 4.14Å; V329-V341 HydrophobicContact CG1-CB 4.28Å; V329-V341 HydrophobicContact CG1-CG2 3.89Å; V329-V341 HydrophobicContact CG2-CB 4.31Å; V329-V341 HydrophobicContact CG2-CG1 3.95Å; V329-V341 HydrophobicContact CG2-CG2 4.37Å; V329-F396 HydrophobicContact CG2-CD1 4.22Å |
| 330 | A | 90.8 | Very high | 91.7 | Very high | 1 Ų | 1 | 11 Ų | 11 | 1% | 0.008 | 6% | 0.06 | C | C | . | . | I | π-helix | trans | -63.4 | -42 | -176 | 0 | 0 | 0 | 0 | 0 | 111.9 | L236 T325 A332 G334 V335 I338 | L236-A330 HydrophobicContact CD2-CB 3.5Å; T325-A330 WeakPolarHBondContact O-CB 3.34Å; T325-A330 PolarHBondContact O-N 3.35Å; A330-A332 VanDerWaalsContact C-N 3.33Å; A330-A332 PolarHBondContact O-N 2.84Å; A330-G334 VanDerWaalsContact O-CA 3.25Å; A330-G334 WeakPolarHBondContact O-CA 3.41Å; A330-G334 PolarHBondContact O-N 2.88Å; A330-V335 HydrophobicContact CB-CG2 4.21Å; A330-I338 HydrophobicContact CB-CD1 3.96Å; A330-I338 HydrophobicContact CB-CG1 4.27Å |
| 331 | C | 89.2 | Confident | 91.7 | Very high | 1 Ų | 1 | 10.8 Ų | 10.8 | 1% | 0.007 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -61.1 | -36.5 | 179.8 | -167.3 | 0 | 0 | 0 | 0 | 113.5 | C221 Q326 A327 V329 | C221-C331 WeakPolarHBondContact CA-SG 3.24Å; C221-C331 HydrophobicContact CB-CB 3.8Å; C221-C331 WeakPolarHBondContact CB-SG 3.37Å; C221-C331 WeakPolarHBondContact SG-CB 3.29Å; C221-C331 PolarHBondContact SG-O 2.97Å; C221-C331 VanDerWaalsContact SG-O 3.35Å; C221-C331 CovalentContact SG-SG 2.04Å; C221-C331 PolarHBondContact SG-SG 3.1Å; Q326-C331 WeakPolarHBondContact O-CB 3.44Å; Q326-C331 PolarHBondContact O-N 3.49Å; Q326-C331 VanDerWaalsContact O-N 3.16Å; A327-C331 WeakPolarHBondContact O-CB 3.24Å; V329-C331 VanDerWaalsContact C-N 3.35Å; V329-C331 PolarHBondContact O-N 3.37Å |
| 332 | A | 89.6 | Confident | 91.9 | Very high | 4 Ų | 4 | 10.6 Ų | 10.6 | 3% | 0.033 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -103.9 | -34.2 | -175.7 | 0 | 0 | 0 | 0 | 0 | 114.5 | L218 Y328 V329 A330 P388 F396 | L218-A332 HydrophobicContact CD2-CB 4.05Å; Y328-A332 WeakPolarHBondContact O-CB 3.29Å; Y328-A332 PolarHBondContact O-N 3.45Å; V329-A332 PolarHBondContact O-N 3.3Å; A330-A332 VanDerWaalsContact C-N 3.33Å; A330-A332 PolarHBondContact O-N 2.84Å; A332-P388 HydrophobicContact CB-CB 3.62Å; A332-F396 HydrophobicContact CB-CE1 4.14Å; A332-F396 HydrophobicContact CB-CZ 3.82Å |
| 333 | L | 88.4 | Confident | 92 | Very high | 31 Ų | 31 | 12 Ų | 12 | 16% | 0.162 | 6% | 0.064 | C | C | . | . | H | α-helix | trans | -110.6 | -12.5 | -174.4 | -61.4 | -178.6 | 0 | 0 | 0 | 113.8 | V329 K337 P390 P393 F396 | V329-L333 HydrophobicContact CG1-CD1 4.42Å; V329-L333 WeakPolarHBondContact O-CA 3.31Å; V329-L333 WeakPolarHBondContact O-CB 3.34Å; V329-L333 PolarHBondContact O-N 2.78Å; L333-K337 HydrophobicContact CB-CB 3.86Å; L333-K337 HydrophobicContact CB-CG 3.99Å; L333-K337 HydrophobicContact CD1-CB 4.47Å; L333-K337 WeakPolarHBondContact O-CG 3.34Å; L333-P390 HydrophobicContact CD2-CB 4Å; L333-P393 HydrophobicContact CD2-CB 4.38Å; L333-F396 HydrophobicContact CD1-CB 4.1Å; L333-F396 HydrophobicContact CD1-CD1 3.95Å; L333-F396 HydrophobicContact CD1-CD2 3.67Å; L333-F396 HydrophobicContact CD1-CE1 4.22Å; L333-F396 HydrophobicContact CD1-CE2 3.95Å; L333-F396 HydrophobicContact CD1-CG 3.64Å; L333-F396 HydrophobicContact CD1-CZ 4.21Å; L333-F396 HydrophobicContact CD2-CD2 4.48Å; L333-F396 HydrophobicContact CD2-CE2 4.05Å; L333-F396 HydrophobicContact CD2-CZ 4.34Å; L333-F396 HydrophobicContact CG-CD1 4.43Å; L333-F396 HydrophobicContact CG-CD2 4.25Å; L333-F396 HydrophobicContact CG-CE1 4.21Å; L333-F396 HydrophobicContact CG-CE2 4.01Å; L333-F396 HydrophobicContact CG-CG 4.44Å; L333-F396 HydrophobicContact CG-CZ 3.97Å |
| 334 | G | 87.7 | Confident | 92 | Very high | 22 Ų | 22 | 13.5 Ų | 13.5 | 23% | 0.227 | 7% | 0.074 | C | C | . | . | trans | 90.7 | 159.7 | -174.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | V329 A330 N336 K337 | V329-G334 PolarHBondContact O-N 3.06Å; A330-G334 VanDerWaalsContact O-CA 3.25Å; A330-G334 WeakPolarHBondContact O-CA 3.41Å; A330-G334 PolarHBondContact O-N 2.88Å; G334-N336 VanDerWaalsContact C-N 3.3Å; G334-N336 PolarHBondContact O-N 3.34Å; G334-K337 PolarHBondContact O-N 3.42Å | ||
| 335 | V | 88.5 | Confident | 91.9 | Very high | 3 Ų | 3 | 14.2 Ų | 14.2 | 2% | 0.018 | 8% | 0.077 | C | C | . | . | G | 310 helix | trans | -65.2 | -33.9 | -175.6 | -179.1 | 0 | 0 | 0 | 0 | 111.9 | L66 I70 L198 P239 A330 K337 I338 | L66-V335 HydrophobicContact CD2-CG1 4.06Å; I70-V335 HydrophobicContact CG2-CG1 3.84Å; L198-V335 HydrophobicContact CD1-CG1 4.11Å; P239-V335 HydrophobicContact CG-CB 4.41Å; P239-V335 HydrophobicContact CG-CG1 4.04Å; A330-V335 HydrophobicContact CB-CG2 4.21Å; V335-K337 PolarHBondContact O-N 3.46Å; V335-K337 VanDerWaalsContact O-N 3.16Å; V335-I338 HydrophobicContact CB-CD1 4.27Å; V335-I338 HydrophobicContact CG1-CD1 3.83Å; V335-I338 WeakPolarHBondContact O-CB 3.41Å; V335-I338 WeakPolarHBondContact O-CG1 3.37Å; V335-I338 PolarHBondContact O-N 3.38Å; V335-I338 VanDerWaalsContact O-N 3.15Å |
| 336 | N | 88 | Confident | 91.8 | Very high | 22 Ų | 22 | 14.4 Ų | 14.4 | 12% | 0.118 | 8% | 0.079 | C | C | . | . | G | 310 helix | trans | -61 | -19.4 | 176.3 | 62.8 | -24.2 | 0 | 0 | 0 | 114.1 | L198 G334 | L198-N336 HydrophobicContact CB-CB 3.73Å; G334-N336 VanDerWaalsContact C-N 3.3Å; G334-N336 PolarHBondContact O-N 3.34Å |
| 337 | K | 90.4 | Very high | 91.8 | Very high | 74 Ų | 74 | 17 Ų | 17 | 32% | 0.322 | 10% | 0.095 | S | C | . | . | G | 310 helix | trans | -92.4 | -10.3 | 177.6 | -61.7 | -54.8 | -174.5 | -171.6 | 0 | 114.6 | V329 L333 G334 V335 G339 F340 V341 | V329-K337 HydrophobicContact CG1-CB 4.43Å; L333-K337 HydrophobicContact CB-CB 3.86Å; L333-K337 HydrophobicContact CB-CG 3.99Å; L333-K337 HydrophobicContact CD1-CB 4.47Å; L333-K337 WeakPolarHBondContact O-CG 3.34Å; G334-K337 PolarHBondContact O-N 3.42Å; V335-K337 PolarHBondContact O-N 3.46Å; V335-K337 VanDerWaalsContact O-N 3.16Å; K337-G339 PolarHBondContact O-N 3.1Å; K337-F340 HydrophobicContact CD-CD2 3.95Å; K337-F340 HydrophobicContact CD-CE2 4.46Å; K337-F340 PolarHBondContact O-N 2.95Å; K337-V341 PolarHBondContact O-N 2.68Å; K337-V341 VanDerWaalsContact O-N 3.15Å |
| 338 | I | 92.4 | Very high | 91.8 | Very high | 0 Ų | 0 | 18.8 Ų | 18.8 | 0% | 0 | 11% | 0.106 | C | C | . | . | H | α-helix | trans | -54.8 | -52.9 | -178 | -66.9 | 171.7 | 0 | 0 | 0 | 111.2 | N65 L66 S69 T325 V329 A330 V335 F340 V341 M342 | N65-I338 HydrophobicContact CB-CG2 4.43Å; L66-I338 HydrophobicContact CD2-CB 4.12Å; L66-I338 HydrophobicContact CD2-CD1 3.94Å; L66-I338 HydrophobicContact CD2-CG2 4.2Å; S69-I338 WeakPolarHBondContact OG-CD1 3.38Å; T325-I338 HydrophobicContact CG2-CG2 3.64Å; V329-I338 HydrophobicContact CG1-CG1 4.14Å; A330-I338 HydrophobicContact CB-CD1 3.96Å; A330-I338 HydrophobicContact CB-CG1 4.27Å; V335-I338 HydrophobicContact CB-CD1 4.27Å; V335-I338 HydrophobicContact CG1-CD1 3.83Å; V335-I338 WeakPolarHBondContact O-CB 3.41Å; V335-I338 WeakPolarHBondContact O-CG1 3.37Å; V335-I338 PolarHBondContact O-N 3.38Å; V335-I338 VanDerWaalsContact O-N 3.15Å; I338-F340 PolarHBondContact O-N 3.37Å; I338-V341 PolarHBondContact O-N 2.9Å; I338-M342 HydrophobicContact CG2-CG 4.22Å; I338-M342 WeakPolarHBondContact O-CG 3.41Å; I338-M342 PolarHBondContact O-N 2.67Å |
| 339 | G | 92.3 | Very high | 91.7 | Very high | 1 Ų | 1 | 19 Ų | 19 | 1% | 0.01 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -68.4 | -36.2 | -174.9 | 0 | 0 | 0 | 0 | 0 | 112.5 | N191 S195 K337 V341 M342 I343 | N191-G339 WeakPolarHBondContact CB-O 3.48Å; S195-G339 WeakPolarHBondContact OG-CA 3.28Å; S195-G339 PolarHBondContact OG-N 3.08Å; K337-G339 PolarHBondContact O-N 3.1Å; G339-V341 VanDerWaalsContact C-N 3.3Å; G339-V341 PolarHBondContact O-N 2.95Å; G339-M342 PolarHBondContact O-N 2.75Å; G339-I343 VanDerWaalsContact O-CG1 3.25Å; G339-I343 WeakPolarHBondContact O-CG1 3.41Å; G339-I343 PolarHBondContact O-N 3.14Å |
| 340 | F | 93.3 | Very high | 91.4 | Very high | 54 Ų | 54 | 20.4 Ų | 20.4 | 24% | 0.237 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -59.2 | -42 | 174 | -67.6 | -57.5 | 0 | 0 | 0 | 112.2 | S195 S199 K337 I338 Y397 | S195-F340 PolarHBondContact OG-N 3.38Å; S199-F340 WeakPolarHBondContact OG-CE2 3.23Å; K337-F340 HydrophobicContact CD-CD2 3.95Å; K337-F340 HydrophobicContact CD-CE2 4.46Å; K337-F340 PolarHBondContact O-N 2.95Å; I338-F340 PolarHBondContact O-N 3.37Å; F340-Y397 HydrophobicContact CB-CE1 3.98Å; F340-Y397 WeakPolarHBondContact O-CE1 3.24Å |
| 341 | V | 95.4 | Very high | 91.4 | Very high | 0 Ų | 0 | 25.8 Ų | 25.8 | 0% | 0 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -65.8 | -47.4 | 176 | 175.3 | 0 | 0 | 0 | 0 | 110.3 | F324 V329 K337 I338 G339 I343 C344 F396 Y397 S400 | F324-V341 HydrophobicContact CE1-CG1 3.85Å; F324-V341 HydrophobicContact CZ-CG1 4.47Å; V329-V341 HydrophobicContact CG1-CB 4.28Å; V329-V341 HydrophobicContact CG1-CG2 3.89Å; V329-V341 HydrophobicContact CG2-CB 4.31Å; V329-V341 HydrophobicContact CG2-CG1 3.95Å; V329-V341 HydrophobicContact CG2-CG2 4.37Å; K337-V341 PolarHBondContact O-N 2.68Å; K337-V341 VanDerWaalsContact O-N 3.15Å; I338-V341 PolarHBondContact O-N 2.9Å; G339-V341 VanDerWaalsContact C-N 3.3Å; G339-V341 PolarHBondContact O-N 2.95Å; V341-I343 VanDerWaalsContact C-N 3.29Å; V341-I343 PolarHBondContact O-N 3.32Å; V341-C344 WeakPolarHBondContact O-CB 3.36Å; V341-C344 PolarHBondContact O-N 3.38Å; V341-F396 HydrophobicContact CG1-CB 4.44Å; V341-F396 HydrophobicContact CG2-CB 4.14Å; V341-Y397 HydrophobicContact CG2-CD1 4.22Å; V341-Y397 HydrophobicContact CG2-CE1 3.96Å; V341-Y397 HydrophobicContact CG2-CE2 4.42Å; V341-S400 VanDerWaalsContact CG1-CB 3.46Å; V341-S400 PolarHBondContact O-OG 2.79Å |
| 342 | M | 95 | Very high | 91.5 | Very high | 2 Ų | 2 | 26.4 Ų | 26.4 | 1% | 0.01 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -68 | -22.7 | -178.7 | -67.5 | -56.9 | -68.5 | 0 | 0 | 114.3 | N65 N191 I320 T325 I338 G339 C344 F345 G346 | N65-M342 HydrophobicContact CB-CG 4.47Å; N191-M342 HydrophobicContact CB-CB 4.48Å; I320-M342 HydrophobicContact CG1-CE 4.1Å; I320-M342 HydrophobicContact CG1-SD 4.24Å; T325-M342 HydrophobicContact CG2-CG 3.88Å; T325-M342 HydrophobicContact CG2-SD 3.82Å; I338-M342 HydrophobicContact CG2-CG 4.22Å; I338-M342 WeakPolarHBondContact O-CG 3.41Å; I338-M342 PolarHBondContact O-N 2.67Å; G339-M342 PolarHBondContact O-N 2.75Å; M342-C344 PolarHBondContact O-N 2.79Å; M342-F345 HydrophobicContact CE-CB 4.43Å; M342-F345 HydrophobicContact CE-CD1 3.99Å; M342-F345 HydrophobicContact CE-CG 4.28Å; M342-F345 WeakPolarHBondContact O-CB 3.36Å; M342-F345 PolarHBondContact O-N 2.83Å; M342-G346 PolarHBondContact O-N 3.4Å |
| 343 | I | 94.1 | Very high | 91.3 | Very high | 29 Ų | 29 | 27.8 Ų | 27.8 | 15% | 0.149 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -59 | -39 | 167.7 | -74.5 | 167.4 | 0 | 0 | 0 | 110.6 | L188 N191 L192 G339 V341 G346 V347 | L188-I343 HydrophobicContact CD1-CB 4.35Å; L188-I343 HydrophobicContact CD1-CD1 4.41Å; L188-I343 HydrophobicContact CD1-CG1 4.1Å; L188-I343 HydrophobicContact CD1-CG2 3.45Å; L188-I343 VanDerWaalsContact CD1-CG2 3.45Å; N191-I343 HydrophobicContact CB-CD1 4.48Å; N191-I343 HydrophobicContact CB-CG1 3.81Å; L192-I343 HydrophobicContact CB-CD1 3.92Å; L192-I343 HydrophobicContact CD1-CD1 4.15Å; G339-I343 VanDerWaalsContact O-CG1 3.25Å; G339-I343 WeakPolarHBondContact O-CG1 3.41Å; G339-I343 PolarHBondContact O-N 3.14Å; V341-I343 VanDerWaalsContact C-N 3.29Å; V341-I343 PolarHBondContact O-N 3.32Å; I343-G346 PolarHBondContact O-N 3.36Å; I343-V347 HydrophobicContact CG2-CG2 4.15Å; I343-V347 WeakPolarHBondContact O-CB 3.42Å; I343-V347 WeakPolarHBondContact O-CG2 3.16Å; I343-V347 PolarHBondContact O-N 3.15Å |
| 344 | C | 94.8 | Very high | 91.1 | Very high | 35 Ų | 35 | 31 Ų | 31 | 24% | 0.236 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -62.6 | -47.6 | 177.7 | -164.9 | 0 | 0 | 0 | 0 | 111 | V341 M342 G346 V348 Y397 | V341-C344 WeakPolarHBondContact O-CB 3.36Å; V341-C344 PolarHBondContact O-N 3.38Å; M342-C344 PolarHBondContact O-N 2.79Å; C344-G346 PolarHBondContact O-N 3.43Å; C344-V348 WeakPolarHBondContact O-CB 3.34Å; C344-V348 VanDerWaalsContact O-CG2 3.26Å; C344-V348 WeakPolarHBondContact O-CG2 3.04Å; C344-V348 PolarHBondContact O-N 2.91Å; C344-Y397 HydrophobicContact CB-CD1 4.39Å; C344-Y397 PolarHBondContact SG-O 3.4Å |
| 345 | F | 94.1 | Very high | 91.2 | Very high | 16 Ų | 16 | 34.2 Ų | 34.2 | 7% | 0.07 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -52.5 | -54.4 | 171.2 | 169.2 | -96.4 | 0 | 0 | 0 | 111.7 | I320 M342 V347 V348 N349 S400 W403 G404 D407 | I320-F345 HydrophobicContact CG1-CD2 4.06Å; I320-F345 HydrophobicContact CG1-CE2 4.29Å; I320-F345 HydrophobicContact CG2-CE2 4.24Å; I320-F345 HydrophobicContact CG2-CZ 4.31Å; M342-F345 HydrophobicContact CE-CB 4.43Å; M342-F345 HydrophobicContact CE-CD1 3.99Å; M342-F345 HydrophobicContact CE-CG 4.28Å; M342-F345 WeakPolarHBondContact O-CB 3.36Å; M342-F345 PolarHBondContact O-N 2.83Å; F345-V347 PolarHBondContact O-N 3.2Å; F345-V348 PolarHBondContact O-N 3.16Å; F345-N349 WeakPolarHBondContact O-CB 3.42Å; F345-N349 PolarHBondContact O-N 3.44Å; F345-S400 WeakPolarHBondContact CA-O 3.48Å; F345-S400 WeakPolarHBondContact CB-O 3.25Å; F345-S400 VanDerWaalsContact CB-OG 3.25Å; F345-S400 WeakPolarHBondContact CB-OG 3.19Å; F345-S400 PolarHBondContact N-OG 3.39Å; F345-W403 HydrophobicContact CD2-CB 4.14Å; F345-W403 HydrophobicContact CE2-CB 4.46Å; F345-G404 VanDerWaalsContact CD2-CA 3.48Å; F345-D407 HydrophobicContact CE2-CB 4.06Å; F345-D407 HydrophobicContact CZ-CB 4.28Å |
| 346 | G | 90.6 | Very high | 91.1 | Very high | 3 Ų | 3 | 35 Ų | 35 | 3% | 0.031 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -60.8 | -45.8 | -176.1 | 0 | 0 | 0 | 0 | 0 | 113.6 | M342 I343 C344 A350 | M342-G346 PolarHBondContact O-N 3.4Å; I343-G346 PolarHBondContact O-N 3.36Å; C344-G346 PolarHBondContact O-N 3.43Å; G346-A350 WeakPolarHBondContact O-CB 3.41Å; G346-A350 PolarHBondContact O-N 3.42Å |
| 347 | V | 92 | Very high | 90.5 | Very high | 58 Ų | 58 | 35.4 Ų | 35.4 | 35% | 0.352 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -66.8 | -48.6 | -179.9 | 171.4 | 0 | 0 | 0 | 0 | 111.2 | L188 I343 F345 A350 L351 | L188-V347 HydrophobicContact CD1-CG2 4.08Å; I343-V347 HydrophobicContact CG2-CG2 4.15Å; I343-V347 WeakPolarHBondContact O-CB 3.42Å; I343-V347 WeakPolarHBondContact O-CG2 3.16Å; I343-V347 PolarHBondContact O-N 3.15Å; F345-V347 PolarHBondContact O-N 3.2Å; V347-A350 PolarHBondContact O-N 2.89Å; V347-L351 HydrophobicContact CG1-CD1 4Å; V347-L351 WeakPolarHBondContact O-CG 3.43Å; V347-L351 PolarHBondContact O-N 3.16Å |
| 348 | V | 94.1 | Very high | 90.2 | Very high | 39 Ų | 39 | 34.8 Ų | 34.8 | 24% | 0.236 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -65 | -43.5 | -179.2 | 176.8 | 0 | 0 | 0 | 0 | 110.4 | C344 F345 A350 L351 C352 G401 V405 | C344-V348 WeakPolarHBondContact O-CB 3.34Å; C344-V348 VanDerWaalsContact O-CG2 3.26Å; C344-V348 WeakPolarHBondContact O-CG2 3.04Å; C344-V348 PolarHBondContact O-N 2.91Å; F345-V348 PolarHBondContact O-N 3.16Å; V348-A350 PolarHBondContact O-N 3.03Å; V348-L351 PolarHBondContact O-N 3.38Å; V348-C352 VanDerWaalsContact O-CB 3.25Å; V348-C352 WeakPolarHBondContact O-CB 3.06Å; V348-C352 PolarHBondContact O-N 3.34Å; V348-C352 PolarHBondContact O-SG 3.03Å; V348-G401 WeakPolarHBondContact CG1-O 3.1Å; V348-V405 HydrophobicContact CG1-CG2 3.5Å; V348-V405 VanDerWaalsContact CG1-CG2 3.5Å |
| 349 | N | 91.3 | Very high | 89.9 | Confident | 5 Ų | 5 | 36.7 Ų | 36.7 | 3% | 0.027 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -57.7 | -45.9 | 176.2 | -175 | 9.5 | 0 | 0 | 0 | 112.1 | Q184 F345 C352 S353 G404 D407 A408 | Q184-N349 PolarHBondContact NE2-ND2 3.02Å; F345-N349 WeakPolarHBondContact O-CB 3.42Å; F345-N349 PolarHBondContact O-N 3.44Å; N349-C352 PolarHBondContact O-N 3.37Å; N349-S353 VanDerWaalsContact O-CB 3.23Å; N349-S353 WeakPolarHBondContact O-CB 3.44Å; N349-S353 PolarHBondContact O-N 2.8Å; N349-S353 PolarHBondContact O-OG 2.74Å; N349-S353 PolarHBondContact OD1-OG 3.16Å; N349-G404 WeakPolarHBondContact CA-O 3.08Å; N349-D407 PolarHBondContact ND2-OD2 3.44Å; N349-D407 PolarHBondContact OD1-OD2 2.69Å; N349-A408 WeakPolarHBondContact OD1-CA 3.42Å; N349-A408 VanDerWaalsContact OD1-CB 3.28Å; N349-A408 WeakPolarHBondContact OD1-CB 3.43Å; N349-A408 PolarHBondContact OD1-N 2.94Å |
| 350 | A | 86.9 | Confident | 89.6 | Confident | 29 Ų | 29 | 39.6 Ų | 39.6 | 24% | 0.24 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -62.3 | -46.4 | 178 | 0 | 0 | 0 | 0 | 0 | 112.5 | Q184 G346 V347 V348 S353 I354 | Q184-A350 HydrophobicContact CB-CB 4.37Å; G346-A350 WeakPolarHBondContact O-CB 3.41Å; G346-A350 PolarHBondContact O-N 3.42Å; V347-A350 PolarHBondContact O-N 2.89Å; V348-A350 PolarHBondContact O-N 3.03Å; A350-S353 PolarHBondContact O-N 3.36Å; A350-I354 WeakPolarHBondContact O-CG1 3.4Å; A350-I354 PolarHBondContact O-N 2.81Å |
| 351 | L | 90.6 | Very high | 89 | Confident | 113 Ų | 113 | 45.1 Ų | 45.1 | 59% | 0.592 | 26% | 0.256 | S | S | * | . | H | α-helix | trans | -63.6 | -46.8 | 178.1 | -69.5 | 173.6 | 0 | 0 | 0 | 111.6 | V347 V348 S353 I354 L355 | V347-L351 HydrophobicContact CG1-CD1 4Å; V347-L351 WeakPolarHBondContact O-CG 3.43Å; V347-L351 PolarHBondContact O-N 3.16Å; V348-L351 PolarHBondContact O-N 3.38Å; L351-S353 VanDerWaalsContact C-N 3.34Å; L351-S353 PolarHBondContact O-N 3.4Å; L351-I354 PolarHBondContact O-N 3.44Å; L351-L355 WeakPolarHBondContact O-CB 3.32Å; L351-L355 PolarHBondContact O-N 3.26Å |
| 352 | C | 91.4 | Very high | 88.6 | Confident | 15 Ų | 15 | 54.5 Ų | 54.5 | 10% | 0.101 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -64.2 | -37.1 | 178 | -78.2 | 0 | 0 | 0 | 0 | 112.2 | V348 N349 I354 L355 F356 A408 | V348-C352 VanDerWaalsContact O-CB 3.25Å; V348-C352 WeakPolarHBondContact O-CB 3.06Å; V348-C352 PolarHBondContact O-N 3.34Å; V348-C352 PolarHBondContact O-SG 3.03Å; N349-C352 PolarHBondContact O-N 3.37Å; C352-I354 VanDerWaalsContact C-N 3.33Å; C352-I354 PolarHBondContact O-N 2.82Å; C352-L355 PolarHBondContact O-N 3.42Å; C352-F356 HydrophobicContact CB-CD2 3.95Å; C352-F356 HydrophobicContact CB-CE2 3.58Å; C352-F356 HydrophobicContact CB-CZ 4.22Å; C352-F356 WeakPolarHBondContact O-CB 3.34Å; C352-F356 VanDerWaalsContact O-CD2 3.24Å; C352-F356 WeakPolarHBondContact O-CD2 3.14Å; C352-F356 VanDerWaalsContact O-CG 3.27Å; C352-F356 WeakPolarHBondContact O-CG 3.11Å; C352-F356 PolarHBondContact O-N 3.31Å; C352-A408 HydrophobicContact CB-CB 3.51Å |
| 353 | S | 85.9 | Confident | 88.4 | Confident | 32 Ų | 32 | 58.9 Ų | 58.9 | 22% | 0.224 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -61.7 | -40.5 | 176.8 | -74 | 0 | 0 | 0 | 0 | 112.1 | N349 A350 L351 G357 | N349-S353 VanDerWaalsContact O-CB 3.23Å; N349-S353 WeakPolarHBondContact O-CB 3.44Å; N349-S353 PolarHBondContact O-N 2.8Å; N349-S353 PolarHBondContact O-OG 2.74Å; N349-S353 PolarHBondContact OD1-OG 3.16Å; A350-S353 PolarHBondContact O-N 3.36Å; L351-S353 VanDerWaalsContact C-N 3.34Å; L351-S353 PolarHBondContact O-N 3.4Å; S353-G357 PolarHBondContact O-N 3.39Å; S353-G357 VanDerWaalsContact O-N 3.16Å |
| 354 | I | 85.1 | Confident | 88 | Confident | 99 Ų | 99 | 59 Ų | 59 | 51% | 0.508 | 32% | 0.323 | S | S | . | . | H | α-helix | trans | -69.4 | -45.7 | 174.8 | -64.4 | 166.9 | 0 | 0 | 0 | 110.6 | L181 A350 L351 C352 S358 | L181-I354 HydrophobicContact CD1-CD1 4.27Å; A350-I354 WeakPolarHBondContact O-CG1 3.4Å; A350-I354 PolarHBondContact O-N 2.81Å; L351-I354 PolarHBondContact O-N 3.44Å; C352-I354 VanDerWaalsContact C-N 3.33Å; C352-I354 PolarHBondContact O-N 2.82Å; I354-S358 WeakPolarHBondContact O-CB 3.24Å; I354-S358 PolarHBondContact O-N 3.05Å; I354-S358 VanDerWaalsContact O-N 3.15Å; I354-S358 PolarHBondContact O-OG 2.91Å |
| 355 | L | 88.8 | Confident | 87.7 | Confident | 90 Ų | 90 | 58.9 Ų | 58.9 | 47% | 0.471 | 32% | 0.318 | S | S | . | . | H | α-helix | trans | -60.7 | -57.2 | -179.1 | 180 | 66.1 | 0 | 0 | 0 | 111 | L351 C352 G357 S358 V359 | L351-L355 WeakPolarHBondContact O-CB 3.32Å; L351-L355 PolarHBondContact O-N 3.26Å; C352-L355 PolarHBondContact O-N 3.42Å; L355-G357 VanDerWaalsContact C-N 3.35Å; L355-G357 PolarHBondContact O-N 3.4Å; L355-S358 PolarHBondContact O-N 3.35Å; L355-V359 HydrophobicContact CD1-CG2 3.71Å; L355-V359 HydrophobicContact CG-CG2 4.11Å; L355-V359 WeakPolarHBondContact O-CB 3.3Å; L355-V359 VanDerWaalsContact O-CG2 3.26Å; L355-V359 WeakPolarHBondContact O-CG2 3.3Å; L355-V359 PolarHBondContact O-N 3.3Å |
| 356 | F | 86.1 | Confident | 87.5 | Confident | 18 Ų | 18 | 60.1 Ų | 60.1 | 8% | 0.079 | 33% | 0.327 | C | S | . | . | H | α-helix | trans | -67.5 | -33.7 | -176.5 | -60.4 | -33 | 0 | 0 | 0 | 112.5 | C352 S358 M360 I368 L371 V405 A408 V409 | C352-F356 HydrophobicContact CB-CD2 3.95Å; C352-F356 HydrophobicContact CB-CE2 3.58Å; C352-F356 HydrophobicContact CB-CZ 4.22Å; C352-F356 WeakPolarHBondContact O-CB 3.34Å; C352-F356 VanDerWaalsContact O-CD2 3.24Å; C352-F356 WeakPolarHBondContact O-CD2 3.14Å; C352-F356 VanDerWaalsContact O-CG 3.27Å; C352-F356 WeakPolarHBondContact O-CG 3.11Å; C352-F356 PolarHBondContact O-N 3.31Å; F356-S358 PolarHBondContact O-N 3.4Å; F356-M360 VanDerWaalsContact O-CB 3.24Å; F356-M360 WeakPolarHBondContact O-CB 3.24Å; F356-M360 PolarHBondContact O-N 3.01Å; F356-I368 HydrophobicContact CB-CD1 4.49Å; F356-I368 HydrophobicContact CB-CG2 3.97Å; F356-I368 HydrophobicContact CD1-CG2 4.12Å; F356-I368 HydrophobicContact CD2-CG2 4.35Å; F356-I368 HydrophobicContact CG-CG2 3.9Å; F356-L371 HydrophobicContact CE1-CD2 3.97Å; F356-L371 HydrophobicContact CZ-CD2 3.78Å; F356-V405 HydrophobicContact CE2-CG1 4.05Å; F356-V405 HydrophobicContact CZ-CG1 3.99Å; F356-A408 HydrophobicContact CD2-CB 4.24Å; F356-A408 HydrophobicContact CE2-CB 4.41Å; F356-V409 HydrophobicContact CD2-CG2 3.62Å; F356-V409 HydrophobicContact CE2-CG2 3.43Å; F356-V409 VanDerWaalsContact CE2-CG2 3.43Å; F356-V409 HydrophobicContact CG-CG2 4.48Å; F356-V409 HydrophobicContact CZ-CG2 4.17Å |
| 357 | G | 77.2 | Confident | 87.6 | Confident | 32 Ų | 32 | 63.2 Ų | 63.2 | 33% | 0.33 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -61.5 | -33.2 | 170.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | S353 L355 | S353-G357 PolarHBondContact O-N 3.39Å; S353-G357 VanDerWaalsContact O-N 3.16Å; L355-G357 VanDerWaalsContact C-N 3.35Å; L355-G357 PolarHBondContact O-N 3.4Å |
| 358 | S | 82.4 | Confident | 87.7 | Confident | 60 Ų | 60 | 60.6 Ų | 60.6 | 42% | 0.42 | 33% | 0.33 | S | S | . | . | H | α-helix | trans | -84.4 | -45.8 | 179 | -57.9 | 0 | 0 | 0 | 0 | 112.3 | I354 L355 F356 M360 K361 | I354-S358 WeakPolarHBondContact O-CB 3.24Å; I354-S358 PolarHBondContact O-N 3.05Å; I354-S358 VanDerWaalsContact O-N 3.15Å; I354-S358 PolarHBondContact O-OG 2.91Å; L355-S358 PolarHBondContact O-N 3.35Å; F356-S358 PolarHBondContact O-N 3.4Å; S358-M360 VanDerWaalsContact C-N 3.34Å; S358-M360 PolarHBondContact O-N 3.12Å; S358-K361 PolarHBondContact O-N 3.47Å |
| 359 | V | 86.3 | Confident | 87.7 | Confident | 41 Ų | 41 | 59 Ų | 59 | 25% | 0.248 | 32% | 0.32 | C | S | . | . | H | α-helix | trans | -67.7 | -31 | -176.9 | 169.7 | 0 | 0 | 0 | 0 | 112.2 | L355 K361 Y362 I363 | L355-V359 HydrophobicContact CD1-CG2 3.71Å; L355-V359 HydrophobicContact CG-CG2 4.11Å; L355-V359 WeakPolarHBondContact O-CB 3.3Å; L355-V359 VanDerWaalsContact O-CG2 3.26Å; L355-V359 WeakPolarHBondContact O-CG2 3.3Å; L355-V359 PolarHBondContact O-N 3.3Å; V359-K361 PolarHBondContact O-N 3.24Å; V359-Y362 PolarHBondContact O-N 2.92Å; V359-I363 HydrophobicContact CG1-CD1 3.45Å; V359-I363 VanDerWaalsContact CG1-CD1 3.45Å; V359-I363 HydrophobicContact CG1-CG1 3.73Å; V359-I363 PolarHBondContact O-N 2.92Å |
| 360 | M | 85.6 | Confident | 87.9 | Confident | 62 Ų | 62 | 62.6 Ų | 62.6 | 31% | 0.305 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -51.3 | -31.2 | 175.7 | -174.6 | -145.2 | -64.8 | 0 | 0 | 112.8 | F356 S358 Y362 G364 R365 I368 Q413 | F356-M360 VanDerWaalsContact O-CB 3.24Å; F356-M360 WeakPolarHBondContact O-CB 3.24Å; F356-M360 PolarHBondContact O-N 3.01Å; S358-M360 VanDerWaalsContact C-N 3.34Å; S358-M360 PolarHBondContact O-N 3.12Å; M360-Y362 PolarHBondContact O-N 3.12Å; M360-G364 VanDerWaalsContact O-CA 3.26Å; M360-G364 WeakPolarHBondContact O-CA 3.38Å; M360-G364 PolarHBondContact O-N 3.49Å; M360-G364 VanDerWaalsContact O-N 3.08Å; M360-R365 HydrophobicContact CG-CB 4.47Å; M360-I368 HydrophobicContact CB-CD1 3.77Å; M360-I368 HydrophobicContact CG-CD1 4.38Å; M360-Q413 VanDerWaalsContact CE-OE1 3.22Å |
| 361 | K | 81.2 | Confident | 88.4 | Confident | 170 Ų | 170 | 64.8 Ų | 64.8 | 74% | 0.739 | 35% | 0.35 | S | S | * | . | H | α-helix | trans | -66.1 | -24.3 | 178.7 | -64 | 177.6 | -177.5 | 172.1 | 0 | 113.6 | S358 V359 | S358-K361 PolarHBondContact O-N 3.47Å; V359-K361 PolarHBondContact O-N 3.24Å |
| 362 | Y | 87.3 | Confident | 88.6 | Confident | 196 Ų | 196 | 59.4 Ų | 59.4 | 77% | 0.769 | 32% | 0.321 | S | S | * | . | H | α-helix | trans | -102.6 | -47.2 | -174 | -57 | -75.5 | 0 | 0 | 0 | 112.4 | V359 M360 | V359-Y362 PolarHBondContact O-N 2.92Å; M360-Y362 PolarHBondContact O-N 3.12Å |
| 363 | I | 90.1 | Very high | 88.9 | Confident | 95 Ų | 95 | 59.4 Ų | 59.4 | 49% | 0.487 | 32% | 0.322 | S | S | . | . | H | α-helix | trans | -100.4 | -6.5 | -175.1 | 69.7 | 177 | 0 | 0 | 0 | 113.4 | V359 P367 I368 | V359-I363 HydrophobicContact CG1-CD1 3.45Å; V359-I363 VanDerWaalsContact CG1-CD1 3.45Å; V359-I363 HydrophobicContact CG1-CG1 3.73Å; V359-I363 PolarHBondContact O-N 2.92Å; I363-P367 HydrophobicContact CD1-CB 4.24Å; I363-I368 HydrophobicContact CD1-CD1 4.42Å; I363-I368 HydrophobicContact CD1-CG1 3.93Å; I363-I368 HydrophobicContact CG1-CD1 4.39Å; I363-I368 HydrophobicContact CG1-CG1 4.26Å |
| 364 | G | 86.6 | Confident | 89.5 | Confident | 31 Ų | 31 | 61.8 Ų | 61.8 | 32% | 0.32 | 34% | 0.335 | S | S | . | . | trans | 77.6 | 177.9 | -173.9 | 0 | 0 | 0 | 0 | 0 | 113.3 | M360 | M360-G364 VanDerWaalsContact O-CA 3.26Å; M360-G364 WeakPolarHBondContact O-CA 3.38Å; M360-G364 PolarHBondContact O-N 3.49Å; M360-G364 VanDerWaalsContact O-N 3.08Å | ||
| 365 | R | 87.8 | Confident | 90.1 | Very high | 32 Ų | 32 | 58 Ų | 58 | 12% | 0.121 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -78.5 | -38.6 | -174.5 | 174.7 | 176.1 | 60.5 | -146.4 | -4.1 | 113.9 | M360 I368 I369 Q413 L417 E475 | M360-R365 HydrophobicContact CG-CB 4.47Å; R365-I368 PolarHBondContact O-N 3.41Å; R365-I369 HydrophobicContact CG-CD1 3.52Å; R365-I369 HydrophobicContact CG-CG1 4.02Å; R365-I369 PolarHBondContact O-N 3.14Å; R365-Q413 HydrophobicContact CG-CB 4.22Å; R365-L417 VanDerWaalsContact CZ-CD1 3.41Å; R365-E475 IonicContact CZ-OE2 3.54Å; R365-E475 IonicContact NE-OE2 2.74Å; R365-E475 PolarHBondContact NE-OE2 2.94Å; R365-E475 IonicContact NH2-OE1 3.49Å; R365-E475 IonicContact NH2-OE2 3.5Å; R365-E475 PolarHBondContact NH2-OE2 3.35Å |
| 366 | T | 90.2 | Very high | 90.6 | Very high | 43 Ų | 43 | 53.7 Ų | 53.7 | 26% | 0.264 | 29% | 0.294 | S | S | . | . | H | α-helix | trans | -57.5 | -47 | -171 | -51.2 | 0 | 0 | 0 | 0 | 113.2 | I368 I369 V370 R479 | T366-I368 VanDerWaalsContact C-N 3.3Å; T366-I368 PolarHBondContact O-N 2.74Å; T366-I369 PolarHBondContact O-N 3.37Å; T366-V370 HydrophobicContact CG2-CG2 4.48Å; T366-V370 WeakPolarHBondContact O-CG2 3.35Å; T366-V370 PolarHBondContact O-N 3.02Å; T366-R479 PolarHBondContact OG1-NH2 3.41Å; T366-R479 VanDerWaalsContact OG1-NH2 3.14Å |
| 367 | P | 93.8 | Very high | 91.1 | Very high | 67 Ų | 67 | 55.9 Ų | 55.9 | 44% | 0.435 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -62.5 | -36.7 | 179.2 | -22.7 | 35.2 | 0 | 0 | 0 | 113.2 | I363 V370 L371 | I363-P367 HydrophobicContact CD1-CB 4.24Å; P367-V370 PolarHBondContact O-N 3.11Å; P367-L371 PolarHBondContact O-N 2.61Å |
| 368 | I | 93.8 | Very high | 92.1 | Very high | 4 Ų | 4 | 58 Ų | 58 | 2% | 0.021 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -67.1 | -43.3 | 179.5 | -56.2 | 177.1 | 0 | 0 | 0 | 110.2 | F356 M360 I363 R365 T366 L371 G372 V409 Q413 | F356-I368 HydrophobicContact CB-CD1 4.49Å; F356-I368 HydrophobicContact CB-CG2 3.97Å; F356-I368 HydrophobicContact CD1-CG2 4.12Å; F356-I368 HydrophobicContact CD2-CG2 4.35Å; F356-I368 HydrophobicContact CG-CG2 3.9Å; M360-I368 HydrophobicContact CB-CD1 3.77Å; M360-I368 HydrophobicContact CG-CD1 4.38Å; I363-I368 HydrophobicContact CD1-CD1 4.42Å; I363-I368 HydrophobicContact CD1-CG1 3.93Å; I363-I368 HydrophobicContact CG1-CD1 4.39Å; I363-I368 HydrophobicContact CG1-CG1 4.26Å; R365-I368 PolarHBondContact O-N 3.41Å; T366-I368 VanDerWaalsContact C-N 3.3Å; T366-I368 PolarHBondContact O-N 2.74Å; I368-L371 WeakPolarHBondContact O-CB 3.41Å; I368-L371 PolarHBondContact O-N 2.94Å; I368-G372 PolarHBondContact O-N 3Å; I368-G372 VanDerWaalsContact O-N 3.09Å; I368-V409 HydrophobicContact CG2-CG1 4.14Å; I368-V409 HydrophobicContact CG2-CG2 3.92Å; I368-V409 VanDerWaalsContact O-CG1 3.24Å; I368-V409 WeakPolarHBondContact O-CG1 3.38Å; I368-Q413 HydrophobicContact CB-CG 4.3Å; I368-Q413 HydrophobicContact CG2-CG 3.75Å |
| 369 | I | 94.1 | Very high | 92.9 | Very high | 6 Ų | 6 | 55.6 Ų | 55.6 | 3% | 0.031 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -65.6 | -39.4 | 176.3 | -74 | -179 | 0 | 0 | 0 | 111.8 | R365 T366 L371 G372 A373 V409 W410 Q413 I414 Y471 | R365-I369 HydrophobicContact CG-CD1 3.52Å; R365-I369 HydrophobicContact CG-CG1 4.02Å; R365-I369 PolarHBondContact O-N 3.14Å; T366-I369 PolarHBondContact O-N 3.37Å; I369-L371 VanDerWaalsContact C-N 3.3Å; I369-L371 PolarHBondContact O-N 3.49Å; I369-G372 PolarHBondContact O-N 3.28Å; I369-A373 PolarHBondContact O-N 3.06Å; I369-V409 HydrophobicContact CG1-CG1 4.4Å; I369-W410 HydrophobicContact CG2-CH2 4.38Å; I369-W410 HydrophobicContact CG2-CZ3 3.84Å; I369-Q413 HydrophobicContact CD1-CB 3.87Å; I369-Q413 HydrophobicContact CG1-CB 3.72Å; I369-Q413 HydrophobicContact CG1-CG 4.08Å; I369-I414 HydrophobicContact CD1-CD1 3.89Å; I369-Y471 HydrophobicContact CB-CE1 4.18Å; I369-Y471 HydrophobicContact CD1-CD1 4.49Å; I369-Y471 HydrophobicContact CD1-CD2 4.08Å; I369-Y471 HydrophobicContact CD1-CE1 3.88Å; I369-Y471 HydrophobicContact CD1-CE2 3.42Å; I369-Y471 VanDerWaalsContact CD1-CE2 3.42Å; I369-Y471 HydrophobicContact CG2-CD1 3.79Å; I369-Y471 HydrophobicContact CG2-CE1 3.55Å |
| 370 | V | 95.7 | Very high | 93.4 | Very high | 80 Ų | 80 | 53.6 Ų | 53.6 | 49% | 0.485 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -61.6 | -40.9 | 175 | 171.5 | 0 | 0 | 0 | 0 | 110.8 | T366 P367 A373 V374 | T366-V370 HydrophobicContact CG2-CG2 4.48Å; T366-V370 WeakPolarHBondContact O-CG2 3.35Å; T366-V370 PolarHBondContact O-N 3.02Å; P367-V370 PolarHBondContact O-N 3.11Å; V370-A373 PolarHBondContact O-N 3.46Å; V370-V374 HydrophobicContact CG1-CG2 4.33Å; V370-V374 WeakPolarHBondContact O-CG2 3.23Å; V370-V374 PolarHBondContact O-N 3.33Å |
| 371 | L | 96.1 | Very high | 94 | Very high | 75 Ų | 75 | 53.5 Ų | 53.5 | 39% | 0.393 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -57.4 | -50.5 | 173.2 | 175.8 | 67.7 | 0 | 0 | 0 | 111.5 | F356 P367 I368 I369 A373 V374 V375 | F356-L371 HydrophobicContact CE1-CD2 3.97Å; F356-L371 HydrophobicContact CZ-CD2 3.78Å; P367-L371 PolarHBondContact O-N 2.61Å; I368-L371 WeakPolarHBondContact O-CB 3.41Å; I368-L371 PolarHBondContact O-N 2.94Å; I369-L371 VanDerWaalsContact C-N 3.3Å; I369-L371 PolarHBondContact O-N 3.49Å; L371-A373 VanDerWaalsContact C-N 3.31Å; L371-A373 PolarHBondContact O-N 3.22Å; L371-V374 PolarHBondContact O-N 3.15Å; L371-V375 HydrophobicContact CD1-CG2 4.07Å; L371-V375 HydrophobicContact CG-CG2 4.41Å; L371-V375 VanDerWaalsContact O-CG2 3.29Å; L371-V375 WeakPolarHBondContact O-CG2 3.44Å; L371-V375 PolarHBondContact O-N 3.49Å |
| 372 | G | 96.3 | Very high | 94.7 | Very high | 0 Ų | 0 | 48.3 Ų | 48.3 | 0% | 0 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -58.6 | -42.1 | 178 | 0 | 0 | 0 | 0 | 0 | 112.8 | I368 I369 V375 H376 W410 | I368-G372 PolarHBondContact O-N 3Å; I368-G372 VanDerWaalsContact O-N 3.09Å; I369-G372 PolarHBondContact O-N 3.28Å; G372-V375 PolarHBondContact O-N 3.39Å; G372-H376 PolarHBondContact O-N 3.28Å; G372-W410 WeakPolarHBondContact O-CZ2 3.44Å |
| 373 | A | 97.4 | Very high | 95.1 | Very high | 14 Ų | 14 | 39 Ų | 39 | 12% | 0.116 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -59.8 | -52.7 | 175.8 | 0 | 0 | 0 | 0 | 0 | 111.2 | I369 V370 L371 V375 H376 F377 W410 | I369-A373 PolarHBondContact O-N 3.06Å; V370-A373 PolarHBondContact O-N 3.46Å; L371-A373 VanDerWaalsContact C-N 3.31Å; L371-A373 PolarHBondContact O-N 3.22Å; A373-V375 VanDerWaalsContact C-N 3.32Å; A373-V375 PolarHBondContact O-N 3.02Å; A373-H376 PolarHBondContact O-N 3.33Å; A373-F377 HydrophobicContact CB-CD2 4.32Å; A373-F377 HydrophobicContact CB-CE2 4.45Å; A373-F377 WeakPolarHBondContact O-CB 3.32Å; A373-F377 WeakPolarHBondContact O-CD2 3.37Å; A373-F377 PolarHBondContact O-N 2.99Å; A373-W410 HydrophobicContact CB-CH2 3.92Å; A373-W410 HydrophobicContact CB-CZ2 4.31Å; A373-W410 VanDerWaalsContact N-CZ2 3.28Å |
| 374 | V | 98.2 | Very high | 95.4 | Very high | 83 Ų | 83 | 35.3 Ų | 35.3 | 50% | 0.503 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -59.2 | -44.3 | -179.5 | 170.9 | 0 | 0 | 0 | 0 | 111 | V370 L371 T378 | V370-V374 HydrophobicContact CG1-CG2 4.33Å; V370-V374 WeakPolarHBondContact O-CG2 3.23Å; V370-V374 PolarHBondContact O-N 3.33Å; L371-V374 PolarHBondContact O-N 3.15Å; V374-T378 VanDerWaalsContact O-CB 3.26Å; V374-T378 WeakPolarHBondContact O-CB 3.42Å; V374-T378 PolarHBondContact O-N 3.24Å; V374-T378 PolarHBondContact O-OG1 2.85Å |
| 375 | V | 98.1 | Very high | 95.8 | Very high | 19 Ų | 19 | 41.7 Ų | 41.7 | 12% | 0.115 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -61.6 | -51.6 | 179.8 | 173 | 0 | 0 | 0 | 0 | 110.8 | L371 G372 A373 T378 L379 L402 | L371-V375 HydrophobicContact CD1-CG2 4.07Å; L371-V375 HydrophobicContact CG-CG2 4.41Å; L371-V375 VanDerWaalsContact O-CG2 3.29Å; L371-V375 WeakPolarHBondContact O-CG2 3.44Å; L371-V375 PolarHBondContact O-N 3.49Å; G372-V375 PolarHBondContact O-N 3.39Å; A373-V375 VanDerWaalsContact C-N 3.32Å; A373-V375 PolarHBondContact O-N 3.02Å; V375-T378 PolarHBondContact O-N 3.32Å; V375-L379 HydrophobicContact CG1-CD1 3.87Å; V375-L379 HydrophobicContact CG1-CG 4.32Å; V375-L379 WeakPolarHBondContact O-CB 3.36Å; V375-L379 VanDerWaalsContact O-CG 3.31Å; V375-L379 WeakPolarHBondContact O-CG 3.22Å; V375-L379 PolarHBondContact O-N 3.45Å; V375-L402 HydrophobicContact CG1-CB 4.13Å; V375-L402 HydrophobicContact CG1-CD2 4.35Å; V375-L402 WeakPolarHBondContact CG1-O 3.44Å |
| 376 | H | 97.9 | Very high | 96.2 | Very high | 0 Ų | 0 | 42.8 Ų | 42.8 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -70.7 | -37.3 | -178.7 | -76.7 | -168.1 | 0 | 0 | 0 | 113.5 | F312 E316 G372 A373 T378 L379 I380 W403 G406 W410 L464 | F312-H376 AromaticContact CE1-ND1 3.6Å; F312-H376 HydrophobicContact CZ-CB 4.36Å; F312-H376 AromaticContact CZ-ND1 3.59Å; E316-H376 IonicContact OE1-CE1 2.92Å; E316-H376 IonicContact OE2-CE1 3.07Å; E316-H376 PolarHBondContact OE2-CE1 2.97Å; E316-H376 IonicContact OE2-ND1 3.15Å; E316-H376 IonicContact OE2-NE2 2.67Å; G372-H376 PolarHBondContact O-N 3.28Å; A373-H376 PolarHBondContact O-N 3.33Å; H376-T378 VanDerWaalsContact C-N 3.29Å; H376-T378 PolarHBondContact O-N 3.49Å; H376-L379 PolarHBondContact O-N 3.45Å; H376-I380 WeakPolarHBondContact O-CB 3.22Å; H376-I380 WeakPolarHBondContact O-CD1 3.46Å; H376-I380 WeakPolarHBondContact O-CG1 3.48Å; H376-I380 PolarHBondContact O-N 3.3Å; H376-W403 AromaticContact CD2-CE3 4Å; H376-W403 AromaticContact CE1-CE3 3.69Å; H376-W403 AromaticContact CE1-CZ3 3.76Å; H376-W403 AromaticContact ND1-CZ3 3.87Å; H376-W403 AromaticContact NE2-CE3 3.54Å; H376-W403 AromaticContact NE2-CZ3 3.97Å; H376-W403 PolarHBondContact NE2-O 3.35Å; H376-G406 WeakPolarHBondContact NE2-CA 3.4Å; H376-W410 AromaticContact CE1-CD1 3.55Å; H376-W410 AromaticContact CE1-NE1 3.29Å; H376-W410 PolarHBondContact CE1-NE1 2.85Å; H376-W410 VanDerWaalsContact CE1-NE1 3.29Å; H376-W410 AromaticContact CG-NE1 3.78Å; H376-W410 AromaticContact ND1-CD1 3.67Å; H376-W410 AromaticContact ND1-NE1 3Å; H376-W410 PolarHBondContact ND1-NE1 3.16Å; H376-L464 HydrophobicContact CB-CD2 3.89Å |
| 377 | F | 98.4 | Very high | 96.2 | Very high | 64 Ų | 64 | 44.8 Ų | 44.8 | 28% | 0.281 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -59.2 | -43.9 | 171.8 | -85.7 | -64 | 0 | 0 | 0 | 111.2 | A373 T381 L461 L464 T465 | A373-F377 HydrophobicContact CB-CD2 4.32Å; A373-F377 HydrophobicContact CB-CE2 4.45Å; A373-F377 WeakPolarHBondContact O-CB 3.32Å; A373-F377 WeakPolarHBondContact O-CD2 3.37Å; A373-F377 PolarHBondContact O-N 2.99Å; F377-T381 VanDerWaalsContact O-CB 3.3Å; F377-T381 WeakPolarHBondContact O-CB 3.33Å; F377-T381 PolarHBondContact O-N 2.88Å; F377-T381 VanDerWaalsContact O-N 3.1Å; F377-T381 PolarHBondContact O-OG1 2.95Å; F377-L461 HydrophobicContact CD1-CD2 3.63Å; F377-L461 HydrophobicContact CE1-CD2 4.01Å; F377-L464 HydrophobicContact CD1-CD2 4.03Å; F377-L464 HydrophobicContact CD2-CD2 3.94Å; F377-L464 HydrophobicContact CD2-CG 4.42Å; F377-L464 HydrophobicContact CE1-CD2 4Å; F377-L464 HydrophobicContact CE1-CG 4.18Å; F377-L464 HydrophobicContact CE2-CD2 3.9Å; F377-L464 HydrophobicContact CE2-CG 3.87Å; F377-L464 HydrophobicContact CG-CD2 3.98Å; F377-L464 HydrophobicContact CZ-CB 4.42Å; F377-L464 HydrophobicContact CZ-CD2 3.93Å; F377-L464 HydrophobicContact CZ-CG 3.74Å; F377-T465 WeakPolarHBondContact CE1-OG1 3.35Å; F377-T465 WeakPolarHBondContact CZ-OG1 3.45Å |
| 378 | T | 97.9 | Very high | 96 | Very high | 77 Ų | 77 | 41.6 Ų | 41.6 | 47% | 0.472 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -66 | -49.2 | 178.8 | -55.1 | 0 | 0 | 0 | 0 | 110.7 | V374 V375 H376 T381 V382 | V374-T378 VanDerWaalsContact O-CB 3.26Å; V374-T378 WeakPolarHBondContact O-CB 3.42Å; V374-T378 PolarHBondContact O-N 3.24Å; V374-T378 PolarHBondContact O-OG1 2.85Å; V375-T378 PolarHBondContact O-N 3.32Å; H376-T378 VanDerWaalsContact C-N 3.29Å; H376-T378 PolarHBondContact O-N 3.49Å; T378-T381 PolarHBondContact O-N 3.4Å; T378-V382 HydrophobicContact CG2-CG2 4.28Å; T378-V382 VanDerWaalsContact O-CG2 3.28Å; T378-V382 WeakPolarHBondContact O-CG2 3.44Å; T378-V382 PolarHBondContact O-N 2.9Å |
| 379 | L | 97.6 | Very high | 95.8 | Very high | 8 Ų | 8 | 43.5 Ų | 43.5 | 4% | 0.042 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -58.6 | -51.7 | -179.9 | -77 | 174.5 | 0 | 0 | 0 | 112.3 | V375 H376 T381 V382 E383 M399 L402 W403 | V375-L379 HydrophobicContact CG1-CD1 3.87Å; V375-L379 HydrophobicContact CG1-CG 4.32Å; V375-L379 WeakPolarHBondContact O-CB 3.36Å; V375-L379 VanDerWaalsContact O-CG 3.31Å; V375-L379 WeakPolarHBondContact O-CG 3.22Å; V375-L379 PolarHBondContact O-N 3.45Å; H376-L379 PolarHBondContact O-N 3.45Å; L379-T381 PolarHBondContact O-N 3.32Å; L379-V382 CarbonylContact O-C 3.49Å; L379-V382 PolarHBondContact O-N 3.34Å; L379-V382 VanDerWaalsContact O-N 3.1Å; L379-E383 WeakPolarHBondContact O-CB 3.45Å; L379-E383 WeakPolarHBondContact O-CG 3.35Å; L379-E383 PolarHBondContact O-N 3.09Å; L379-M399 HydrophobicContact CD2-CB 4.43Å; L379-M399 HydrophobicContact CD2-CG 4.32Å; L379-L402 HydrophobicContact CD1-CB 3.71Å; L379-L402 HydrophobicContact CD2-CB 3.8Å; L379-L402 HydrophobicContact CD2-CD1 3.91Å; L379-L402 HydrophobicContact CG-CB 4.11Å; L379-W403 HydrophobicContact CD1-CB 4.42Å; L379-W403 HydrophobicContact CD1-CD2 4.09Å; L379-W403 HydrophobicContact CD1-CG 3.89Å |
| 380 | I | 98.1 | Very high | 95.4 | Very high | 0 Ų | 0 | 45.3 Ų | 45.3 | 0% | 0 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -62.6 | -37.8 | -178.8 | -63.8 | 163.7 | 0 | 0 | 0 | 110.6 | F312 H376 E383 L384 W403 L457 L460 L461 L464 | F312-I380 HydrophobicContact CE2-CD1 4.4Å; H376-I380 WeakPolarHBondContact O-CB 3.22Å; H376-I380 WeakPolarHBondContact O-CD1 3.46Å; H376-I380 WeakPolarHBondContact O-CG1 3.48Å; H376-I380 PolarHBondContact O-N 3.3Å; I380-E383 PolarHBondContact O-N 3.45Å; I380-L384 WeakPolarHBondContact O-CG 3.13Å; I380-L384 PolarHBondContact O-N 3.06Å; I380-W403 HydrophobicContact CD1-CH2 4.22Å; I380-W403 HydrophobicContact CG1-CH2 3.83Å; I380-W403 HydrophobicContact CG1-CZ2 4.02Å; I380-L457 HydrophobicContact CG2-CB 4.03Å; I380-L457 HydrophobicContact CG2-CD2 3.99Å; I380-L460 HydrophobicContact CD1-CB 4.13Å; I380-L461 HydrophobicContact CB-CD2 3.93Å; I380-L461 HydrophobicContact CB-CG 4.2Å; I380-L461 HydrophobicContact CD1-CD2 4.25Å; I380-L461 HydrophobicContact CG2-CD1 3.86Å; I380-L461 HydrophobicContact CG2-CD2 3.74Å; I380-L461 HydrophobicContact CG2-CG 3.43Å; I380-L461 VanDerWaalsContact CG2-CG 3.43Å; I380-L464 HydrophobicContact CD1-CD2 4.29Å |
| 381 | T | 96.9 | Very high | 95.1 | Very high | 60 Ų | 60 | 47.6 Ų | 47.6 | 37% | 0.368 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -64.9 | -44.3 | 174.7 | -56.1 | 0 | 0 | 0 | 0 | 111.3 | F377 T378 L379 L384 F385 | F377-T381 VanDerWaalsContact O-CB 3.3Å; F377-T381 WeakPolarHBondContact O-CB 3.33Å; F377-T381 PolarHBondContact O-N 2.88Å; F377-T381 VanDerWaalsContact O-N 3.1Å; F377-T381 PolarHBondContact O-OG1 2.95Å; T378-T381 PolarHBondContact O-N 3.4Å; L379-T381 PolarHBondContact O-N 3.32Å; T381-L384 WeakPolarHBondContact O-CB 3.39Å; T381-L384 PolarHBondContact O-N 2.84Å; T381-F385 HydrophobicContact CG2-CD2 4.05Å; T381-F385 HydrophobicContact CG2-CE2 3.89Å; T381-F385 WeakPolarHBondContact O-CD2 3.5Å; T381-F385 PolarHBondContact O-N 3.05Å |
| 382 | V | 96.6 | Very high | 94.7 | Very high | 61 Ų | 61 | 48.4 Ų | 48.4 | 37% | 0.37 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -61.9 | -46 | 176.5 | 173.2 | 0 | 0 | 0 | 0 | 110.1 | T378 L379 L384 F385 W386 M399 | T378-V382 HydrophobicContact CG2-CG2 4.28Å; T378-V382 VanDerWaalsContact O-CG2 3.28Å; T378-V382 WeakPolarHBondContact O-CG2 3.44Å; T378-V382 PolarHBondContact O-N 2.9Å; L379-V382 CarbonylContact O-C 3.49Å; L379-V382 PolarHBondContact O-N 3.34Å; L379-V382 VanDerWaalsContact O-N 3.1Å; V382-L384 VanDerWaalsContact C-N 3.26Å; V382-L384 PolarHBondContact O-N 3.41Å; V382-F385 PolarHBondContact O-N 2.75Å; V382-F385 VanDerWaalsContact O-N 3.1Å; V382-W386 HydrophobicContact CG1-CB 3.87Å; V382-W386 HydrophobicContact CG1-CG 4.49Å; V382-W386 WeakPolarHBondContact O-CA 3.09Å; V382-W386 WeakPolarHBondContact O-CB 3.25Å; V382-W386 PolarHBondContact O-N 3.44Å; V382-M399 HydrophobicContact CG1-CE 3.43Å; V382-M399 VanDerWaalsContact CG1-CE 3.43Å |
| 383 | E | 96.6 | Very high | 94.3 | Very high | 0 Ų | 0 | 50.9 Ų | 50.9 | 0% | 0 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -62.1 | -30.6 | 178.4 | -74 | 177.1 | 169.4 | 0 | 0 | 113.3 | F319 F324 Y328 L379 I380 F385 M399 W403 L457 | F319-E383 VanDerWaalsContact CE1-OE2 3.26Å; F319-E383 WeakPolarHBondContact CE1-OE2 3.46Å; F324-E383 WeakPolarHBondContact CD2-OE1 3.37Å; Y328-E383 HydrophobicContact CE1-CB 4.1Å; Y328-E383 HydrophobicContact CE1-CG 4.18Å; Y328-E383 PolarHBondContact OH-O 3.34Å; L379-E383 WeakPolarHBondContact O-CB 3.45Å; L379-E383 WeakPolarHBondContact O-CG 3.35Å; L379-E383 PolarHBondContact O-N 3.09Å; I380-E383 PolarHBondContact O-N 3.45Å; E383-F385 VanDerWaalsContact C-N 3.31Å; E383-F385 PolarHBondContact O-N 2.86Å; E383-M399 HydrophobicContact CG-SD 4.37Å; E383-W403 PolarHBondContact OE1-NE1 3.47Å; E383-W403 WeakPolarHBondContact OE2-CZ2 3.37Å; E383-L457 HydrophobicContact CB-CD1 3.9Å; E383-L457 HydrophobicContact CB-CD2 4.49Å |
| 384 | L | 96.3 | Very high | 94.1 | Very high | 18 Ų | 18 | 56.7 Ų | 56.7 | 9% | 0.094 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -64.9 | -32.6 | 173.9 | -82.8 | 168 | 0 | 0 | 0 | 113.5 | I380 T381 V382 Q454 L457 Y458 L461 | I380-L384 WeakPolarHBondContact O-CG 3.13Å; I380-L384 PolarHBondContact O-N 3.06Å; T381-L384 WeakPolarHBondContact O-CB 3.39Å; T381-L384 PolarHBondContact O-N 2.84Å; V382-L384 VanDerWaalsContact C-N 3.26Å; V382-L384 PolarHBondContact O-N 3.41Å; L384-Q454 HydrophobicContact CD2-CG 3.89Å; L384-L457 HydrophobicContact CB-CD1 4.47Å; L384-L457 HydrophobicContact CD2-CB 3.66Å; L384-L457 HydrophobicContact CD2-CD1 3.81Å; L384-L457 HydrophobicContact CD2-CG 4.4Å; L384-L457 HydrophobicContact CG-CB 3.9Å; L384-L457 HydrophobicContact CG-CD1 3.79Å; L384-Y458 HydrophobicContact CD1-CD1 4.33Å; L384-Y458 HydrophobicContact CD1-CE1 4.04Å; L384-Y458 HydrophobicContact CD2-CD2 4.45Å; L384-Y458 HydrophobicContact CD2-CE1 4.41Å; L384-Y458 HydrophobicContact CD2-CE2 4.19Å; L384-L461 HydrophobicContact CD1-CD1 3.64Å |
| 385 | F | 94.8 | Very high | 94 | Very high | 165 Ų | 165 | 55.3 Ų | 55.3 | 72% | 0.724 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -112.7 | -24.6 | -172.1 | -63.4 | -66 | 0 | 0 | 0 | 114 | T381 V382 E383 | T381-F385 HydrophobicContact CG2-CD2 4.05Å; T381-F385 HydrophobicContact CG2-CE2 3.89Å; T381-F385 WeakPolarHBondContact O-CD2 3.5Å; T381-F385 PolarHBondContact O-N 3.05Å; V382-F385 PolarHBondContact O-N 2.75Å; V382-F385 VanDerWaalsContact O-N 3.1Å; E383-F385 VanDerWaalsContact C-N 3.31Å; E383-F385 PolarHBondContact O-N 2.86Å |
| 386 | W | 94.8 | Very high | 93.9 | Very high | 54 Ų | 54 | 54.4 Ų | 54.4 | 21% | 0.205 | 28% | 0.281 | C | S | . | . | P | Polyproline II helix | trans | -80.6 | 130 | -179.1 | 178.6 | 72.4 | 0 | 0 | 0 | 110.1 | Y328 V382 P388 I395 F396 M399 | Y328-W386 HydrophobicContact CD1-CE3 4.27Å; Y328-W386 HydrophobicContact CD1-CZ3 4.07Å; Y328-W386 HydrophobicContact CE1-CE3 4.47Å; V382-W386 HydrophobicContact CG1-CB 3.87Å; V382-W386 HydrophobicContact CG1-CG 4.49Å; V382-W386 WeakPolarHBondContact O-CA 3.09Å; V382-W386 WeakPolarHBondContact O-CB 3.25Å; V382-W386 PolarHBondContact O-N 3.44Å; W386-P388 HydrophobicContact CE3-CG 4.37Å; W386-P388 HydrophobicContact CH2-CB 4.29Å; W386-P388 HydrophobicContact CZ3-CB 4.2Å; W386-P388 HydrophobicContact CZ3-CG 4.04Å; W386-I395 HydrophobicContact CD2-CG2 4.31Å; W386-I395 HydrophobicContact CH2-CB 4.17Å; W386-I395 HydrophobicContact CH2-CG2 3.78Å; W386-I395 HydrophobicContact CZ2-CB 3.78Å; W386-I395 HydrophobicContact CZ2-CD1 3.96Å; W386-I395 HydrophobicContact CZ2-CG1 4.47Å; W386-I395 HydrophobicContact CZ2-CG2 3.46Å; W386-I395 VanDerWaalsContact CZ2-CG2 3.46Å; W386-I395 HydrophobicContact CZ3-CG2 4.35Å; W386-F396 HydrophobicContact CH2-CD1 4.18Å; W386-F396 HydrophobicContact CH2-CD2 4.04Å; W386-F396 AromaticContact CH2-CE1 3.85Å; W386-F396 HydrophobicContact CH2-CE1 3.85Å; W386-F396 AromaticContact CH2-CE2 3.72Å; W386-F396 HydrophobicContact CH2-CE2 3.72Å; W386-F396 HydrophobicContact CH2-CG 4.28Å; W386-F396 AromaticContact CH2-CZ 3.64Å; W386-F396 HydrophobicContact CH2-CZ 3.64Å; W386-F396 HydrophobicContact CZ2-CE2 4.3Å; W386-F396 HydrophobicContact CZ2-CZ 4.46Å; W386-F396 HydrophobicContact CZ3-CE1 4.24Å; W386-F396 HydrophobicContact CZ3-CZ 4.41Å; W386-M399 HydrophobicContact CB-CE 4.36Å; W386-M399 HydrophobicContact CD2-CE 3.64Å; W386-M399 HydrophobicContact CE3-CE 3.41Å; W386-M399 VanDerWaalsContact CE3-CE 3.41Å; W386-M399 HydrophobicContact CE3-SD 3.8Å; W386-M399 HydrophobicContact CG-CE 4.06Å; W386-M399 HydrophobicContact CH2-CE 4.49Å; W386-M399 HydrophobicContact CH2-SD 4.39Å; W386-M399 HydrophobicContact CZ3-CE 3.86Å; W386-M399 HydrophobicContact CZ3-SD 3.69Å |
| 387 | R | 90.5 | Very high | 93.8 | Very high | 85 Ų | 85 | 58 Ų | 58 | 32% | 0.321 | 30% | 0.295 | S | S | . | . | P | Polyproline II helix | trans | -94.4 | 124.9 | 175.7 | -171.5 | 171.5 | 173.2 | -151.2 | -12.6 | 109.8 | E215 L218 N389 | E215-R387 PolarHBondContact O-NH2 3.35Å; E215-R387 IonicContact OE1-CZ 3.13Å; E215-R387 IonicContact OE1-NH1 2.64Å; E215-R387 PolarHBondContact OE1-NH1 3.49Å; E215-R387 IonicContact OE1-NH2 2.66Å; E215-R387 PolarHBondContact OE1-NH2 3.17Å; E215-R387 VanDerWaalsContact OE1-NH2 3.13Å; L218-R387 VanDerWaalsContact CB-NH2 3.25Å; L218-R387 PolarHBondContact O-NE 2.99Å; R387-N389 PolarHBondContact O-N 3Å |
| 388 | P | 91 | Very high | 93.7 | Very high | 1 Ų | 1 | 57.4 Ų | 57.4 | 1% | 0.006 | 30% | 0.301 | C | S | . | . | P | Polyproline II helix | trans | -57.2 | 128.3 | 174.7 | -26.9 | 37.1 | 0 | 0 | 0 | 111.5 | C221 Y328 A332 W386 F396 | C221-P388 HydrophobicContact CB-CB 4.35Å; C221-P388 HydrophobicContact CB-CG 4.2Å; Y328-P388 HydrophobicContact CD1-CG 3.59Å; Y328-P388 HydrophobicContact CE1-CG 4.19Å; Y328-P388 HydrophobicContact CG-CG 4.23Å; A332-P388 HydrophobicContact CB-CB 3.62Å; W386-P388 HydrophobicContact CE3-CG 4.37Å; W386-P388 HydrophobicContact CH2-CB 4.29Å; W386-P388 HydrophobicContact CZ3-CB 4.2Å; W386-P388 HydrophobicContact CZ3-CG 4.04Å; P388-F396 HydrophobicContact CB-CE1 3.91Å; P388-F396 HydrophobicContact CB-CZ 3.78Å |
| 389 | N | 88.9 | Confident | 93.6 | Very high | 44 Ų | 44 | 54.1 Ų | 54.1 | 24% | 0.235 | 28% | 0.281 | C | S | . | . | trans | -136.6 | 127.9 | 175.6 | -177.4 | -43.1 | 0 | 0 | 0 | 110 | R387 D391 N392 F396 | R387-N389 PolarHBondContact O-N 3Å; N389-D391 VanDerWaalsContact C-N 3.25Å; N389-D391 PolarHBondContact O-N 3.32Å; N389-D391 VanDerWaalsContact OD1-CB 3.27Å; N389-D391 WeakPolarHBondContact OD1-CB 3.4Å; N389-D391 PolarHBondContact OD1-N 3.49Å; N389-D391 PolarHBondContact OD1-OD2 3.13Å; N389-N392 PolarHBondContact O-N 2.9Å; N389-F396 WeakPolarHBondContact O-CE2 3.07Å | ||
| 390 | P | 86.5 | Confident | 93.6 | Very high | 44 Ų | 44 | 53.8 Ų | 53.8 | 29% | 0.286 | 28% | 0.279 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.5 | -21.7 | -177.1 | 26.4 | -35.1 | 0 | 0 | 0 | 115 | L333 N392 P393 | L333-P390 HydrophobicContact CD2-CB 4Å; P390-N392 PolarHBondContact O-N 3.04Å; P390-P393 WeakPolarHBondContact O-CD 3.49Å |
| 391 | D | 87.9 | Confident | 93.5 | Very high | 128 Ų | 128 | 54 Ų | 54 | 68% | 0.684 | 28% | 0.282 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -66.1 | -22.4 | 179.6 | -64.6 | -29.6 | 0 | 0 | 0 | 112.6 | N389 P393 | N389-D391 VanDerWaalsContact C-N 3.25Å; N389-D391 PolarHBondContact O-N 3.32Å; N389-D391 VanDerWaalsContact OD1-CB 3.27Å; N389-D391 WeakPolarHBondContact OD1-CB 3.4Å; N389-D391 PolarHBondContact OD1-N 3.49Å; N389-D391 PolarHBondContact OD1-OD2 3.13Å; D391-P393 VanDerWaalsContact O-CD 3.28Å; D391-P393 WeakPolarHBondContact O-CD 3.33Å |
| 392 | N | 88.4 | Confident | 93.6 | Very high | 92 Ų | 92 | 54.9 Ų | 54.9 | 49% | 0.492 | 28% | 0.283 | S | S | . | . | trans | -120.2 | 63.6 | -179.2 | -66.4 | -71.2 | 0 | 0 | 0 | 111.4 | N389 P390 I394 I395 | N389-N392 PolarHBondContact O-N 2.9Å; P390-N392 PolarHBondContact O-N 3.04Å; N392-I394 PolarHBondContact O-N 3.27Å; N392-I394 VanDerWaalsContact O-N 3.12Å; N392-I395 HydrophobicContact CB-CD1 3.77Å; N392-I395 HydrophobicContact CB-CG1 4.2Å; N392-I395 PolarHBondContact O-N 2.66Å | ||
| 393 | P | 88.4 | Confident | 93.6 | Very high | 51 Ų | 51 | 52 Ų | 52 | 33% | 0.331 | 27% | 0.266 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -64.4 | -24.8 | -173.3 | 28.1 | -34.7 | 0 | 0 | 0 | 112.2 | L333 P390 D391 I395 F396 Y397 | L333-P393 HydrophobicContact CD2-CB 4.38Å; P390-P393 WeakPolarHBondContact O-CD 3.49Å; D391-P393 VanDerWaalsContact O-CD 3.28Å; D391-P393 WeakPolarHBondContact O-CD 3.33Å; P393-I395 PolarHBondContact O-N 2.66Å; P393-F396 WeakPolarHBondContact O-CD2 3.46Å; P393-F396 PolarHBondContact O-N 2.97Å; P393-F396 VanDerWaalsContact O-N 3.15Å; P393-Y397 HydrophobicContact CB-CE2 4.38Å; P393-Y397 WeakPolarHBondContact O-CD2 3.3Å |
| 394 | I | 93.3 | Very high | 93.6 | Very high | 136 Ų | 136 | 52 Ų | 52 | 70% | 0.697 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -55.6 | -34.1 | 178.9 | -60.5 | 174 | 0 | 0 | 0 | 111.8 | N392 F396 Y397 A398 | N392-I394 PolarHBondContact O-N 3.27Å; N392-I394 VanDerWaalsContact O-N 3.12Å; I394-F396 VanDerWaalsContact C-N 3.31Å; I394-F396 PolarHBondContact O-N 3.33Å; I394-Y397 PolarHBondContact O-N 3.5Å; I394-A398 WeakPolarHBondContact O-CB 3.45Å; I394-A398 PolarHBondContact O-N 3.13Å |
| 395 | I | 94.6 | Very high | 93.6 | Very high | 55 Ų | 55 | 52.2 Ų | 52.2 | 28% | 0.282 | 27% | 0.268 | S | S | . | . | H | α-helix | trans | -63.8 | -38.3 | -177.6 | -59.3 | 176.3 | 0 | 0 | 0 | 110.9 | W386 N392 P393 A398 M399 | W386-I395 HydrophobicContact CD2-CG2 4.31Å; W386-I395 HydrophobicContact CH2-CB 4.17Å; W386-I395 HydrophobicContact CH2-CG2 3.78Å; W386-I395 HydrophobicContact CZ2-CB 3.78Å; W386-I395 HydrophobicContact CZ2-CD1 3.96Å; W386-I395 HydrophobicContact CZ2-CG1 4.47Å; W386-I395 HydrophobicContact CZ2-CG2 3.46Å; W386-I395 VanDerWaalsContact CZ2-CG2 3.46Å; W386-I395 HydrophobicContact CZ3-CG2 4.35Å; N392-I395 HydrophobicContact CB-CD1 3.77Å; N392-I395 HydrophobicContact CB-CG1 4.2Å; N392-I395 PolarHBondContact O-N 2.66Å; P393-I395 PolarHBondContact O-N 2.66Å; I395-A398 PolarHBondContact O-N 3.37Å; I395-M399 HydrophobicContact CG2-CE 3.56Å; I395-M399 HydrophobicContact CG2-CG 4.29Å; I395-M399 HydrophobicContact CG2-SD 4.03Å; I395-M399 WeakPolarHBondContact O-CB 3.13Å; I395-M399 VanDerWaalsContact O-CG 3.3Å; I395-M399 WeakPolarHBondContact O-CG 3.48Å; I395-M399 PolarHBondContact O-N 3.22Å |
| 396 | F | 95.8 | Very high | 93.7 | Very high | 0 Ų | 0 | 44.3 Ų | 44.3 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -63.9 | -44.7 | 178.5 | -61.3 | -99.1 | 0 | 0 | 0 | 111.9 | Y328 V329 A332 L333 V341 W386 P388 N389 P393 I394 M399 S400 | Y328-F396 WeakPolarHBondContact O-CE1 3.44Å; V329-F396 HydrophobicContact CG2-CD1 4.22Å; A332-F396 HydrophobicContact CB-CE1 4.14Å; A332-F396 HydrophobicContact CB-CZ 3.82Å; L333-F396 HydrophobicContact CD1-CB 4.1Å; L333-F396 HydrophobicContact CD1-CD1 3.95Å; L333-F396 HydrophobicContact CD1-CD2 3.67Å; L333-F396 HydrophobicContact CD1-CE1 4.22Å; L333-F396 HydrophobicContact CD1-CE2 3.95Å; L333-F396 HydrophobicContact CD1-CG 3.64Å; L333-F396 HydrophobicContact CD1-CZ 4.21Å; L333-F396 HydrophobicContact CD2-CD2 4.48Å; L333-F396 HydrophobicContact CD2-CE2 4.05Å; L333-F396 HydrophobicContact CD2-CZ 4.34Å; L333-F396 HydrophobicContact CG-CD1 4.43Å; L333-F396 HydrophobicContact CG-CD2 4.25Å; L333-F396 HydrophobicContact CG-CE1 4.21Å; L333-F396 HydrophobicContact CG-CE2 4.01Å; L333-F396 HydrophobicContact CG-CG 4.44Å; L333-F396 HydrophobicContact CG-CZ 3.97Å; V341-F396 HydrophobicContact CG1-CB 4.44Å; V341-F396 HydrophobicContact CG2-CB 4.14Å; W386-F396 HydrophobicContact CH2-CD1 4.18Å; W386-F396 HydrophobicContact CH2-CD2 4.04Å; W386-F396 AromaticContact CH2-CE1 3.85Å; W386-F396 HydrophobicContact CH2-CE1 3.85Å; W386-F396 AromaticContact CH2-CE2 3.72Å; W386-F396 HydrophobicContact CH2-CE2 3.72Å; W386-F396 HydrophobicContact CH2-CG 4.28Å; W386-F396 AromaticContact CH2-CZ 3.64Å; W386-F396 HydrophobicContact CH2-CZ 3.64Å; W386-F396 HydrophobicContact CZ2-CE2 4.3Å; W386-F396 HydrophobicContact CZ2-CZ 4.46Å; W386-F396 HydrophobicContact CZ3-CE1 4.24Å; W386-F396 HydrophobicContact CZ3-CZ 4.41Å; P388-F396 HydrophobicContact CB-CE1 3.91Å; P388-F396 HydrophobicContact CB-CZ 3.78Å; N389-F396 WeakPolarHBondContact O-CE2 3.07Å; P393-F396 WeakPolarHBondContact O-CD2 3.46Å; P393-F396 PolarHBondContact O-N 2.97Å; P393-F396 VanDerWaalsContact O-N 3.15Å; I394-F396 VanDerWaalsContact C-N 3.31Å; I394-F396 PolarHBondContact O-N 3.33Å; F396-M399 PolarHBondContact O-N 2.78Å; F396-S400 VanDerWaalsContact O-CB 3.3Å; F396-S400 WeakPolarHBondContact O-CB 3.31Å; F396-S400 PolarHBondContact O-N 3.08Å |
| 397 | Y | 96.2 | Very high | 93.7 | Very high | 76 Ų | 76 | 42.1 Ų | 42.1 | 30% | 0.298 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -64.6 | -42.5 | 175.6 | -61.8 | -86.7 | 0 | 0 | 0 | 111.3 | F340 V341 C344 P393 I394 S400 G401 | F340-Y397 HydrophobicContact CB-CE1 3.98Å; F340-Y397 WeakPolarHBondContact O-CE1 3.24Å; V341-Y397 HydrophobicContact CG2-CD1 4.22Å; V341-Y397 HydrophobicContact CG2-CE1 3.96Å; V341-Y397 HydrophobicContact CG2-CE2 4.42Å; C344-Y397 HydrophobicContact CB-CD1 4.39Å; C344-Y397 PolarHBondContact SG-O 3.4Å; P393-Y397 HydrophobicContact CB-CE2 4.38Å; P393-Y397 WeakPolarHBondContact O-CD2 3.3Å; I394-Y397 PolarHBondContact O-N 3.5Å; Y397-S400 PolarHBondContact O-N 3.2Å; Y397-G401 PolarHBondContact O-N 2.04Å |
| 398 | A | 96.6 | Very high | 93.7 | Very high | 50 Ų | 50 | 38 Ų | 38 | 41% | 0.413 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -62.8 | -45 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | I394 I395 G401 L402 | I394-A398 WeakPolarHBondContact O-CB 3.45Å; I394-A398 PolarHBondContact O-N 3.13Å; I395-A398 PolarHBondContact O-N 3.37Å; A398-G401 PolarHBondContact O-N 3.27Å; A398-L402 WeakPolarHBondContact O-CB 3.48Å; A398-L402 VanDerWaalsContact O-CG 3.29Å; A398-L402 WeakPolarHBondContact O-CG 3.48Å; A398-L402 PolarHBondContact O-N 3.16Å |
| 399 | M | 96.5 | Very high | 93.9 | Very high | 9 Ų | 9 | 38 Ų | 38 | 4% | 0.044 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -60.7 | -50 | 175.2 | -73.7 | 177.5 | 174.8 | 0 | 0 | 111.4 | F324 L379 V382 E383 W386 I395 F396 G401 L402 W403 | F324-M399 HydrophobicContact CE2-CB 4.2Å; F324-M399 HydrophobicContact CE2-SD 4.49Å; F324-M399 HydrophobicContact CZ-CB 4.14Å; L379-M399 HydrophobicContact CD2-CB 4.43Å; L379-M399 HydrophobicContact CD2-CG 4.32Å; V382-M399 HydrophobicContact CG1-CE 3.43Å; V382-M399 VanDerWaalsContact CG1-CE 3.43Å; E383-M399 HydrophobicContact CG-SD 4.37Å; W386-M399 HydrophobicContact CB-CE 4.36Å; W386-M399 HydrophobicContact CD2-CE 3.64Å; W386-M399 HydrophobicContact CE3-CE 3.41Å; W386-M399 VanDerWaalsContact CE3-CE 3.41Å; W386-M399 HydrophobicContact CE3-SD 3.8Å; W386-M399 HydrophobicContact CG-CE 4.06Å; W386-M399 HydrophobicContact CH2-CE 4.49Å; W386-M399 HydrophobicContact CH2-SD 4.39Å; W386-M399 HydrophobicContact CZ3-CE 3.86Å; W386-M399 HydrophobicContact CZ3-SD 3.69Å; I395-M399 HydrophobicContact CG2-CE 3.56Å; I395-M399 HydrophobicContact CG2-CG 4.29Å; I395-M399 HydrophobicContact CG2-SD 4.03Å; I395-M399 WeakPolarHBondContact O-CB 3.13Å; I395-M399 VanDerWaalsContact O-CG 3.3Å; I395-M399 WeakPolarHBondContact O-CG 3.48Å; I395-M399 PolarHBondContact O-N 3.22Å; F396-M399 PolarHBondContact O-N 2.78Å; M399-G401 VanDerWaalsContact C-N 3.35Å; M399-G401 PolarHBondContact O-N 2.93Å; M399-L402 PolarHBondContact O-N 3.11Å; M399-L402 VanDerWaalsContact O-N 3.17Å; M399-W403 VanDerWaalsContact O-CD1 3.27Å; M399-W403 PolarHBondContact O-N 3.44Å |
| 400 | S | 96.9 | Very high | 94.1 | Very high | 0 Ų | 0 | 36 Ų | 36 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -60 | -42.5 | 178.8 | -175.5 | 0 | 0 | 0 | 0 | 112.5 | V341 F345 F396 Y397 W403 G404 | V341-S400 VanDerWaalsContact CG1-CB 3.46Å; V341-S400 PolarHBondContact O-OG 2.79Å; F345-S400 WeakPolarHBondContact CA-O 3.48Å; F345-S400 WeakPolarHBondContact CB-O 3.25Å; F345-S400 VanDerWaalsContact CB-OG 3.25Å; F345-S400 WeakPolarHBondContact CB-OG 3.19Å; F345-S400 PolarHBondContact N-OG 3.39Å; F396-S400 VanDerWaalsContact O-CB 3.3Å; F396-S400 WeakPolarHBondContact O-CB 3.31Å; F396-S400 PolarHBondContact O-N 3.08Å; Y397-S400 PolarHBondContact O-N 3.2Å; S400-W403 WeakPolarHBondContact O-CB 3.35Å; S400-W403 PolarHBondContact O-N 2.96Å; S400-G404 PolarHBondContact O-N 3.36Å |
| 401 | G | 97.2 | Very high | 94.2 | Very high | 6 Ų | 6 | 35.8 Ų | 35.8 | 6% | 0.062 | 19% | 0.194 | C | C | . | . | H | α-helix | trans | -62 | -43.6 | 173.8 | 0 | 0 | 0 | 0 | 0 | 112.7 | V348 Y397 A398 M399 G404 V405 | V348-G401 WeakPolarHBondContact CG1-O 3.1Å; Y397-G401 PolarHBondContact O-N 2.04Å; A398-G401 PolarHBondContact O-N 3.27Å; M399-G401 VanDerWaalsContact C-N 3.35Å; M399-G401 PolarHBondContact O-N 2.93Å; G401-G404 CarbonylContact O-C 3.55Å; G401-G404 WeakPolarHBondContact O-CA 3.42Å; G401-G404 PolarHBondContact O-N 2.9Å; G401-V405 PolarHBondContact O-N 3.35Å |
| 402 | L | 97.8 | Very high | 94.1 | Very high | 78 Ų | 78 | 31.3 Ų | 31.3 | 41% | 0.408 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -67.6 | -35.5 | 177.5 | -73.7 | 172 | 0 | 0 | 0 | 112.7 | V375 L379 A398 M399 G404 V405 G406 | V375-L402 HydrophobicContact CG1-CB 4.13Å; V375-L402 HydrophobicContact CG1-CD2 4.35Å; V375-L402 WeakPolarHBondContact CG1-O 3.44Å; L379-L402 HydrophobicContact CD1-CB 3.71Å; L379-L402 HydrophobicContact CD2-CB 3.8Å; L379-L402 HydrophobicContact CD2-CD1 3.91Å; L379-L402 HydrophobicContact CG-CB 4.11Å; A398-L402 WeakPolarHBondContact O-CB 3.48Å; A398-L402 VanDerWaalsContact O-CG 3.29Å; A398-L402 WeakPolarHBondContact O-CG 3.48Å; A398-L402 PolarHBondContact O-N 3.16Å; M399-L402 PolarHBondContact O-N 3.11Å; M399-L402 VanDerWaalsContact O-N 3.17Å; L402-G404 PolarHBondContact O-N 3.47Å; L402-V405 HydrophobicContact CD2-CG2 4.47Å; L402-V405 WeakPolarHBondContact O-CB 3.16Å; L402-V405 PolarHBondContact O-N 2.64Å; L402-V405 VanDerWaalsContact O-N 3.11Å; L402-G406 PolarHBondContact O-N 2.77Å; L402-G406 VanDerWaalsContact O-N 3.12Å |
| 403 | W | 97.7 | Very high | 94.1 | Very high | 0 Ų | 0 | 26.9 Ų | 26.9 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -57.6 | -41.7 | 167.1 | -86.4 | 108.5 | 0 | 0 | 0 | 110.6 | E316 F319 I320 F345 H376 L379 I380 E383 M399 S400 V405 G406 D407 | E316-W403 HydrophobicContact CB-CH2 4.45Å; E316-W403 HydrophobicContact CB-CZ3 3.73Å; F319-W403 AromaticContact CD1-CH2 3.93Å; F319-W403 HydrophobicContact CD1-CH2 3.93Å; F319-W403 AromaticContact CD1-CZ2 3.61Å; F319-W403 HydrophobicContact CD1-CZ2 3.61Å; F319-W403 HydrophobicContact CE1-CH2 4.34Å; F319-W403 AromaticContact CE1-CZ2 3.61Å; F319-W403 HydrophobicContact CE1-CZ2 3.61Å; I320-W403 HydrophobicContact CD1-CB 3.91Å; I320-W403 HydrophobicContact CD1-CD2 4.37Å; I320-W403 HydrophobicContact CD1-CG 3.73Å; I320-W403 HydrophobicContact CG1-CB 4.22Å; I320-W403 HydrophobicContact CG1-CG 4.37Å; F345-W403 HydrophobicContact CD2-CB 4.14Å; F345-W403 HydrophobicContact CE2-CB 4.46Å; H376-W403 AromaticContact CD2-CE3 4Å; H376-W403 AromaticContact CE1-CE3 3.69Å; H376-W403 AromaticContact CE1-CZ3 3.76Å; H376-W403 AromaticContact ND1-CZ3 3.87Å; H376-W403 AromaticContact NE2-CE3 3.54Å; H376-W403 AromaticContact NE2-CZ3 3.97Å; H376-W403 PolarHBondContact NE2-O 3.35Å; L379-W403 HydrophobicContact CD1-CB 4.42Å; L379-W403 HydrophobicContact CD1-CD2 4.09Å; L379-W403 HydrophobicContact CD1-CG 3.89Å; I380-W403 HydrophobicContact CD1-CH2 4.22Å; I380-W403 HydrophobicContact CG1-CH2 3.83Å; I380-W403 HydrophobicContact CG1-CZ2 4.02Å; E383-W403 PolarHBondContact OE1-NE1 3.47Å; E383-W403 WeakPolarHBondContact OE2-CZ2 3.37Å; M399-W403 VanDerWaalsContact O-CD1 3.27Å; M399-W403 PolarHBondContact O-N 3.44Å; S400-W403 WeakPolarHBondContact O-CB 3.35Å; S400-W403 PolarHBondContact O-N 2.96Å; W403-V405 VanDerWaalsContact C-N 3.31Å; W403-V405 PolarHBondContact O-N 3.33Å; W403-G406 PolarHBondContact O-N 3.49Å; W403-D407 WeakPolarHBondContact O-CB 3.44Å; W403-D407 PolarHBondContact O-N 3.06Å |
| 404 | G | 95.8 | Very high | 94.3 | Very high | 0 Ų | 0 | 24.5 Ų | 24.5 | 0% | 0 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -61.8 | -35.2 | 173.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | F345 N349 S400 G401 L402 A408 | F345-G404 VanDerWaalsContact CD2-CA 3.48Å; N349-G404 WeakPolarHBondContact CA-O 3.08Å; S400-G404 PolarHBondContact O-N 3.36Å; G401-G404 CarbonylContact O-C 3.55Å; G401-G404 WeakPolarHBondContact O-CA 3.42Å; G401-G404 PolarHBondContact O-N 2.9Å; L402-G404 PolarHBondContact O-N 3.47Å; G404-A408 VanDerWaalsContact O-CB 3.29Å; G404-A408 WeakPolarHBondContact O-CB 3.24Å; G404-A408 PolarHBondContact O-N 2.95Å; G404-A408 VanDerWaalsContact O-N 3.11Å |
| 405 | V | 96.6 | Very high | 94 | Very high | 22 Ų | 22 | 20.6 Ų | 20.6 | 13% | 0.133 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -62.9 | -49 | 174.3 | 178.6 | 0 | 0 | 0 | 0 | 110.9 | V348 F356 G401 L402 W403 V409 | V348-V405 HydrophobicContact CG1-CG2 3.5Å; V348-V405 VanDerWaalsContact CG1-CG2 3.5Å; F356-V405 HydrophobicContact CE2-CG1 4.05Å; F356-V405 HydrophobicContact CZ-CG1 3.99Å; G401-V405 PolarHBondContact O-N 3.35Å; L402-V405 HydrophobicContact CD2-CG2 4.47Å; L402-V405 WeakPolarHBondContact O-CB 3.16Å; L402-V405 PolarHBondContact O-N 2.64Å; L402-V405 VanDerWaalsContact O-N 3.11Å; W403-V405 VanDerWaalsContact C-N 3.31Å; W403-V405 PolarHBondContact O-N 3.33Å; V405-V409 WeakPolarHBondContact O-CG2 3.48Å; V405-V409 PolarHBondContact O-N 3.23Å |
| 406 | G | 95.8 | Very high | 93.4 | Very high | 0 Ų | 0 | 19.7 Ų | 19.7 | 0% | 0 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -73.7 | -40.2 | -177 | 0 | 0 | 0 | 0 | 0 | 113 | H376 L402 W403 A408 V409 W410 | H376-G406 WeakPolarHBondContact NE2-CA 3.4Å; L402-G406 PolarHBondContact O-N 2.77Å; L402-G406 VanDerWaalsContact O-N 3.12Å; W403-G406 PolarHBondContact O-N 3.49Å; G406-A408 VanDerWaalsContact C-N 3.28Å; G406-A408 PolarHBondContact O-N 3.38Å; G406-V409 WeakPolarHBondContact O-CA 3.25Å; G406-V409 WeakPolarHBondContact O-CB 3.34Å; G406-V409 PolarHBondContact O-N 3.01Å; G406-W410 VanDerWaalsContact C-CD1 3.49Å; G406-W410 PolarHBondContact O-N 3.26Å; G406-W410 PolarHBondContact O-NE1 3.01Å |
| 407 | D | 94.7 | Very high | 93.1 | Very high | 7 Ų | 7 | 19.7 Ų | 19.7 | 4% | 0.037 | 12% | 0.117 | C | C | . | . | H | α-helix | trans | -54.8 | -45.3 | 171.6 | 178.1 | 66.7 | 0 | 0 | 0 | 110.8 | Q317 F345 N349 W403 V409 W410 Q411 | Q317-D407 WeakPolarHBondContact CG-OD1 3.32Å; Q317-D407 PolarHBondContact NE2-OD1 3.29Å; F345-D407 HydrophobicContact CE2-CB 4.06Å; F345-D407 HydrophobicContact CZ-CB 4.28Å; N349-D407 PolarHBondContact ND2-OD2 3.44Å; N349-D407 PolarHBondContact OD1-OD2 2.69Å; W403-D407 WeakPolarHBondContact O-CB 3.44Å; W403-D407 PolarHBondContact O-N 3.06Å; D407-V409 VanDerWaalsContact C-N 3.29Å; D407-V409 PolarHBondContact O-N 2.78Å; D407-W410 PolarHBondContact O-N 3.42Å; D407-Q411 VanDerWaalsContact O-CB 3.29Å; D407-Q411 WeakPolarHBondContact O-CB 3.43Å; D407-Q411 WeakPolarHBondContact O-CG 3.25Å; D407-Q411 PolarHBondContact O-N 3.09Å; D407-Q411 WeakPolarHBondContact OD1-CG 3.13Å |
| 408 | A | 91.9 | Very high | 92.7 | Very high | 0 Ų | 0 | 16.1 Ų | 16.1 | 0% | 0 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -58.2 | -39.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 112.7 | N349 C352 F356 G404 G406 T412 | N349-A408 WeakPolarHBondContact OD1-CA 3.42Å; N349-A408 VanDerWaalsContact OD1-CB 3.28Å; N349-A408 WeakPolarHBondContact OD1-CB 3.43Å; N349-A408 PolarHBondContact OD1-N 2.94Å; C352-A408 HydrophobicContact CB-CB 3.51Å; F356-A408 HydrophobicContact CD2-CB 4.24Å; F356-A408 HydrophobicContact CE2-CB 4.41Å; G404-A408 VanDerWaalsContact O-CB 3.29Å; G404-A408 WeakPolarHBondContact O-CB 3.24Å; G404-A408 PolarHBondContact O-N 2.95Å; G404-A408 VanDerWaalsContact O-N 3.11Å; G406-A408 VanDerWaalsContact C-N 3.28Å; G406-A408 PolarHBondContact O-N 3.38Å; A408-T412 WeakPolarHBondContact O-CB 3.35Å; A408-T412 VanDerWaalsContact O-CG2 3.26Å; A408-T412 WeakPolarHBondContact O-CG2 3.48Å; A408-T412 PolarHBondContact O-N 3.16Å; A408-T412 VanDerWaalsContact O-N 3.09Å; A408-T412 PolarHBondContact O-OG1 3.2Å |
| 409 | V | 94 | Very high | 91.9 | Very high | 0 Ų | 0 | 14.3 Ų | 14.3 | 0% | 0 | 9% | 0.089 | C | C | . | . | H | α-helix | trans | -63.1 | -53.8 | 175 | 168.1 | 0 | 0 | 0 | 0 | 110 | F356 I368 I369 V405 G406 D407 T412 Q413 | F356-V409 HydrophobicContact CD2-CG2 3.62Å; F356-V409 HydrophobicContact CE2-CG2 3.43Å; F356-V409 VanDerWaalsContact CE2-CG2 3.43Å; F356-V409 HydrophobicContact CG-CG2 4.48Å; F356-V409 HydrophobicContact CZ-CG2 4.17Å; I368-V409 HydrophobicContact CG2-CG1 4.14Å; I368-V409 HydrophobicContact CG2-CG2 3.92Å; I368-V409 VanDerWaalsContact O-CG1 3.24Å; I368-V409 WeakPolarHBondContact O-CG1 3.38Å; I369-V409 HydrophobicContact CG1-CG1 4.4Å; V405-V409 WeakPolarHBondContact O-CG2 3.48Å; V405-V409 PolarHBondContact O-N 3.23Å; G406-V409 WeakPolarHBondContact O-CA 3.25Å; G406-V409 WeakPolarHBondContact O-CB 3.34Å; G406-V409 PolarHBondContact O-N 3.01Å; D407-V409 VanDerWaalsContact C-N 3.29Å; D407-V409 PolarHBondContact O-N 2.78Å; V409-T412 PolarHBondContact O-N 3.05Å; V409-T412 PolarHBondContact O-OG1 3.09Å; V409-Q413 HydrophobicContact CG1-CG 4.22Å; V409-Q413 WeakPolarHBondContact O-CB 3.37Å; V409-Q413 WeakPolarHBondContact O-CG 3.47Å; V409-Q413 PolarHBondContact O-N 3.01Å |
| 410 | W | 93.6 | Very high | 91.4 | Very high | 1 Ų | 1 | 16.9 Ų | 16.9 | 0% | 0.004 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -64.8 | -47 | -174 | -53.9 | 124.1 | 0 | 0 | 0 | 111.6 | I309 F312 I313 E316 I369 G372 A373 H376 G406 D407 T412 I414 L464 | I309-W410 HydrophobicContact CD1-CE3 4.21Å; I309-W410 HydrophobicContact CD1-CH2 4.39Å; I309-W410 HydrophobicContact CD1-CZ3 4.03Å; I309-W410 HydrophobicContact CG1-CE3 4.37Å; I309-W410 HydrophobicContact CG1-CZ3 4.44Å; F312-W410 AromaticContact CE1-NE1 3.81Å; I313-W410 HydrophobicContact CD1-CB 3.78Å; I313-W410 HydrophobicContact CG1-CB 3.62Å; I313-W410 HydrophobicContact CG1-CG 4.35Å; E316-W410 VanDerWaalsContact OE1-CD1 3.31Å; I369-W410 HydrophobicContact CG2-CH2 4.38Å; I369-W410 HydrophobicContact CG2-CZ3 3.84Å; G372-W410 WeakPolarHBondContact O-CZ2 3.44Å; A373-W410 HydrophobicContact CB-CH2 3.92Å; A373-W410 HydrophobicContact CB-CZ2 4.31Å; A373-W410 VanDerWaalsContact N-CZ2 3.28Å; H376-W410 AromaticContact CE1-CD1 3.55Å; H376-W410 AromaticContact CE1-NE1 3.29Å; H376-W410 PolarHBondContact CE1-NE1 2.85Å; H376-W410 VanDerWaalsContact CE1-NE1 3.29Å; H376-W410 AromaticContact CG-NE1 3.78Å; H376-W410 AromaticContact ND1-CD1 3.67Å; H376-W410 AromaticContact ND1-NE1 3Å; H376-W410 PolarHBondContact ND1-NE1 3.16Å; G406-W410 VanDerWaalsContact C-CD1 3.49Å; G406-W410 PolarHBondContact O-N 3.26Å; G406-W410 PolarHBondContact O-NE1 3.01Å; D407-W410 PolarHBondContact O-N 3.42Å; W410-T412 PolarHBondContact O-N 2.75Å; W410-I414 HydrophobicContact CE3-CG1 4.21Å; W410-I414 VanDerWaalsContact O-CB 3.25Å; W410-I414 WeakPolarHBondContact O-CB 3.22Å; W410-I414 WeakPolarHBondContact O-CG1 3.2Å; W410-I414 PolarHBondContact O-N 2.97Å; W410-L464 HydrophobicContact CH2-CD1 4.27Å; W410-L464 HydrophobicContact CZ2-CD1 3.95Å |
| 411 | Q | 88 | Confident | 90.8 | Very high | 41 Ų | 41 | 18.4 Ų | 18.4 | 19% | 0.192 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -62.6 | -43.6 | 179.6 | -74.7 | -73.7 | 37.9 | 0 | 0 | 112.5 | I313 D407 N415 Y433 E437 | I313-Q411 HydrophobicContact CG2-CG 4.42Å; D407-Q411 VanDerWaalsContact O-CB 3.29Å; D407-Q411 WeakPolarHBondContact O-CB 3.43Å; D407-Q411 WeakPolarHBondContact O-CG 3.25Å; D407-Q411 PolarHBondContact O-N 3.09Å; D407-Q411 WeakPolarHBondContact OD1-CG 3.13Å; Q411-N415 WeakPolarHBondContact O-CB 3.19Å; Q411-Y433 PolarHBondContact OE1-OH 2.94Å; Q411-E437 PolarHBondContact NE2-OE1 3.18Å; Q411-E437 PolarHBondContact OE1-OE1 3.39Å |
| 412 | T | 86.3 | Confident | 90.2 | Very high | 33 Ų | 33 | 18.7 Ų | 18.7 | 20% | 0.202 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -76.6 | -41.9 | -178.9 | 60.1 | 0 | 0 | 0 | 0 | 112.6 | A408 V409 W410 G416 | A408-T412 WeakPolarHBondContact O-CB 3.35Å; A408-T412 VanDerWaalsContact O-CG2 3.26Å; A408-T412 WeakPolarHBondContact O-CG2 3.48Å; A408-T412 PolarHBondContact O-N 3.16Å; A408-T412 VanDerWaalsContact O-N 3.09Å; A408-T412 PolarHBondContact O-OG1 3.2Å; V409-T412 PolarHBondContact O-N 3.05Å; V409-T412 PolarHBondContact O-OG1 3.09Å; W410-T412 PolarHBondContact O-N 2.75Å; T412-G416 PolarHBondContact O-N 3.26Å |
| 413 | Q | 89.4 | Confident | 89.1 | Confident | 0 Ų | 0 | 22.5 Ų | 22.5 | 0% | 0 | 12% | 0.12 | C | C | . | . | H | α-helix | trans | -84.8 | -42.5 | -169.5 | -56.2 | -54.8 | -57.5 | 0 | 0 | 112.8 | M360 R365 I368 I369 V409 L417 | M360-Q413 VanDerWaalsContact CE-OE1 3.22Å; R365-Q413 HydrophobicContact CG-CB 4.22Å; I368-Q413 HydrophobicContact CB-CG 4.3Å; I368-Q413 HydrophobicContact CG2-CG 3.75Å; I369-Q413 HydrophobicContact CD1-CB 3.87Å; I369-Q413 HydrophobicContact CG1-CB 3.72Å; I369-Q413 HydrophobicContact CG1-CG 4.08Å; V409-Q413 HydrophobicContact CG1-CG 4.22Å; V409-Q413 WeakPolarHBondContact O-CB 3.37Å; V409-Q413 WeakPolarHBondContact O-CG 3.47Å; V409-Q413 PolarHBondContact O-N 3.01Å; Q413-L417 WeakPolarHBondContact O-CB 3.44Å; Q413-L417 PolarHBondContact O-N 3.29Å |
| 414 | I | 91.5 | Very high | 87.9 | Confident | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 15% | 0.152 | C | C | . | . | H | α-helix | trans | -74.2 | -43.9 | -179 | -55.8 | -58.6 | 0 | 0 | 0 | 110.2 | I309 I313 I369 W410 G416 L417 Y418 Y433 Y471 | I309-I414 HydrophobicContact CG1-CD1 4.38Å; I309-I414 HydrophobicContact CG1-CG1 4.4Å; I309-I414 HydrophobicContact CG2-CD1 4.45Å; I309-I414 HydrophobicContact CG2-CG2 4.27Å; I313-I414 HydrophobicContact CD1-CB 4.04Å; I313-I414 HydrophobicContact CD1-CG1 4.18Å; I313-I414 HydrophobicContact CD1-CG2 4.23Å; I369-I414 HydrophobicContact CD1-CD1 3.89Å; W410-I414 HydrophobicContact CE3-CG1 4.21Å; W410-I414 VanDerWaalsContact O-CB 3.25Å; W410-I414 WeakPolarHBondContact O-CB 3.22Å; W410-I414 WeakPolarHBondContact O-CG1 3.2Å; W410-I414 PolarHBondContact O-N 2.97Å; I414-G416 VanDerWaalsContact C-N 3.3Å; I414-G416 PolarHBondContact O-N 3.24Å; I414-L417 WeakPolarHBondContact O-CA 3.41Å; I414-L417 WeakPolarHBondContact O-CB 3.48Å; I414-L417 PolarHBondContact O-N 3Å; I414-Y418 HydrophobicContact CG2-CD2 4.16Å; I414-Y418 HydrophobicContact CG2-CE2 4Å; I414-Y418 WeakPolarHBondContact O-CD2 3.36Å; I414-Y418 PolarHBondContact O-N 2.88Å; I414-Y433 HydrophobicContact CB-CE2 4.38Å; I414-Y433 HydrophobicContact CG2-CE2 3.99Å; I414-Y471 HydrophobicContact CD1-CD2 4.16Å |
| 415 | N | 86.4 | Confident | 86.8 | Confident | 54 Ų | 54 | 34.6 Ų | 34.6 | 29% | 0.289 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -57.9 | -44.3 | 173.2 | -164.8 | -35 | 0 | 0 | 0 | 111.1 | Q411 L417 Y418 G419 F430 Y433 | Q411-N415 WeakPolarHBondContact O-CB 3.19Å; N415-L417 VanDerWaalsContact C-N 3.35Å; N415-L417 PolarHBondContact O-N 3.3Å; N415-Y418 WeakPolarHBondContact O-CB 3.32Å; N415-Y418 PolarHBondContact O-N 3.32Å; N415-G419 PolarHBondContact O-N 3.36Å; N415-F430 WeakPolarHBondContact OD1-CD1 3.26Å; N415-F430 WeakPolarHBondContact OD1-CE1 3.27Å; N415-Y433 HydrophobicContact CB-CE1 4.36Å; N415-Y433 HydrophobicContact CB-CE2 4.17Å |
| 416 | G | 83.4 | Confident | 85.5 | Confident | 37 Ų | 37 | 38.1 Ų | 38.1 | 38% | 0.381 | 18% | 0.184 | S | C | . | . | H | α-helix | trans | -60.5 | -38.7 | 172.6 | 0 | 0 | 0 | 0 | 0 | 113.8 | T412 I414 G419 L420 | T412-G416 PolarHBondContact O-N 3.26Å; I414-G416 VanDerWaalsContact C-N 3.3Å; I414-G416 PolarHBondContact O-N 3.24Å; G416-G419 PolarHBondContact O-N 3.31Å; G416-L420 PolarHBondContact O-N 3.09Å |
| 417 | L | 88.2 | Confident | 84.3 | Confident | 0 Ų | 0 | 42.5 Ų | 42.5 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -62.7 | -40.5 | 175.8 | 172.7 | 65.5 | 0 | 0 | 0 | 112.1 | L306 R365 Q413 I414 N415 G419 L420 L421 Y471 | L306-L417 HydrophobicContact CD1-CD2 3.79Å; L306-L417 HydrophobicContact CD1-CG 4.15Å; L306-L417 HydrophobicContact CD2-CD2 3.69Å; L306-L417 HydrophobicContact CG-CD2 4.41Å; R365-L417 VanDerWaalsContact CZ-CD1 3.41Å; Q413-L417 WeakPolarHBondContact O-CB 3.44Å; Q413-L417 PolarHBondContact O-N 3.29Å; I414-L417 WeakPolarHBondContact O-CA 3.41Å; I414-L417 WeakPolarHBondContact O-CB 3.48Å; I414-L417 PolarHBondContact O-N 3Å; N415-L417 VanDerWaalsContact C-N 3.35Å; N415-L417 PolarHBondContact O-N 3.3Å; L417-G419 VanDerWaalsContact C-N 3.34Å; L417-G419 PolarHBondContact O-N 2.85Å; L417-L420 HydrophobicContact CD1-CD2 4.43Å; L417-L420 PolarHBondContact O-N 3.35Å; L417-L420 VanDerWaalsContact O-N 3.16Å; L417-L421 HydrophobicContact CD1-CD1 3.65Å; L417-L421 HydrophobicContact CD1-CD2 4.24Å; L417-L421 HydrophobicContact CD1-CG 3.62Å; L417-L421 HydrophobicContact CD2-CD1 4.42Å; L417-L421 HydrophobicContact CG-CD1 3.82Å; L417-L421 HydrophobicContact CG-CG 4.19Å; L417-L421 WeakPolarHBondContact O-CG 3.24Å; L417-L421 PolarHBondContact O-N 3.18Å; L417-Y471 HydrophobicContact CD2-CD2 3.88Å; L417-Y471 HydrophobicContact CD2-CE2 3.86Å |
| 418 | Y | 88.7 | Confident | 83.3 | Confident | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -58.5 | -46.3 | 174.4 | -90.7 | -113.8 | 0 | 0 | 0 | 111.5 | L303 L306 T310 I414 N415 L420 F422 A429 N432 Y433 | L303-Y418 HydrophobicContact CD1-CD1 4.26Å; L303-Y418 HydrophobicContact CD1-CE1 3.29Å; L303-Y418 VanDerWaalsContact CD1-OH 3.29Å; L303-Y418 WeakPolarHBondContact CD1-OH 3.33Å; L306-Y418 HydrophobicContact CB-CE2 3.94Å; L306-Y418 HydrophobicContact CD1-CD2 4.17Å; L306-Y418 HydrophobicContact CD1-CE2 3.84Å; L306-Y418 HydrophobicContact CG-CE2 4.5Å; T310-Y418 PolarHBondContact OG1-OH 3.25Å; I414-Y418 HydrophobicContact CG2-CD2 4.16Å; I414-Y418 HydrophobicContact CG2-CE2 4Å; I414-Y418 WeakPolarHBondContact O-CD2 3.36Å; I414-Y418 PolarHBondContact O-N 2.88Å; N415-Y418 WeakPolarHBondContact O-CB 3.32Å; N415-Y418 PolarHBondContact O-N 3.32Å; Y418-L420 VanDerWaalsContact C-N 3.26Å; Y418-L420 PolarHBondContact O-N 2.86Å; Y418-F422 HydrophobicContact CD1-CD2 4.47Å; Y418-F422 WeakPolarHBondContact O-CB 3.43Å; Y418-F422 PolarHBondContact O-N 3.45Å; Y418-F422 VanDerWaalsContact O-N 3.11Å; Y418-A429 HydrophobicContact CD1-CB 4.31Å; Y418-A429 VanDerWaalsContact CD1-O 3.25Å; Y418-A429 WeakPolarHBondContact CD1-O 3.46Å; Y418-N432 HydrophobicContact CE1-CB 4.34Å; Y418-Y433 AromaticContact CD2-CD2 3.92Å; Y418-Y433 HydrophobicContact CD2-CD2 3.92Å; Y418-Y433 HydrophobicContact CE1-CD2 4.47Å; Y418-Y433 AromaticContact CE2-CD2 3.9Å; Y418-Y433 HydrophobicContact CE2-CD2 3.9Å; Y418-Y433 HydrophobicContact CG-CD2 4.24Å |
| 419 | G | 80.5 | Confident | 82.9 | Confident | 12 Ų | 12 | 42.3 Ų | 42.3 | 12% | 0.124 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -62.1 | -32.4 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | N415 G416 L417 R423 | N415-G419 PolarHBondContact O-N 3.36Å; G416-G419 PolarHBondContact O-N 3.31Å; L417-G419 VanDerWaalsContact C-N 3.34Å; L417-G419 PolarHBondContact O-N 2.85Å; G419-R423 WeakPolarHBondContact O-CG 3.22Å |
| 420 | L | 84.1 | Confident | 82.3 | Confident | 64 Ų | 64 | 46.1 Ų | 46.1 | 34% | 0.335 | 22% | 0.221 | S | C | . | . | H | α-helix | trans | -79.8 | -43.8 | 179.6 | -178.1 | 125.3 | 0 | 0 | 0 | 113.2 | G416 L417 Y418 F422 Y478 | G416-L420 PolarHBondContact O-N 3.09Å; L417-L420 HydrophobicContact CD1-CD2 4.43Å; L417-L420 PolarHBondContact O-N 3.35Å; L417-L420 VanDerWaalsContact O-N 3.16Å; Y418-L420 VanDerWaalsContact C-N 3.26Å; Y418-L420 PolarHBondContact O-N 2.86Å; L420-F422 VanDerWaalsContact C-N 3.33Å; L420-Y478 HydrophobicContact CD2-CD2 4.5Å; L420-Y478 HydrophobicContact CD2-CE1 4.13Å; L420-Y478 HydrophobicContact CD2-CE2 3.78Å |
| 421 | L | 85.3 | Confident | 81.6 | Confident | 32 Ų | 32 | 48.2 Ų | 48.2 | 17% | 0.168 | 24% | 0.236 | C | C | . | . | H | α-helix | trans | -70 | -31.5 | 179.5 | -72.7 | 176.1 | 0 | 0 | 0 | 112.6 | N302 L306 L417 V474 Y478 | N302-L421 HydrophobicContact CB-CD1 4.43Å; L306-L421 HydrophobicContact CD1-CD1 3.65Å; L417-L421 HydrophobicContact CD1-CD1 3.65Å; L417-L421 HydrophobicContact CD1-CD2 4.24Å; L417-L421 HydrophobicContact CD1-CG 3.62Å; L417-L421 HydrophobicContact CD2-CD1 4.42Å; L417-L421 HydrophobicContact CG-CD1 3.82Å; L417-L421 HydrophobicContact CG-CG 4.19Å; L417-L421 WeakPolarHBondContact O-CG 3.24Å; L417-L421 PolarHBondContact O-N 3.18Å; L421-V474 HydrophobicContact CD1-CG1 3.79Å; L421-Y478 HydrophobicContact CD2-CD2 3.73Å; L421-Y478 HydrophobicContact CD2-CE2 4.32Å; L421-Y478 HydrophobicContact CD2-CG 4.44Å |
| 422 | F | 84.4 | Confident | 81.5 | Confident | 12 Ų | 12 | 46.3 Ų | 46.3 | 5% | 0.053 | 23% | 0.227 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -122.4 | 41.4 | -169.1 | -55.2 | -57.1 | 0 | 0 | 0 | 113.2 | K300 N302 L303 Y418 L420 R424 N425 K426 A429 | K300-F422 HydrophobicContact CB-CE1 4.41Å; K300-F422 HydrophobicContact CD-CD1 4.18Å; K300-F422 HydrophobicContact CD-CE1 3.7Å; N302-F422 HydrophobicContact CB-CZ 4.3Å; L303-F422 HydrophobicContact CB-CE2 4.2Å; L303-F422 HydrophobicContact CB-CZ 3.79Å; L303-F422 HydrophobicContact CD1-CE2 4.16Å; Y418-F422 HydrophobicContact CD1-CD2 4.47Å; Y418-F422 WeakPolarHBondContact O-CB 3.43Å; Y418-F422 PolarHBondContact O-N 3.45Å; Y418-F422 VanDerWaalsContact O-N 3.11Å; L420-F422 VanDerWaalsContact C-N 3.33Å; F422-R424 PolarHBondContact O-N 3.38Å; F422-R424 VanDerWaalsContact O-N 3.08Å; F422-N425 CarbonylContact O-C 3.57Å; F422-N425 VanDerWaalsContact O-C 3.26Å; F422-N425 PolarHBondContact O-N 3.48Å; F422-K426 PolarHBondContact O-N 2.81Å; F422-A429 HydrophobicContact CB-CB 3.55Å; F422-A429 HydrophobicContact CD2-CB 3.8Å; F422-A429 HydrophobicContact CG-CB 4.05Å |
| 423 | R | 74.3 | Confident | 81.6 | Confident | 158 Ų | 158 | 45 Ų | 45 | 60% | 0.596 | 22% | 0.219 | S | C | * | . | G | 310 helix | trans | -53.3 | -31.3 | -177.2 | -71.4 | 179.7 | 75.2 | 152.1 | 3.8 | 115.7 | G419 K426 | G419-R423 WeakPolarHBondContact O-CG 3.22Å; R423-K426 WeakPolarHBondContact O-CG 3.3Å |
| 424 | R | 71.9 | Confident | 81.3 | Confident | 177 Ų | 177 | 48.7 Ų | 48.7 | 67% | 0.668 | 23% | 0.233 | S | C | * | . | G | 310 helix | trans | -73.9 | -32.7 | 178.1 | -86.7 | -178.2 | 163.9 | 159 | -2.6 | 113 | D12 F422 | D12-R424 IonicContact OD2-CZ 3.79Å; D12-R424 IonicContact OD2-NH1 3.55Å; D12-R424 PolarHBondContact OD2-NH1 3.05Å; F422-R424 PolarHBondContact O-N 3.38Å; F422-R424 VanDerWaalsContact O-N 3.08Å |
| 425 | N | 73.1 | Confident | 81.1 | Confident | 76 Ų | 76 | 50.6 Ų | 50.6 | 41% | 0.406 | 24% | 0.242 | S | C | . | . | G | 310 helix | trans | -127.4 | 55.9 | -175.6 | -62.8 | -10.6 | 0 | 0 | 0 | 109.8 | F422 E427 A428 A429 | F422-N425 CarbonylContact O-C 3.57Å; F422-N425 VanDerWaalsContact O-C 3.26Å; F422-N425 PolarHBondContact O-N 3.48Å; N425-E427 VanDerWaalsContact C-N 3.32Å; N425-E427 PolarHBondContact O-N 3.27Å; N425-A428 HydrophobicContact CB-CB 4.44Å; N425-A428 PolarHBondContact O-N 3.3Å; N425-A429 WeakPolarHBondContact O-CB 3.31Å; N425-A429 PolarHBondContact O-N 3Å; N425-A429 VanDerWaalsContact O-N 3.08Å |
| 426 | K | 69.7 | Low | 81.4 | Confident | 96 Ų | 96 | 51.2 Ų | 51.2 | 42% | 0.417 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -59.8 | -41.9 | -174.5 | -69.5 | -180 | -175.8 | 175.7 | 0 | 112.3 | F422 R423 A429 F430 | F422-K426 PolarHBondContact O-N 2.81Å; R423-K426 WeakPolarHBondContact O-CG 3.3Å; K426-A429 WeakPolarHBondContact O-CB 3.36Å; K426-A429 PolarHBondContact O-N 3.5Å; K426-F430 HydrophobicContact CB-CD2 4.24Å; K426-F430 HydrophobicContact CB-CE2 4.03Å; K426-F430 WeakPolarHBondContact O-CD2 3.38Å; K426-F430 PolarHBondContact O-N 3.08Å |
| 427 | E | 70.8 | Confident | 81.8 | Confident | 92 Ų | 92 | 49.5 Ų | 49.5 | 43% | 0.43 | 22% | 0.223 | S | C | . | . | H | α-helix | trans | -58.2 | -54.8 | 179.7 | -66.2 | 177.5 | -175.4 | 0 | 0 | 111.2 | L290 N425 A429 F430 S431 | L290-E427 HydrophobicContact CD1-CB 4.33Å; N425-E427 VanDerWaalsContact C-N 3.32Å; N425-E427 PolarHBondContact O-N 3.27Å; E427-A429 PolarHBondContact O-N 3.05Å; E427-F430 PolarHBondContact O-N 3.09Å; E427-S431 WeakPolarHBondContact O-CB 3.48Å; E427-S431 PolarHBondContact O-N 3.23Å; E427-S431 PolarHBondContact O-OG 3.13Å |
| 428 | A | 74.1 | Confident | 82 | Confident | 4 Ų | 4 | 49.7 Ų | 49.7 | 3% | 0.033 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -61.8 | -29.8 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.1 | L290 A293 N425 N432 | L290-A428 HydrophobicContact CD1-CB 4.44Å; A293-A428 HydrophobicContact CB-CB 4.2Å; N425-A428 HydrophobicContact CB-CB 4.44Å; N425-A428 PolarHBondContact O-N 3.3Å; A428-N432 WeakPolarHBondContact O-CB 3.47Å; A428-N432 PolarHBondContact O-N 3.15Å; A428-N432 VanDerWaalsContact O-N 3.08Å; A428-N432 PolarHBondContact O-ND2 2.73Å |
| 429 | A | 82.3 | Confident | 82.1 | Confident | 0 Ų | 0 | 50.9 Ų | 50.9 | 0% | 0 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -70.2 | -49.9 | 175.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y418 F422 N425 K426 E427 S431 N432 Y433 | Y418-A429 HydrophobicContact CD1-CB 4.31Å; Y418-A429 VanDerWaalsContact CD1-O 3.25Å; Y418-A429 WeakPolarHBondContact CD1-O 3.46Å; F422-A429 HydrophobicContact CB-CB 3.55Å; F422-A429 HydrophobicContact CD2-CB 3.8Å; F422-A429 HydrophobicContact CG-CB 4.05Å; N425-A429 WeakPolarHBondContact O-CB 3.31Å; N425-A429 PolarHBondContact O-N 3Å; N425-A429 VanDerWaalsContact O-N 3.08Å; K426-A429 WeakPolarHBondContact O-CB 3.36Å; K426-A429 PolarHBondContact O-N 3.5Å; E427-A429 PolarHBondContact O-N 3.05Å; A429-S431 VanDerWaalsContact C-N 3.31Å; A429-S431 PolarHBondContact O-N 2.93Å; A429-N432 WeakPolarHBondContact O-CB 3.25Å; A429-N432 PolarHBondContact O-N 2.78Å; A429-N432 VanDerWaalsContact O-N 3.15Å; A429-Y433 PolarHBondContact O-N 2.87Å |
| 430 | F | 81.3 | Confident | 82.8 | Confident | 80 Ų | 80 | 50.3 Ų | 50.3 | 35% | 0.351 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -66.5 | -32.8 | 177 | -67.5 | -55.8 | 0 | 0 | 0 | 112.3 | N415 K426 E427 Y433 R434 | N415-F430 WeakPolarHBondContact OD1-CD1 3.26Å; N415-F430 WeakPolarHBondContact OD1-CE1 3.27Å; K426-F430 HydrophobicContact CB-CD2 4.24Å; K426-F430 HydrophobicContact CB-CE2 4.03Å; K426-F430 WeakPolarHBondContact O-CD2 3.38Å; K426-F430 PolarHBondContact O-N 3.08Å; E427-F430 PolarHBondContact O-N 3.09Å; F430-Y433 WeakPolarHBondContact O-CB 3.2Å; F430-Y433 PolarHBondContact O-N 3.37Å; F430-R434 PolarHBondContact O-N 2.9Å |
| 431 | S | 80.8 | Confident | 83.3 | Confident | 45 Ų | 45 | 47.8 Ų | 47.8 | 32% | 0.315 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -61.2 | -43.9 | 169.6 | -62.2 | 0 | 0 | 0 | 0 | 111.9 | E427 A429 R434 L435 | E427-S431 WeakPolarHBondContact O-CB 3.48Å; E427-S431 PolarHBondContact O-N 3.23Å; E427-S431 PolarHBondContact O-OG 3.13Å; A429-S431 VanDerWaalsContact C-N 3.31Å; A429-S431 PolarHBondContact O-N 2.93Å; S431-R434 PolarHBondContact O-N 2.82Å; S431-L435 VanDerWaalsContact O-CB 3.29Å; S431-L435 WeakPolarHBondContact O-CB 3.46Å; S431-L435 PolarHBondContact O-N 3.18Å |
| 432 | N | 85.6 | Confident | 83.6 | Confident | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -63.4 | -42.2 | 174 | -89.9 | -74.7 | 0 | 0 | 0 | 112.2 | T294 M298 L303 Y418 A428 A429 L435 W436 | T294-N432 VanDerWaalsContact CG2-ND2 3.27Å; T294-N432 WeakPolarHBondContact CG2-ND2 3.31Å; T294-N432 PolarHBondContact O-ND2 3.33Å; M298-N432 WeakPolarHBondContact CG-OD1 3.49Å; L303-N432 HydrophobicContact CD1-CB 4.33Å; L303-N432 HydrophobicContact CD2-CB 4.01Å; Y418-N432 HydrophobicContact CE1-CB 4.34Å; A428-N432 WeakPolarHBondContact O-CB 3.47Å; A428-N432 PolarHBondContact O-N 3.15Å; A428-N432 VanDerWaalsContact O-N 3.08Å; A428-N432 PolarHBondContact O-ND2 2.73Å; A429-N432 WeakPolarHBondContact O-CB 3.25Å; A429-N432 PolarHBondContact O-N 2.78Å; A429-N432 VanDerWaalsContact O-N 3.15Å; N432-L435 PolarHBondContact O-N 3.41Å; N432-W436 PolarHBondContact O-N 2.87Å |
| 433 | Y | 87.4 | Confident | 84.1 | Confident | 6 Ų | 6 | 51 Ų | 51 | 2% | 0.024 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -54.9 | -54.7 | 175.8 | 179.5 | -92.2 | 0 | 0 | 0 | 110.7 | T310 I313 Q411 I414 N415 Y418 A429 F430 L435 W436 E437 | T310-Y433 HydrophobicContact CG2-CD2 3.79Å; T310-Y433 HydrophobicContact CG2-CE2 4.02Å; T310-Y433 HydrophobicContact CG2-CG 4.3Å; T310-Y433 VanDerWaalsContact CG2-O 3.29Å; T310-Y433 WeakPolarHBondContact CG2-O 3.47Å; I313-Y433 HydrophobicContact CD1-CE2 4.18Å; Q411-Y433 PolarHBondContact OE1-OH 2.94Å; I414-Y433 HydrophobicContact CB-CE2 4.38Å; I414-Y433 HydrophobicContact CG2-CE2 3.99Å; N415-Y433 HydrophobicContact CB-CE1 4.36Å; N415-Y433 HydrophobicContact CB-CE2 4.17Å; Y418-Y433 AromaticContact CD2-CD2 3.92Å; Y418-Y433 HydrophobicContact CD2-CD2 3.92Å; Y418-Y433 HydrophobicContact CE1-CD2 4.47Å; Y418-Y433 AromaticContact CE2-CD2 3.9Å; Y418-Y433 HydrophobicContact CE2-CD2 3.9Å; Y418-Y433 HydrophobicContact CG-CD2 4.24Å; A429-Y433 PolarHBondContact O-N 2.87Å; F430-Y433 WeakPolarHBondContact O-CB 3.2Å; F430-Y433 PolarHBondContact O-N 3.37Å; Y433-L435 VanDerWaalsContact C-N 3.3Å; Y433-L435 PolarHBondContact O-N 3.48Å; Y433-W436 PolarHBondContact O-N 3.4Å; Y433-E437 VanDerWaalsContact O-CB 3.32Å; Y433-E437 WeakPolarHBondContact O-CB 3.19Å; Y433-E437 PolarHBondContact O-N 3.29Å |
| 434 | R | 83.8 | Confident | 85.1 | Confident | 78 Ų | 78 | 43.5 Ų | 43.5 | 29% | 0.294 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -63.8 | -35.4 | -178.6 | -166.7 | 56.7 | 153.9 | -171.9 | -2 | 112.8 | F430 S431 E437 S438 | F430-R434 PolarHBondContact O-N 2.9Å; S431-R434 PolarHBondContact O-N 2.82Å; R434-E437 WeakPolarHBondContact CD-OE2 3.39Å; R434-E437 IonicContact CZ-OE2 2.74Å; R434-E437 IonicContact NE-OE2 3.71Å; R434-E437 IonicContact NH1-OE1 3.16Å; R434-E437 IonicContact NH1-OE2 3.78Å; R434-E437 PolarHBondContact NH1-OE2 2.98Å; R434-S438 VanDerWaalsContact O-CB 3.28Å; R434-S438 WeakPolarHBondContact O-CB 3.46Å; R434-S438 PolarHBondContact O-N 3.03Å; R434-S438 PolarHBondContact O-OG 3.35Å |
| 435 | L | 87.4 | Confident | 86 | Confident | 39 Ų | 39 | 35.6 Ų | 35.6 | 20% | 0.204 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -60.5 | -52.6 | 175.8 | 176.7 | 68.1 | 0 | 0 | 0 | 111.4 | V89 S431 N432 Y433 S438 A439 | V89-L435 HydrophobicContact CB-CD1 4.48Å; V89-L435 HydrophobicContact CG1-CD1 3.59Å; V89-L435 HydrophobicContact CG2-CD1 4.4Å; S431-L435 VanDerWaalsContact O-CB 3.29Å; S431-L435 WeakPolarHBondContact O-CB 3.46Å; S431-L435 PolarHBondContact O-N 3.18Å; N432-L435 PolarHBondContact O-N 3.41Å; Y433-L435 VanDerWaalsContact C-N 3.3Å; Y433-L435 PolarHBondContact O-N 3.48Å; L435-S438 PolarHBondContact O-N 3.17Å; L435-A439 WeakPolarHBondContact O-CB 3.46Å; L435-A439 PolarHBondContact O-N 2.8Å |
| 436 | W | 91.6 | Very high | 86.7 | Confident | 68 Ų | 68 | 35 Ų | 35 | 26% | 0.258 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -73.5 | -33.1 | -176.9 | -70.8 | 111.8 | 0 | 0 | 0 | 112.7 | M298 I307 T310 V311 N432 Y433 A439 G440 | M298-W436 HydrophobicContact SD-CZ2 3.77Å; I307-W436 HydrophobicContact CB-CD2 4.41Å; I307-W436 HydrophobicContact CD1-CD2 4.39Å; I307-W436 HydrophobicContact CD1-CH2 4.3Å; I307-W436 HydrophobicContact CD1-CZ2 3.62Å; I307-W436 HydrophobicContact CG1-CD2 4.09Å; I307-W436 HydrophobicContact CG1-CG 4.23Å; I307-W436 HydrophobicContact CG1-CZ2 4.24Å; I307-W436 HydrophobicContact CG2-CD2 3.58Å; I307-W436 HydrophobicContact CG2-CE3 3.52Å; I307-W436 HydrophobicContact CG2-CG 4.12Å; I307-W436 HydrophobicContact CG2-CH2 4.18Å; I307-W436 HydrophobicContact CG2-CZ2 4.26Å; I307-W436 HydrophobicContact CG2-CZ3 3.83Å; T310-W436 HydrophobicContact CG2-CB 3.75Å; V311-W436 HydrophobicContact CG2-CB 4.29Å; V311-W436 HydrophobicContact CG2-CE3 3.83Å; N432-W436 PolarHBondContact O-N 2.87Å; Y433-W436 PolarHBondContact O-N 3.4Å; W436-A439 HydrophobicContact CE3-CB 4.3Å; W436-A439 PolarHBondContact O-N 2.99Å; W436-G440 PolarHBondContact O-N 3.29Å |
| 437 | E | 93.2 | Very high | 87.6 | Confident | 1 Ų | 1 | 32 Ų | 32 | 1% | 0.005 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -59.8 | -49.6 | 169.5 | -178.8 | -172.7 | -141.8 | 0 | 0 | 110 | T310 I313 G314 Q411 Y433 R434 A439 G440 F441 | T310-E437 HydrophobicContact CG2-CB 4.3Å; T310-E437 WeakPolarHBondContact O-CA 3.28Å; I313-E437 HydrophobicContact CG2-CG 4.27Å; G314-E437 VanDerWaalsContact CA-O 3.25Å; G314-E437 WeakPolarHBondContact CA-O 3.5Å; Q411-E437 PolarHBondContact NE2-OE1 3.18Å; Q411-E437 PolarHBondContact OE1-OE1 3.39Å; Y433-E437 VanDerWaalsContact O-CB 3.32Å; Y433-E437 WeakPolarHBondContact O-CB 3.19Å; Y433-E437 PolarHBondContact O-N 3.29Å; R434-E437 WeakPolarHBondContact CD-OE2 3.39Å; R434-E437 IonicContact CZ-OE2 2.74Å; R434-E437 IonicContact NE-OE2 3.71Å; R434-E437 IonicContact NH1-OE1 3.16Å; R434-E437 IonicContact NH1-OE2 3.78Å; R434-E437 PolarHBondContact NH1-OE2 2.98Å; E437-A439 VanDerWaalsContact C-N 3.31Å; E437-A439 PolarHBondContact O-N 3.26Å; E437-G440 WeakPolarHBondContact O-CA 3.35Å; E437-G440 PolarHBondContact O-N 3.38Å; E437-F441 HydrophobicContact CG-CE2 4.31Å; E437-F441 WeakPolarHBondContact O-CD2 3.47Å; E437-F441 PolarHBondContact O-N 2.96Å |
| 438 | S | 90.5 | Very high | 88.4 | Confident | 3 Ų | 3 | 27.6 Ų | 27.6 | 2% | 0.021 | 15% | 0.147 | C | C | . | . | H | α-helix | trans | -65.8 | -33.5 | 178.4 | -53.6 | 0 | 0 | 0 | 0 | 112.6 | L88 V89 R434 L435 G440 F441 V442 | L88-S438 VanDerWaalsContact CD2-OG 3.3Å; L88-S438 WeakPolarHBondContact CD2-OG 3.45Å; V89-S438 VanDerWaalsContact CG2-CB 3.43Å; R434-S438 VanDerWaalsContact O-CB 3.28Å; R434-S438 WeakPolarHBondContact O-CB 3.46Å; R434-S438 PolarHBondContact O-N 3.03Å; R434-S438 PolarHBondContact O-OG 3.35Å; L435-S438 PolarHBondContact O-N 3.17Å; S438-G440 VanDerWaalsContact C-N 3.3Å; S438-G440 PolarHBondContact O-N 3.31Å; S438-F441 WeakPolarHBondContact O-CB 3.28Å; S438-F441 PolarHBondContact O-N 3.39Å; S438-V442 WeakPolarHBondContact O-CG2 3.27Å; S438-V442 PolarHBondContact O-N 2.92Å; S438-V442 VanDerWaalsContact O-N 3.09Å |
| 439 | A | 92.3 | Very high | 88.8 | Confident | 25 Ų | 25 | 28.7 Ų | 28.7 | 21% | 0.207 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -62.8 | -37.6 | 172.2 | 0 | 0 | 0 | 0 | 0 | 111.7 | L435 W436 E437 V442 I443 | L435-A439 WeakPolarHBondContact O-CB 3.46Å; L435-A439 PolarHBondContact O-N 2.8Å; W436-A439 HydrophobicContact CE3-CB 4.3Å; W436-A439 PolarHBondContact O-N 2.99Å; E437-A439 VanDerWaalsContact C-N 3.31Å; E437-A439 PolarHBondContact O-N 3.26Å; A439-V442 PolarHBondContact O-N 2.89Å; A439-I443 WeakPolarHBondContact O-CB 3.49Å; A439-I443 WeakPolarHBondContact O-CD1 3.12Å; A439-I443 VanDerWaalsContact O-CG1 3.24Å; A439-I443 WeakPolarHBondContact O-CG1 3.37Å; A439-I443 PolarHBondContact O-N 2.84Å |
| 440 | G | 95.6 | Very high | 89 | Confident | 0 Ų | 0 | 33.6 Ų | 33.6 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -58.4 | -46.4 | 172.6 | 0 | 0 | 0 | 0 | 0 | 113 | V311 M315 W436 E437 S438 V442 I443 A444 | V311-G440 WeakPolarHBondContact O-CA 3.47Å; M315-G440 VanDerWaalsContact CG-O 3.3Å; M315-G440 WeakPolarHBondContact CG-O 3.45Å; W436-G440 PolarHBondContact O-N 3.29Å; E437-G440 WeakPolarHBondContact O-CA 3.35Å; E437-G440 PolarHBondContact O-N 3.38Å; S438-G440 VanDerWaalsContact C-N 3.3Å; S438-G440 PolarHBondContact O-N 3.31Å; G440-V442 PolarHBondContact O-N 3.44Å; G440-I443 PolarHBondContact O-N 2.89Å; G440-A444 WeakPolarHBondContact O-CB 3.02Å; G440-A444 PolarHBondContact O-N 3.02Å |
| 441 | F | 93.4 | Very high | 89.5 | Confident | 11 Ų | 11 | 32.4 Ų | 32.4 | 5% | 0.048 | 18% | 0.18 | C | C | . | . | H | α-helix | trans | -57.1 | -48.5 | 173.1 | -81.3 | -81.1 | 0 | 0 | 0 | 112.4 | Y85 Q317 A318 E437 S438 I443 A444 Y445 | Y85-F441 HydrophobicContact CD1-CB 3.84Å; Y85-F441 HydrophobicContact CD1-CD1 4.27Å; Y85-F441 AromaticContact CD1-CD2 3.83Å; Y85-F441 HydrophobicContact CD1-CD2 3.83Å; Y85-F441 HydrophobicContact CD1-CE2 4.4Å; Y85-F441 AromaticContact CD1-CG 3.73Å; Y85-F441 HydrophobicContact CD1-CG 3.73Å; Y85-F441 HydrophobicContact CD2-CB 3.91Å; Y85-F441 HydrophobicContact CD2-CD1 4.09Å; Y85-F441 HydrophobicContact CD2-CG 4.11Å; Y85-F441 HydrophobicContact CE1-CB 4.32Å; Y85-F441 AromaticContact CE1-CD1 3.9Å; Y85-F441 HydrophobicContact CE1-CD1 3.9Å; Y85-F441 AromaticContact CE1-CD2 3.72Å; Y85-F441 HydrophobicContact CE1-CD2 3.72Å; Y85-F441 HydrophobicContact CE1-CE1 4.03Å; Y85-F441 AromaticContact CE1-CE2 3.85Å; Y85-F441 HydrophobicContact CE1-CE2 3.85Å; Y85-F441 AromaticContact CE1-CG 3.73Å; Y85-F441 HydrophobicContact CE1-CG 3.73Å; Y85-F441 AromaticContact CE1-CZ 3.97Å; Y85-F441 HydrophobicContact CE1-CZ 3.97Å; Y85-F441 HydrophobicContact CE2-CB 4.43Å; Y85-F441 AromaticContact CE2-CD1 3.76Å; Y85-F441 HydrophobicContact CE2-CD1 3.76Å; Y85-F441 HydrophobicContact CE2-CE1 4.16Å; Y85-F441 HydrophobicContact CE2-CG 4.16Å; Y85-F441 HydrophobicContact CG-CB 3.59Å; Y85-F441 HydrophobicContact CG-CD1 4.35Å; Y85-F441 HydrophobicContact CG-CD2 4.45Å; Y85-F441 AromaticContact CG-CG 3.92Å; Y85-F441 HydrophobicContact CG-CG 3.92Å; Y85-F441 AromaticContact CZ-CD1 3.62Å; Y85-F441 AromaticContact CZ-CE1 3.66Å; Y85-F441 AromaticContact CZ-CG 3.95Å; Y85-F441 AromaticContact CZ-CZ 3.99Å; Q317-F441 HydrophobicContact CB-CE1 3.66Å; Q317-F441 HydrophobicContact CB-CE2 4.15Å; Q317-F441 HydrophobicContact CB-CZ 3.33Å; Q317-F441 HydrophobicContact CG-CZ 4.26Å; A318-F441 HydrophobicContact CB-CD1 3.72Å; A318-F441 HydrophobicContact CB-CE1 4.25Å; E437-F441 HydrophobicContact CG-CE2 4.31Å; E437-F441 WeakPolarHBondContact O-CD2 3.47Å; E437-F441 PolarHBondContact O-N 2.96Å; S438-F441 WeakPolarHBondContact O-CB 3.28Å; S438-F441 PolarHBondContact O-N 3.39Å; F441-I443 PolarHBondContact O-N 3.34Å; F441-A444 PolarHBondContact O-N 3.38Å; F441-Y445 HydrophobicContact CB-CD2 4.43Å; F441-Y445 HydrophobicContact CB-CE2 4.26Å; F441-Y445 AromaticContact CD1-CE2 3.74Å; F441-Y445 HydrophobicContact CD1-CE2 3.74Å; F441-Y445 WeakPolarHBondContact O-CD2 2.97Å; F441-Y445 PolarHBondContact O-N 3.09Å |
| 442 | V | 92.9 | Very high | 90 | Very high | 37 Ų | 37 | 32.2 Ų | 32.2 | 22% | 0.224 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -61.6 | -44.5 | -179.7 | 173.9 | 0 | 0 | 0 | 0 | 111.1 | A86 S438 A439 G440 A446 | A86-V442 HydrophobicContact CB-CG2 3.94Å; A86-V442 VanDerWaalsContact N-CG2 3.34Å; S438-V442 WeakPolarHBondContact O-CG2 3.27Å; S438-V442 PolarHBondContact O-N 2.92Å; S438-V442 VanDerWaalsContact O-N 3.09Å; A439-V442 PolarHBondContact O-N 2.89Å; G440-V442 PolarHBondContact O-N 3.44Å; V442-A446 WeakPolarHBondContact O-CB 3.38Å; V442-A446 PolarHBondContact O-N 3.31Å |
| 443 | I | 94.2 | Very high | 90.4 | Very high | 75 Ų | 75 | 32.2 Ų | 32.2 | 39% | 0.385 | 18% | 0.178 | S | C | . | . | H | α-helix | trans | -59.6 | -50.6 | 177.5 | -72.3 | 164.6 | 0 | 0 | 0 | 110.1 | V311 M315 A439 G440 F441 Y445 A446 Y447 | V311-I443 HydrophobicContact CG1-CD1 4.14Å; M315-I443 HydrophobicContact CE-CG2 4.3Å; M315-I443 HydrophobicContact SD-CG2 4.48Å; A439-I443 WeakPolarHBondContact O-CB 3.49Å; A439-I443 WeakPolarHBondContact O-CD1 3.12Å; A439-I443 VanDerWaalsContact O-CG1 3.24Å; A439-I443 WeakPolarHBondContact O-CG1 3.37Å; A439-I443 PolarHBondContact O-N 2.84Å; G440-I443 PolarHBondContact O-N 2.89Å; F441-I443 PolarHBondContact O-N 3.34Å; I443-Y445 PolarHBondContact O-N 2.98Å; I443-A446 PolarHBondContact O-N 3.48Å; I443-Y447 HydrophobicContact CG2-CD1 4.19Å; I443-Y447 HydrophobicContact CG2-CE1 3.63Å; I443-Y447 WeakPolarHBondContact O-CD1 3.36Å; I443-Y447 VanDerWaalsContact O-CE1 3.3Å; I443-Y447 WeakPolarHBondContact O-CE1 3.08Å; I443-Y447 PolarHBondContact O-N 3.06Å |
| 444 | A | 94.3 | Very high | 90.7 | Very high | 1 Ų | 1 | 35 Ų | 35 | 1% | 0.008 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -60.5 | -46.6 | -178.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | M315 A318 G440 F441 Y447 A448 | M315-A444 HydrophobicContact CB-CB 4.29Å; M315-A444 HydrophobicContact CG-CB 4.29Å; A318-A444 HydrophobicContact CB-CB 3.48Å; A318-A444 VanDerWaalsContact CB-CB 3.48Å; G440-A444 WeakPolarHBondContact O-CB 3.02Å; G440-A444 PolarHBondContact O-N 3.02Å; F441-A444 PolarHBondContact O-N 3.38Å; A444-Y447 WeakPolarHBondContact O-CD2 3.3Å; A444-Y447 WeakPolarHBondContact O-CE2 3.39Å; A444-A448 PolarHBondContact O-N 3.23Å |
| 445 | Y | 91.1 | Very high | 91.3 | Very high | 10 Ų | 10 | 36 Ų | 36 | 4% | 0.039 | 20% | 0.201 | C | C | . | . | H | α-helix | trans | -73 | -27.5 | 178.8 | -63.3 | -45.1 | 0 | 0 | 0 | 113.8 | L81 Y85 A318 A322 F441 I443 Y447 A448 | L81-Y445 HydrophobicContact CB-CD2 4.09Å; L81-Y445 HydrophobicContact CB-CE1 4.42Å; L81-Y445 HydrophobicContact CB-CE2 3.82Å; L81-Y445 HydrophobicContact CB-CG 4.49Å; L81-Y445 HydrophobicContact CD1-CE1 4.23Å; Y85-Y445 HydrophobicContact CD2-CD2 4.16Å; Y85-Y445 AromaticContact CD2-CE2 3.66Å; Y85-Y445 HydrophobicContact CD2-CE2 3.66Å; Y85-Y445 AromaticContact CE2-CE2 3.68Å; Y85-Y445 HydrophobicContact CE2-CE2 3.68Å; A318-Y445 HydrophobicContact CB-CD1 4.25Å; A318-Y445 HydrophobicContact CB-CE1 3.75Å; A318-Y445 HydrophobicContact CB-CE2 4.13Å; A322-Y445 HydrophobicContact CB-CD1 4.4Å; A322-Y445 HydrophobicContact CB-CE1 3.64Å; F441-Y445 HydrophobicContact CB-CD2 4.43Å; F441-Y445 HydrophobicContact CB-CE2 4.26Å; F441-Y445 AromaticContact CD1-CE2 3.74Å; F441-Y445 HydrophobicContact CD1-CE2 3.74Å; F441-Y445 WeakPolarHBondContact O-CD2 2.97Å; F441-Y445 PolarHBondContact O-N 3.09Å; I443-Y445 PolarHBondContact O-N 2.98Å; Y445-Y447 VanDerWaalsContact C-N 3.33Å; Y445-Y447 PolarHBondContact O-N 3.11Å; Y445-A448 WeakPolarHBondContact O-CB 3.44Å; Y445-A448 PolarHBondContact O-N 3.24Å |
| 446 | A | 88.6 | Confident | 91.6 | Very high | 64 Ų | 64 | 34.2 Ų | 34.2 | 53% | 0.529 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -64.8 | -36.1 | 179.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | V442 I443 | V442-A446 WeakPolarHBondContact O-CB 3.38Å; V442-A446 PolarHBondContact O-N 3.31Å; I443-A446 PolarHBondContact O-N 3.48Å |
| 447 | Y | 89.1 | Confident | 91.9 | Very high | 32 Ų | 32 | 31 Ų | 31 | 13% | 0.125 | 18% | 0.179 | C | C | . | . | S | Bend | trans | -97.1 | 1.8 | 175.8 | 62.7 | -122.7 | 0 | 0 | 0 | 113.8 | M315 I443 A444 Y445 T449 T450 L451 K456 I459 | M315-Y447 HydrophobicContact CE-CE1 4.36Å; M315-Y447 WeakPolarHBondContact CE-OH 3.45Å; I443-Y447 HydrophobicContact CG2-CD1 4.19Å; I443-Y447 HydrophobicContact CG2-CE1 3.63Å; I443-Y447 WeakPolarHBondContact O-CD1 3.36Å; I443-Y447 VanDerWaalsContact O-CE1 3.3Å; I443-Y447 WeakPolarHBondContact O-CE1 3.08Å; I443-Y447 PolarHBondContact O-N 3.06Å; A444-Y447 WeakPolarHBondContact O-CD2 3.3Å; A444-Y447 WeakPolarHBondContact O-CE2 3.39Å; Y445-Y447 VanDerWaalsContact C-N 3.33Å; Y445-Y447 PolarHBondContact O-N 3.11Å; Y447-T449 PolarHBondContact O-N 3.13Å; Y447-T449 VanDerWaalsContact O-N 3.16Å; Y447-T450 WeakPolarHBondContact CA-OG1 3.27Å; Y447-T450 PolarHBondContact O-N 3.45Å; Y447-T450 PolarHBondContact O-OG1 3.29Å; Y447-L451 HydrophobicContact CD1-CD1 4.45Å; Y447-L451 HydrophobicContact CD2-CD1 3.96Å; Y447-L451 HydrophobicContact CG-CD1 3.84Å; Y447-L451 PolarHBondContact O-N 3.41Å; Y447-K456 HydrophobicContact CD2-CD 4.42Å; Y447-K456 HydrophobicContact CD2-CG 4.02Å; Y447-K456 HydrophobicContact CE2-CB 4.19Å; Y447-K456 HydrophobicContact CE2-CD 4.23Å; Y447-K456 HydrophobicContact CE2-CG 3.76Å; Y447-I459 HydrophobicContact CE1-CD1 4.38Å; Y447-I459 HydrophobicContact CE1-CG2 4.36Å |
| 448 | A | 86.7 | Confident | 92.1 | Very high | 1 Ų | 1 | 36.4 Ų | 36.4 | 1% | 0.008 | 20% | 0.2 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -60.2 | -29.2 | -173.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | T78 T227 A444 Y445 K456 | T78-A448 HydrophobicContact CG2-CB 4.28Å; T227-A448 PolarHBondContact OG1-O 2.95Å; T227-A448 VanDerWaalsContact OG1-O 3.09Å; A444-A448 PolarHBondContact O-N 3.23Å; Y445-A448 WeakPolarHBondContact O-CB 3.44Å; Y445-A448 PolarHBondContact O-N 3.24Å; A448-K456 WeakPolarHBondContact O-CE 3.29Å; A448-K456 PolarHBondContact O-NZ 3.27Å |
| 449 | T | 83.1 | Confident | 92.5 | Very high | 27 Ų | 27 | 38.8 Ų | 38.8 | 17% | 0.166 | 21% | 0.212 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -94.3 | -21.3 | -179.1 | 56.5 | 0 | 0 | 0 | 0 | 113.5 | T227 T228 Y447 | T227-T449 HydrophobicContact CG2-CG2 4.35Å; T228-T449 PolarHBondContact OG1-O 2.84Å; Y447-T449 PolarHBondContact O-N 3.13Å; Y447-T449 VanDerWaalsContact O-N 3.16Å |
| 450 | T | 86.6 | Confident | 92.7 | Very high | 102 Ų | 102 | 37.7 Ų | 37.7 | 63% | 0.626 | 20% | 0.203 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -97.3 | -28 | -173.1 | 55.9 | 0 | 0 | 0 | 0 | 113.2 | Y447 | Y447-T450 WeakPolarHBondContact CA-OG1 3.27Å; Y447-T450 PolarHBondContact O-N 3.45Å; Y447-T450 PolarHBondContact O-OG1 3.29Å |
| 451 | L | 90.9 | Very high | 92.8 | Very high | 55 Ų | 55 | 39.1 Ų | 39.1 | 29% | 0.288 | 21% | 0.21 | S | C | . | . | S | Bend | trans | -104.6 | 146.7 | 179.2 | -61.3 | -177.6 | 0 | 0 | 0 | 111.3 | Y447 M455 K456 I459 | Y447-L451 HydrophobicContact CD1-CD1 4.45Å; Y447-L451 HydrophobicContact CD2-CD1 3.96Å; Y447-L451 HydrophobicContact CG-CD1 3.84Å; Y447-L451 PolarHBondContact O-N 3.41Å; L451-M455 HydrophobicContact CB-CB 4.32Å; L451-K456 HydrophobicContact CB-CG 4.18Å; L451-K456 WeakPolarHBondContact O-CE 3.35Å; L451-K456 PolarHBondContact O-NZ 3.47Å; L451-I459 HydrophobicContact CD1-CD1 3.53Å |
| 452 | C | 91.6 | Very high | 93 | Very high | 41 Ų | 41 | 41.5 Ų | 41.5 | 28% | 0.277 | 23% | 0.232 | S | C | . | . | trans | -75.1 | 155.1 | 167.7 | -57.9 | 0 | 0 | 0 | 0 | 111 | F225 C226 Q454 M455 K456 | F225-C452 CarbonylContact O-C 3.59Å; F225-C452 WeakPolarHBondContact O-CA 3.37Å; F225-C452 WeakPolarHBondContact O-CB 3.3Å; C226-C452 HydrophobicContact CB-CB 4.06Å; C226-C452 WeakPolarHBondContact CB-SG 3.45Å; C226-C452 WeakPolarHBondContact SG-CB 3.36Å; C226-C452 CovalentContact SG-SG 2.03Å; C226-C452 PolarHBondContact SG-SG 3.2Å; C452-Q454 VanDerWaalsContact C-N 3.28Å; C452-Q454 PolarHBondContact O-N 3.09Å; C452-M455 WeakPolarHBondContact O-CB 3.41Å; C452-M455 PolarHBondContact O-N 2.93Å; C452-K456 PolarHBondContact O-N 3.28Å | ||
| 453 | T | 93.6 | Very high | 93.3 | Very high | 0 Ų | 0 | 41.1 Ų | 41.1 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -54.4 | -40.8 | -176.3 | -60.7 | 0 | 0 | 0 | 0 | 112.8 | G222 F225 F319 A327 Y328 M455 K456 L457 | G222-T453 WeakPolarHBondContact O-CB 3.5Å; G222-T453 WeakPolarHBondContact O-CG2 3.27Å; F225-T453 PolarHBondContact O-N 3.49Å; F225-T453 PolarHBondContact O-OG1 2.82Å; F319-T453 HydrophobicContact CE2-CG2 4.25Å; A327-T453 HydrophobicContact CB-CG2 4.16Å; A327-T453 WeakPolarHBondContact CB-OG1 3.29Å; Y328-T453 HydrophobicContact CE2-CG2 3.72Å; T453-M455 VanDerWaalsContact C-N 3.3Å; T453-M455 PolarHBondContact O-N 2.77Å; T453-K456 WeakPolarHBondContact O-CB 3.42Å; T453-K456 PolarHBondContact O-N 3.45Å; T453-K456 VanDerWaalsContact O-N 3.08Å; T453-L457 WeakPolarHBondContact O-CG 3.39Å; T453-L457 PolarHBondContact O-N 2.63Å |
| 454 | Q | 94.9 | Very high | 93.5 | Very high | 65 Ų | 65 | 37.6 Ų | 37.6 | 30% | 0.304 | 21% | 0.211 | S | C | . | . | H | α-helix | trans | -55 | -44.7 | 175.4 | -177.1 | -177.8 | 31.1 | 0 | 0 | 112.2 | A223 L384 C452 K456 L457 Y458 | A223-Q454 HydrophobicContact CB-CB 4.17Å; A223-Q454 WeakPolarHBondContact O-CA 3.4Å; A223-Q454 WeakPolarHBondContact O-CB 3.14Å; A223-Q454 PolarHBondContact O-N 3.35Å; L384-Q454 HydrophobicContact CD2-CG 3.89Å; C452-Q454 VanDerWaalsContact C-N 3.28Å; C452-Q454 PolarHBondContact O-N 3.09Å; Q454-K456 VanDerWaalsContact C-N 3.33Å; Q454-K456 PolarHBondContact O-N 3Å; Q454-L457 PolarHBondContact O-N 3.02Å; Q454-Y458 HydrophobicContact CG-CD2 4.11Å; Q454-Y458 HydrophobicContact CG-CE2 3.68Å; Q454-Y458 VanDerWaalsContact O-CD2 3.22Å; Q454-Y458 WeakPolarHBondContact O-CD2 3.49Å; Q454-Y458 PolarHBondContact O-N 2.97Å; Q454-Y458 VanDerWaalsContact O-N 3.13Å |
| 455 | M | 95.1 | Very high | 93.7 | Very high | 100 Ų | 100 | 40.4 Ų | 40.4 | 49% | 0.493 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -67.2 | -37.6 | 178.9 | -61.7 | -62.1 | 179 | 0 | 0 | 111.2 | L451 C452 T453 L457 Y458 I459 | L451-M455 HydrophobicContact CB-CB 4.32Å; C452-M455 WeakPolarHBondContact O-CB 3.41Å; C452-M455 PolarHBondContact O-N 2.93Å; T453-M455 VanDerWaalsContact C-N 3.3Å; T453-M455 PolarHBondContact O-N 2.77Å; M455-L457 VanDerWaalsContact C-N 3.34Å; M455-L457 PolarHBondContact O-N 3.09Å; M455-Y458 PolarHBondContact O-N 3.46Å; M455-I459 WeakPolarHBondContact O-CG1 3.35Å; M455-I459 PolarHBondContact O-N 3.45Å |
| 456 | K | 95.5 | Very high | 94 | Very high | 1 Ų | 1 | 44.7 Ų | 44.7 | 0% | 0.004 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -62.6 | -41.3 | 175.5 | -56 | 176.3 | -167.3 | 166.7 | 0 | 111.4 | D323 Y447 A448 L451 C452 T453 Q454 I459 L460 | D323-K456 WeakPolarHBondContact OD1-CD 3.42Å; D323-K456 IonicContact OD1-NZ 3.99Å; D323-K456 PolarHBondContact OD1-NZ 3.21Å; Y447-K456 HydrophobicContact CD2-CD 4.42Å; Y447-K456 HydrophobicContact CD2-CG 4.02Å; Y447-K456 HydrophobicContact CE2-CB 4.19Å; Y447-K456 HydrophobicContact CE2-CD 4.23Å; Y447-K456 HydrophobicContact CE2-CG 3.76Å; A448-K456 WeakPolarHBondContact O-CE 3.29Å; A448-K456 PolarHBondContact O-NZ 3.27Å; L451-K456 HydrophobicContact CB-CG 4.18Å; L451-K456 WeakPolarHBondContact O-CE 3.35Å; L451-K456 PolarHBondContact O-NZ 3.47Å; C452-K456 PolarHBondContact O-N 3.28Å; T453-K456 WeakPolarHBondContact O-CB 3.42Å; T453-K456 PolarHBondContact O-N 3.45Å; T453-K456 VanDerWaalsContact O-N 3.08Å; Q454-K456 VanDerWaalsContact C-N 3.33Å; Q454-K456 PolarHBondContact O-N 3Å; K456-I459 PolarHBondContact O-N 3.29Å; K456-L460 WeakPolarHBondContact O-CG 3.48Å; K456-L460 PolarHBondContact O-N 2.89Å |
| 457 | L | 97.3 | Very high | 94.4 | Very high | 0 Ų | 0 | 41.6 Ų | 41.6 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -63.3 | -41.5 | 176 | -69.7 | -179.7 | 0 | 0 | 0 | 112.4 | F319 Y328 I380 E383 L384 T453 Q454 M455 I459 L460 L461 | F319-L457 HydrophobicContact CD2-CD2 4.36Å; F319-L457 HydrophobicContact CE1-CD2 4.02Å; F319-L457 HydrophobicContact CE2-CD2 3.49Å; F319-L457 VanDerWaalsContact CE2-CD2 3.49Å; F319-L457 HydrophobicContact CE2-CG 4.25Å; F319-L457 HydrophobicContact CZ-CD2 3.3Å; F319-L457 HydrophobicContact CZ-CG 4.3Å; Y328-L457 WeakPolarHBondContact OH-CD1 3.38Å; I380-L457 HydrophobicContact CG2-CB 4.03Å; I380-L457 HydrophobicContact CG2-CD2 3.99Å; E383-L457 HydrophobicContact CB-CD1 3.9Å; E383-L457 HydrophobicContact CB-CD2 4.49Å; L384-L457 HydrophobicContact CB-CD1 4.47Å; L384-L457 HydrophobicContact CD2-CB 3.66Å; L384-L457 HydrophobicContact CD2-CD1 3.81Å; L384-L457 HydrophobicContact CD2-CG 4.4Å; L384-L457 HydrophobicContact CG-CB 3.9Å; L384-L457 HydrophobicContact CG-CD1 3.79Å; T453-L457 WeakPolarHBondContact O-CG 3.39Å; T453-L457 PolarHBondContact O-N 2.63Å; Q454-L457 PolarHBondContact O-N 3.02Å; M455-L457 VanDerWaalsContact C-N 3.34Å; M455-L457 PolarHBondContact O-N 3.09Å; L457-I459 VanDerWaalsContact C-N 3.35Å; L457-I459 PolarHBondContact O-N 3.21Å; L457-L460 HydrophobicContact CD2-CD1 4.29Å; L457-L460 PolarHBondContact O-N 3.16Å; L457-L461 PolarHBondContact O-N 3.48Å |
| 458 | Y | 97.9 | Very high | 94.8 | Very high | 114 Ų | 114 | 41.2 Ų | 41.2 | 45% | 0.447 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -62.8 | -40.8 | 173.6 | -76 | -57.4 | 0 | 0 | 0 | 112.6 | L384 Q454 M455 L461 A462 | L384-Y458 HydrophobicContact CD1-CD1 4.33Å; L384-Y458 HydrophobicContact CD1-CE1 4.04Å; L384-Y458 HydrophobicContact CD2-CD2 4.45Å; L384-Y458 HydrophobicContact CD2-CE1 4.41Å; L384-Y458 HydrophobicContact CD2-CE2 4.19Å; Q454-Y458 HydrophobicContact CG-CD2 4.11Å; Q454-Y458 HydrophobicContact CG-CE2 3.68Å; Q454-Y458 VanDerWaalsContact O-CD2 3.22Å; Q454-Y458 WeakPolarHBondContact O-CD2 3.49Å; Q454-Y458 PolarHBondContact O-N 2.97Å; Q454-Y458 VanDerWaalsContact O-N 3.13Å; M455-Y458 PolarHBondContact O-N 3.46Å; Y458-L461 PolarHBondContact O-N 2.96Å; Y458-A462 WeakPolarHBondContact O-CB 3.43Å; Y458-A462 PolarHBondContact O-N 3.38Å |
| 459 | I | 97.7 | Very high | 95.3 | Very high | 54 Ų | 54 | 45.5 Ų | 45.5 | 28% | 0.277 | 25% | 0.25 | S | C | . | . | H | α-helix | trans | -61.4 | -46.4 | 174.2 | -67.7 | 167.9 | 0 | 0 | 0 | 110 | M315 Y447 L451 M455 K456 L457 L461 A462 V463 | M315-I459 HydrophobicContact CE-CG2 3.59Å; Y447-I459 HydrophobicContact CE1-CD1 4.38Å; Y447-I459 HydrophobicContact CE1-CG2 4.36Å; L451-I459 HydrophobicContact CD1-CD1 3.53Å; M455-I459 WeakPolarHBondContact O-CG1 3.35Å; M455-I459 PolarHBondContact O-N 3.45Å; K456-I459 PolarHBondContact O-N 3.29Å; L457-I459 VanDerWaalsContact C-N 3.35Å; L457-I459 PolarHBondContact O-N 3.21Å; I459-L461 PolarHBondContact O-N 3.22Å; I459-A462 PolarHBondContact O-N 3.23Å; I459-V463 HydrophobicContact CG2-CG2 4.33Å; I459-V463 WeakPolarHBondContact O-CG2 3.23Å; I459-V463 PolarHBondContact O-N 3.48Å |
| 460 | L | 97.4 | Very high | 95.9 | Very high | 2 Ų | 2 | 44.5 Ų | 44.5 | 1% | 0.01 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -58.4 | -44.9 | 176.8 | -76.6 | 169.1 | 0 | 0 | 0 | 112.1 | F312 M315 F319 I380 K456 L457 A462 V463 L464 | F312-L460 HydrophobicContact CD2-CD2 4.28Å; F312-L460 HydrophobicContact CE2-CB 4.49Å; F312-L460 HydrophobicContact CE2-CD2 4.12Å; M315-L460 HydrophobicContact CB-CD2 3.63Å; M315-L460 HydrophobicContact CE-CD2 4.35Å; F319-L460 HydrophobicContact CB-CD1 3.81Å; F319-L460 HydrophobicContact CD1-CD1 4.19Å; F319-L460 HydrophobicContact CD2-CD1 3.62Å; F319-L460 HydrophobicContact CE2-CD1 4.27Å; F319-L460 HydrophobicContact CG-CD1 3.58Å; I380-L460 HydrophobicContact CD1-CB 4.13Å; K456-L460 WeakPolarHBondContact O-CG 3.48Å; K456-L460 PolarHBondContact O-N 2.89Å; L457-L460 HydrophobicContact CD2-CD1 4.29Å; L457-L460 PolarHBondContact O-N 3.16Å; L460-A462 PolarHBondContact O-N 3.43Å; L460-V463 PolarHBondContact O-N 3.25Å; L460-L464 VanDerWaalsContact O-CB 3.26Å; L460-L464 WeakPolarHBondContact O-CB 3.33Å; L460-L464 PolarHBondContact O-N 2.96Å |
| 461 | L | 97.8 | Very high | 96.3 | Very high | 29 Ų | 29 | 40.1 Ų | 40.1 | 15% | 0.152 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -60.3 | -44.3 | 175.2 | -77.8 | 171.9 | 0 | 0 | 0 | 112.3 | F377 I380 L384 L457 Y458 I459 L464 T465 | F377-L461 HydrophobicContact CD1-CD2 3.63Å; F377-L461 HydrophobicContact CE1-CD2 4.01Å; I380-L461 HydrophobicContact CB-CD2 3.93Å; I380-L461 HydrophobicContact CB-CG 4.2Å; I380-L461 HydrophobicContact CD1-CD2 4.25Å; I380-L461 HydrophobicContact CG2-CD1 3.86Å; I380-L461 HydrophobicContact CG2-CD2 3.74Å; I380-L461 HydrophobicContact CG2-CG 3.43Å; I380-L461 VanDerWaalsContact CG2-CG 3.43Å; L384-L461 HydrophobicContact CD1-CD1 3.64Å; L457-L461 PolarHBondContact O-N 3.48Å; Y458-L461 PolarHBondContact O-N 2.96Å; I459-L461 PolarHBondContact O-N 3.22Å; L461-L464 PolarHBondContact O-N 2.88Å; L461-T465 WeakPolarHBondContact O-CB 2.96Å; L461-T465 PolarHBondContact O-N 3.33Å; L461-T465 PolarHBondContact O-OG1 3.01Å |
| 462 | A | 98.1 | Very high | 96.5 | Very high | 61 Ų | 61 | 41 Ų | 41 | 50% | 0.504 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -63.4 | -45.9 | -179.8 | 0 | 0 | 0 | 0 | 0 | 111.4 | Y458 I459 L460 T465 L466 | Y458-A462 WeakPolarHBondContact O-CB 3.43Å; Y458-A462 PolarHBondContact O-N 3.38Å; I459-A462 PolarHBondContact O-N 3.23Å; L460-A462 PolarHBondContact O-N 3.43Å; A462-T465 PolarHBondContact O-N 3.46Å; A462-L466 WeakPolarHBondContact O-CB 3.21Å; A462-L466 PolarHBondContact O-N 3.32Å |
| 463 | V | 98 | Very high | 96.6 | Very high | 30 Ų | 30 | 42.3 Ų | 42.3 | 18% | 0.182 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -69.5 | -39.6 | 179.6 | -176.1 | 0 | 0 | 0 | 0 | 111.1 | P308 V311 F312 M315 I459 L460 T465 L466 G467 | P308-V463 WeakPolarHBondContact O-CG1 3.39Å; V311-V463 HydrophobicContact CG1-CG1 4.44Å; F312-V463 HydrophobicContact CB-CG1 3.97Å; M315-V463 HydrophobicContact CE-CG2 4.1Å; M315-V463 HydrophobicContact SD-CB 4.33Å; M315-V463 HydrophobicContact SD-CG1 4.06Å; M315-V463 HydrophobicContact SD-CG2 4.09Å; I459-V463 HydrophobicContact CG2-CG2 4.33Å; I459-V463 WeakPolarHBondContact O-CG2 3.23Å; I459-V463 PolarHBondContact O-N 3.48Å; L460-V463 PolarHBondContact O-N 3.25Å; V463-T465 PolarHBondContact O-N 3.11Å; V463-L466 PolarHBondContact O-N 2.75Å; V463-G467 PolarHBondContact O-N 3.27Å |
| 464 | L | 98.1 | Very high | 96.6 | Very high | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -58.6 | -47.7 | 172.9 | 178 | 54.8 | 0 | 0 | 0 | 111.1 | I309 F312 H376 F377 I380 W410 L460 L461 L466 G467 C468 | I309-L464 HydrophobicContact CD1-CD1 4.14Å; F312-L464 HydrophobicContact CD1-CD1 3.93Å; F312-L464 HydrophobicContact CD2-CB 3.75Å; F312-L464 HydrophobicContact CD2-CD1 4.46Å; F312-L464 HydrophobicContact CE1-CD1 3.69Å; F312-L464 HydrophobicContact CE2-CB 3.62Å; F312-L464 HydrophobicContact CE2-CD1 4.24Å; F312-L464 HydrophobicContact CE2-CD2 4.28Å; F312-L464 HydrophobicContact CE2-CG 4.24Å; F312-L464 HydrophobicContact CG-CB 4.31Å; F312-L464 HydrophobicContact CG-CD1 4.32Å; F312-L464 HydrophobicContact CZ-CB 4.07Å; F312-L464 HydrophobicContact CZ-CD1 3.85Å; F312-L464 HydrophobicContact CZ-CD2 4Å; F312-L464 HydrophobicContact CZ-CG 4.18Å; H376-L464 HydrophobicContact CB-CD2 3.89Å; F377-L464 HydrophobicContact CD1-CD2 4.03Å; F377-L464 HydrophobicContact CD2-CD2 3.94Å; F377-L464 HydrophobicContact CD2-CG 4.42Å; F377-L464 HydrophobicContact CE1-CD2 4Å; F377-L464 HydrophobicContact CE1-CG 4.18Å; F377-L464 HydrophobicContact CE2-CD2 3.9Å; F377-L464 HydrophobicContact CE2-CG 3.87Å; F377-L464 HydrophobicContact CG-CD2 3.98Å; F377-L464 HydrophobicContact CZ-CB 4.42Å; F377-L464 HydrophobicContact CZ-CD2 3.93Å; F377-L464 HydrophobicContact CZ-CG 3.74Å; I380-L464 HydrophobicContact CD1-CD2 4.29Å; W410-L464 HydrophobicContact CH2-CD1 4.27Å; W410-L464 HydrophobicContact CZ2-CD1 3.95Å; L460-L464 VanDerWaalsContact O-CB 3.26Å; L460-L464 WeakPolarHBondContact O-CB 3.33Å; L460-L464 PolarHBondContact O-N 2.96Å; L461-L464 PolarHBondContact O-N 2.88Å; L464-L466 PolarHBondContact O-N 3.04Å; L464-G467 PolarHBondContact O-N 3.32Å; L464-C468 WeakPolarHBondContact O-CB 3.37Å; L464-C468 PolarHBondContact O-N 3.49Å; L464-C468 PolarHBondContact O-SG 3.32Å; L464-C468 VanDerWaalsContact O-SG 3.38Å |
| 465 | T | 98.1 | Very high | 96.4 | Very high | 60 Ų | 60 | 40 Ų | 40 | 37% | 0.368 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -59.6 | -49.1 | 178.9 | -56.3 | 0 | 0 | 0 | 0 | 111.2 | F377 L461 A462 V463 G467 C468 I469 | F377-T465 WeakPolarHBondContact CE1-OG1 3.35Å; F377-T465 WeakPolarHBondContact CZ-OG1 3.45Å; L461-T465 WeakPolarHBondContact O-CB 2.96Å; L461-T465 PolarHBondContact O-N 3.33Å; L461-T465 PolarHBondContact O-OG1 3.01Å; A462-T465 PolarHBondContact O-N 3.46Å; V463-T465 PolarHBondContact O-N 3.11Å; T465-G467 VanDerWaalsContact C-N 3.31Å; T465-G467 PolarHBondContact O-N 3.22Å; T465-C468 PolarHBondContact O-N 3.48Å; T465-I469 HydrophobicContact CG2-CD1 4.1Å; T465-I469 VanDerWaalsContact O-CG1 3.3Å; T465-I469 WeakPolarHBondContact O-CG1 3.31Å; T465-I469 PolarHBondContact O-N 3.03Å |
| 466 | L | 97.8 | Very high | 96.1 | Very high | 100 Ų | 100 | 40.1 Ų | 40.1 | 52% | 0.524 | 22% | 0.218 | S | C | . | . | H | α-helix | trans | -61.2 | -41 | 176.6 | -177.3 | 62.5 | 0 | 0 | 0 | 111.8 | P308 A462 V463 L464 I469 G470 | P308-L466 HydrophobicContact CB-CB 4.35Å; P308-L466 HydrophobicContact CB-CD2 3.97Å; P308-L466 HydrophobicContact CB-CG 3.86Å; P308-L466 HydrophobicContact CG-CD2 4.01Å; P308-L466 HydrophobicContact CG-CG 3.98Å; A462-L466 WeakPolarHBondContact O-CB 3.21Å; A462-L466 PolarHBondContact O-N 3.32Å; V463-L466 PolarHBondContact O-N 2.75Å; L464-L466 PolarHBondContact O-N 3.04Å; L466-I469 PolarHBondContact O-N 3.32Å; L466-G470 PolarHBondContact O-N 2.9Å |
| 467 | G | 97.2 | Very high | 95.8 | Very high | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -62.4 | -45.7 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | V463 L464 T465 G470 Y471 | V463-G467 PolarHBondContact O-N 3.27Å; L464-G467 PolarHBondContact O-N 3.32Å; T465-G467 VanDerWaalsContact C-N 3.31Å; T465-G467 PolarHBondContact O-N 3.22Å; G467-G470 PolarHBondContact O-N 3.35Å; G467-Y471 WeakPolarHBondContact O-CB 3.24Å; G467-Y471 PolarHBondContact O-N 2.97Å |
| 468 | C | 97.1 | Very high | 95.3 | Very high | 24 Ų | 24 | 46.5 Ų | 46.5 | 16% | 0.162 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -63.1 | -42.9 | 176.1 | -72.3 | 0 | 0 | 0 | 0 | 111.6 | L464 T465 Y471 V472 | L464-C468 WeakPolarHBondContact O-CB 3.37Å; L464-C468 PolarHBondContact O-N 3.49Å; L464-C468 PolarHBondContact O-SG 3.32Å; L464-C468 VanDerWaalsContact O-SG 3.38Å; T465-C468 PolarHBondContact O-N 3.48Å; C468-Y471 PolarHBondContact O-N 3.24Å; C468-V472 VanDerWaalsContact O-CG2 3.28Å; C468-V472 WeakPolarHBondContact O-CG2 3.31Å; C468-V472 PolarHBondContact O-N 2.92Å |
| 469 | I | 97.1 | Very high | 94.7 | Very high | 91 Ų | 91 | 47.4 Ų | 47.4 | 47% | 0.467 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -59 | -49.8 | 175 | -68 | 164.8 | 0 | 0 | 0 | 110.2 | T465 L466 Y471 V472 I473 | T465-I469 HydrophobicContact CG2-CD1 4.1Å; T465-I469 VanDerWaalsContact O-CG1 3.3Å; T465-I469 WeakPolarHBondContact O-CG1 3.31Å; T465-I469 PolarHBondContact O-N 3.03Å; L466-I469 PolarHBondContact O-N 3.32Å; I469-Y471 PolarHBondContact O-N 3.23Å; I469-V472 PolarHBondContact O-N 2.94Å; I469-I473 HydrophobicContact CG2-CD1 3.87Å; I469-I473 VanDerWaalsContact O-CG1 3.31Å; I469-I473 WeakPolarHBondContact O-CG1 3.36Å; I469-I473 PolarHBondContact O-N 2.97Å |
| 470 | G | 96 | Very high | 94.1 | Very high | 5 Ų | 5 | 51.2 Ų | 51.2 | 5% | 0.052 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -58.5 | -45 | 177.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | L305 L466 G467 I473 V474 | L305-G470 CarbonylContact O-C 3.59Å; L305-G470 WeakPolarHBondContact O-CA 3.46Å; L466-G470 PolarHBondContact O-N 2.9Å; G467-G470 PolarHBondContact O-N 3.35Å; G470-I473 PolarHBondContact O-N 2.91Å; G470-V474 WeakPolarHBondContact O-CG2 3.38Å; G470-V474 PolarHBondContact O-N 3.45Å |
| 471 | Y | 94.9 | Very high | 93.4 | Very high | 10 Ų | 10 | 57.1 Ų | 57.1 | 4% | 0.039 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -59.6 | -47.9 | 175.1 | 168.4 | -101.4 | 0 | 0 | 0 | 112.3 | L306 I369 I414 L417 G467 C468 I469 I473 V474 E475 | L306-Y471 HydrophobicContact CD2-CD2 4.4Å; I369-Y471 HydrophobicContact CB-CE1 4.18Å; I369-Y471 HydrophobicContact CD1-CD1 4.49Å; I369-Y471 HydrophobicContact CD1-CD2 4.08Å; I369-Y471 HydrophobicContact CD1-CE1 3.88Å; I369-Y471 HydrophobicContact CD1-CE2 3.42Å; I369-Y471 VanDerWaalsContact CD1-CE2 3.42Å; I369-Y471 HydrophobicContact CG2-CD1 3.79Å; I369-Y471 HydrophobicContact CG2-CE1 3.55Å; I414-Y471 HydrophobicContact CD1-CD2 4.16Å; L417-Y471 HydrophobicContact CD2-CD2 3.88Å; L417-Y471 HydrophobicContact CD2-CE2 3.86Å; G467-Y471 WeakPolarHBondContact O-CB 3.24Å; G467-Y471 PolarHBondContact O-N 2.97Å; C468-Y471 PolarHBondContact O-N 3.24Å; I469-Y471 PolarHBondContact O-N 3.23Å; Y471-I473 VanDerWaalsContact C-N 3.32Å; Y471-I473 PolarHBondContact O-N 2.8Å; Y471-V474 PolarHBondContact O-N 3.36Å; Y471-V474 VanDerWaalsContact O-N 3.17Å; Y471-E475 HydrophobicContact CE1-CB 4.5Å; Y471-E475 HydrophobicContact CE2-CB 4.5Å; Y471-E475 WeakPolarHBondContact O-CB 3.41Å; Y471-E475 PolarHBondContact O-N 3Å; Y471-E475 PolarHBondContact OH-OE2 2.84Å |
| 472 | V | 94.9 | Very high | 92.5 | Very high | 74 Ų | 74 | 60.6 Ų | 60.6 | 45% | 0.448 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -60.4 | -43.6 | -179.9 | 168.5 | 0 | 0 | 0 | 0 | 110.8 | C468 I469 V474 E475 I476 | C468-V472 VanDerWaalsContact O-CG2 3.28Å; C468-V472 WeakPolarHBondContact O-CG2 3.31Å; C468-V472 PolarHBondContact O-N 2.92Å; I469-V472 PolarHBondContact O-N 2.94Å; V472-V474 VanDerWaalsContact C-N 3.35Å; V472-V474 PolarHBondContact O-N 2.87Å; V472-E475 PolarHBondContact O-N 2.99Å; V472-I476 HydrophobicContact CG1-CD1 3.79Å; V472-I476 HydrophobicContact CG1-CG1 4.44Å; V472-I476 VanDerWaalsContact O-CG1 3.29Å; V472-I476 WeakPolarHBondContact O-CG1 3.19Å; V472-I476 PolarHBondContact O-N 3.2Å |
| 473 | I | 94.4 | Very high | 91.5 | Very high | 68 Ų | 68 | 62.8 Ų | 62.8 | 35% | 0.349 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -59.3 | -47.3 | 175.8 | -65.6 | 164.7 | 0 | 0 | 0 | 110.3 | L305 I469 G470 Y471 E475 I476 L477 | L305-I473 HydrophobicContact CD1-CB 4.34Å; L305-I473 HydrophobicContact CD1-CG2 3.69Å; L305-I473 HydrophobicContact CD2-CD1 4.41Å; I469-I473 HydrophobicContact CG2-CD1 3.87Å; I469-I473 VanDerWaalsContact O-CG1 3.31Å; I469-I473 WeakPolarHBondContact O-CG1 3.36Å; I469-I473 PolarHBondContact O-N 2.97Å; G470-I473 PolarHBondContact O-N 2.91Å; Y471-I473 VanDerWaalsContact C-N 3.32Å; Y471-I473 PolarHBondContact O-N 2.8Å; I473-E475 VanDerWaalsContact C-N 3.33Å; I473-E475 PolarHBondContact O-N 3.17Å; I473-I476 PolarHBondContact O-N 3.23Å; I473-L477 HydrophobicContact CG2-CD1 3.9Å; I473-L477 HydrophobicContact CG2-CG 4.29Å; I473-L477 WeakPolarHBondContact O-CB 3.45Å; I473-L477 VanDerWaalsContact O-CG 3.27Å; I473-L477 WeakPolarHBondContact O-CG 3.36Å; I473-L477 PolarHBondContact O-N 2.68Å |
| 474 | V | 93.2 | Very high | 90.4 | Very high | 1 Ų | 1 | 65.3 Ų | 65.3 | 1% | 0.006 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -61.2 | -41.8 | 178.5 | 170.3 | 0 | 0 | 0 | 0 | 111.8 | L305 L306 L421 G470 Y471 V472 L477 Y478 | L305-V474 HydrophobicContact CB-CG2 3.46Å; L305-V474 VanDerWaalsContact CB-CG2 3.46Å; L305-V474 HydrophobicContact CD1-CG2 3.76Å; L305-V474 HydrophobicContact CG-CG2 4.27Å; L306-V474 HydrophobicContact CD1-CG1 4.5Å; L306-V474 HydrophobicContact CD2-CB 4.48Å; L306-V474 HydrophobicContact CD2-CG1 4.49Å; L306-V474 HydrophobicContact CD2-CG2 4.37Å; L306-V474 HydrophobicContact CG-CG2 4.25Å; L421-V474 HydrophobicContact CD1-CG1 3.79Å; G470-V474 WeakPolarHBondContact O-CG2 3.38Å; G470-V474 PolarHBondContact O-N 3.45Å; Y471-V474 PolarHBondContact O-N 3.36Å; Y471-V474 VanDerWaalsContact O-N 3.17Å; V472-V474 VanDerWaalsContact C-N 3.35Å; V472-V474 PolarHBondContact O-N 2.87Å; V474-L477 PolarHBondContact O-N 3.3Å; V474-Y478 VanDerWaalsContact O-CB 3.22Å; V474-Y478 WeakPolarHBondContact O-CB 3.11Å; V474-Y478 PolarHBondContact O-N 3.33Å |
| 475 | E | 90.6 | Very high | 89.3 | Confident | 17 Ų | 17 | 67.4 Ų | 67.4 | 8% | 0.079 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -64 | -42.8 | 177.8 | -175.1 | 68 | -150.3 | 0 | 0 | 111.4 | R365 Y471 V472 I473 Y478 R479 | R365-E475 IonicContact CZ-OE2 3.54Å; R365-E475 IonicContact NE-OE2 2.74Å; R365-E475 PolarHBondContact NE-OE2 2.94Å; R365-E475 IonicContact NH2-OE1 3.49Å; R365-E475 IonicContact NH2-OE2 3.5Å; R365-E475 PolarHBondContact NH2-OE2 3.35Å; Y471-E475 HydrophobicContact CE1-CB 4.5Å; Y471-E475 HydrophobicContact CE2-CB 4.5Å; Y471-E475 WeakPolarHBondContact O-CB 3.41Å; Y471-E475 PolarHBondContact O-N 3Å; Y471-E475 PolarHBondContact OH-OE2 2.84Å; V472-E475 PolarHBondContact O-N 2.99Å; I473-E475 VanDerWaalsContact C-N 3.33Å; I473-E475 PolarHBondContact O-N 3.17Å; E475-Y478 PolarHBondContact O-N 3.24Å; E475-R479 WeakPolarHBondContact O-CB 3.46Å; E475-R479 WeakPolarHBondContact O-CG 3.29Å; E475-R479 PolarHBondContact O-N 3.48Å; E475-R479 IonicContact OE1-CZ 3.61Å; E475-R479 IonicContact OE1-NE 2.92Å; E475-R479 PolarHBondContact OE1-NE 3.41Å; E475-R479 IonicContact OE1-NH2 3.43Å; E475-R479 PolarHBondContact OE1-NH2 3.34Å |
| 476 | I | 90.1 | Very high | 88.1 | Confident | 101 Ų | 101 | 71.6 Ų | 71.6 | 52% | 0.518 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -63 | -48.3 | 175.6 | -68.2 | 166.8 | 0 | 0 | 0 | 110.7 | V472 I473 Y478 R479 K480 | V472-I476 HydrophobicContact CG1-CD1 3.79Å; V472-I476 HydrophobicContact CG1-CG1 4.44Å; V472-I476 VanDerWaalsContact O-CG1 3.29Å; V472-I476 WeakPolarHBondContact O-CG1 3.19Å; V472-I476 PolarHBondContact O-N 3.2Å; I473-I476 PolarHBondContact O-N 3.23Å; I476-Y478 VanDerWaalsContact C-N 3.3Å; I476-Y478 PolarHBondContact O-N 3.29Å; I476-R479 PolarHBondContact O-N 3.15Å; I476-K480 WeakPolarHBondContact O-CB 3.47Å; I476-K480 PolarHBondContact O-N 2.92Å |
| 477 | L | 88.7 | Confident | 86.6 | Confident | 80 Ų | 80 | 74.6 Ų | 74.6 | 42% | 0.419 | 35% | 0.35 | S | S | . | . | H | α-helix | trans | -60.9 | -41.1 | 178.3 | -70.4 | 175.9 | 0 | 0 | 0 | 111.6 | L305 I473 V474 K481 | L305-L477 HydrophobicContact CD1-CD1 4.34Å; I473-L477 HydrophobicContact CG2-CD1 3.9Å; I473-L477 HydrophobicContact CG2-CG 4.29Å; I473-L477 WeakPolarHBondContact O-CB 3.45Å; I473-L477 VanDerWaalsContact O-CG 3.27Å; I473-L477 WeakPolarHBondContact O-CG 3.36Å; I473-L477 PolarHBondContact O-N 2.68Å; V474-L477 PolarHBondContact O-N 3.3Å; L477-K481 PolarHBondContact O-N 3.34Å; L477-K481 VanDerWaalsContact O-N 3.09Å |
| 478 | Y | 86.1 | Confident | 85.2 | Confident | 56 Ų | 56 | 82.3 Ų | 82.3 | 22% | 0.22 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -63.4 | -48.3 | 177 | -179.5 | -101.3 | 0 | 0 | 0 | 111.8 | L420 L421 V474 E475 I476 K480 K481 Y482 | L420-Y478 HydrophobicContact CD2-CD2 4.5Å; L420-Y478 HydrophobicContact CD2-CE1 4.13Å; L420-Y478 HydrophobicContact CD2-CE2 3.78Å; L421-Y478 HydrophobicContact CD2-CD2 3.73Å; L421-Y478 HydrophobicContact CD2-CE2 4.32Å; L421-Y478 HydrophobicContact CD2-CG 4.44Å; V474-Y478 VanDerWaalsContact O-CB 3.22Å; V474-Y478 WeakPolarHBondContact O-CB 3.11Å; V474-Y478 PolarHBondContact O-N 3.33Å; E475-Y478 PolarHBondContact O-N 3.24Å; I476-Y478 VanDerWaalsContact C-N 3.3Å; I476-Y478 PolarHBondContact O-N 3.29Å; Y478-K480 PolarHBondContact O-N 3.4Å; Y478-K481 PolarHBondContact O-N 2.86Å; Y478-Y482 PolarHBondContact O-N 3.48Å |
| 479 | R | 85.1 | Confident | 83.4 | Confident | 133 Ų | 133 | 84.8 Ų | 84.8 | 50% | 0.502 | 39% | 0.388 | S | S | . | . | H | α-helix | trans | -62.3 | -42.5 | 177.8 | -74.8 | 177.6 | -179.4 | -119.9 | 6.4 | 112.1 | T366 E475 I476 K481 Y482 L483 | T366-R479 PolarHBondContact OG1-NH2 3.41Å; T366-R479 VanDerWaalsContact OG1-NH2 3.14Å; E475-R479 WeakPolarHBondContact O-CB 3.46Å; E475-R479 WeakPolarHBondContact O-CG 3.29Å; E475-R479 PolarHBondContact O-N 3.48Å; E475-R479 IonicContact OE1-CZ 3.61Å; E475-R479 IonicContact OE1-NE 2.92Å; E475-R479 PolarHBondContact OE1-NE 3.41Å; E475-R479 IonicContact OE1-NH2 3.43Å; E475-R479 PolarHBondContact OE1-NH2 3.34Å; I476-R479 PolarHBondContact O-N 3.15Å; R479-K481 PolarHBondContact O-N 3.21Å; R479-Y482 PolarHBondContact O-N 3.21Å; R479-L483 WeakPolarHBondContact O-CG 3.41Å; R479-L483 PolarHBondContact O-N 2.03Å |
| 480 | K | 86 | Confident | 81.8 | Confident | 133 Ų | 133 | 84.7 Ų | 84.7 | 58% | 0.578 | 39% | 0.388 | S | S | * | . | H | α-helix | trans | -58.9 | -46.2 | 176.3 | -173.4 | 176.3 | -179.5 | 178.7 | 0 | 111.3 | I476 Y478 Y482 L483 I484 | I476-K480 WeakPolarHBondContact O-CB 3.47Å; I476-K480 PolarHBondContact O-N 2.92Å; Y478-K480 PolarHBondContact O-N 3.4Å; K480-Y482 PolarHBondContact O-N 2.93Å; K480-L483 PolarHBondContact O-N 3.07Å; K480-I484 HydrophobicContact CG-CD1 4Å; K480-I484 VanDerWaalsContact O-CG1 3.27Å; K480-I484 WeakPolarHBondContact O-CG1 3.5Å; K480-I484 PolarHBondContact O-N 3.27Å; K480-I484 VanDerWaalsContact O-N 3.09Å |
| 481 | K | 83.1 | Confident | 79.8 | Confident | 127 Ų | 127 | 88.1 Ų | 88.1 | 55% | 0.552 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -62.1 | -43.4 | 177.5 | -169.6 | 172.6 | -177.9 | 174.1 | 0 | 111.9 | L477 Y478 R479 I484 S485 | L477-K481 PolarHBondContact O-N 3.34Å; L477-K481 VanDerWaalsContact O-N 3.09Å; Y478-K481 PolarHBondContact O-N 2.86Å; R479-K481 PolarHBondContact O-N 3.21Å; K481-I484 PolarHBondContact O-N 3.41Å; K481-S485 PolarHBondContact O-N 3.06Å; K481-S485 PolarHBondContact O-OG 2.9Å |
| 482 | Y | 78.4 | Confident | 78 | Confident | 101 Ų | 101 | 95.4 Ų | 95.4 | 40% | 0.396 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -61.3 | -44.9 | 177.8 | -179.1 | -96.8 | 0 | 0 | 0 | 112.7 | Y478 R479 K480 I484 S485 R486 | Y478-Y482 PolarHBondContact O-N 3.48Å; R479-Y482 PolarHBondContact O-N 3.21Å; K480-Y482 PolarHBondContact O-N 2.93Å; Y482-I484 PolarHBondContact O-N 2.73Å; Y482-S485 PolarHBondContact O-N 3.28Å; Y482-R486 PolarHBondContact O-N 3.32Å |
| 483 | L | 76.4 | Confident | 75.9 | Confident | 108 Ų | 108 | 99.6 Ų | 99.6 | 57% | 0.565 | 46% | 0.456 | S | S | * | . | H | α-helix | trans | -63.5 | -41.3 | 178.1 | -71.1 | 170.9 | 0 | 0 | 0 | 112.2 | R479 K480 R486 K487 | R479-L483 WeakPolarHBondContact O-CG 3.41Å; R479-L483 PolarHBondContact O-N 2.03Å; K480-L483 PolarHBondContact O-N 3.07Å; L483-R486 PolarHBondContact O-N 3.26Å; L483-K487 PolarHBondContact O-N 3.14Å |
| 484 | I | 75.6 | Confident | 73.9 | Confident | 82 Ų | 82 | 103.3 Ų | 103.3 | 42% | 0.421 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -61.9 | -50.1 | 176.6 | -68.5 | 166.8 | 0 | 0 | 0 | 110.3 | K480 K481 Y482 R486 K487 Y488 | K480-I484 HydrophobicContact CG-CD1 4Å; K480-I484 VanDerWaalsContact O-CG1 3.27Å; K480-I484 WeakPolarHBondContact O-CG1 3.5Å; K480-I484 PolarHBondContact O-N 3.27Å; K480-I484 VanDerWaalsContact O-N 3.09Å; K481-I484 PolarHBondContact O-N 3.41Å; Y482-I484 PolarHBondContact O-N 2.73Å; I484-R486 VanDerWaalsContact C-N 3.28Å; I484-R486 PolarHBondContact O-N 2.92Å; I484-K487 PolarHBondContact O-N 2.98Å; I484-K487 VanDerWaalsContact O-N 3.09Å; I484-Y488 HydrophobicContact CG2-CD2 3.75Å; I484-Y488 HydrophobicContact CG2-CE2 3.56Å; I484-Y488 VanDerWaalsContact O-CD2 3.29Å; I484-Y488 WeakPolarHBondContact O-CD2 3.41Å; I484-Y488 PolarHBondContact O-N 3.27Å |
| 485 | S | 73.8 | Confident | 71.9 | Confident | 44 Ų | 44 | 110.4 Ų | 110.4 | 31% | 0.308 | 53% | 0.525 | S | S | . | . | H | α-helix | trans | -59.1 | -38 | 177.7 | -64.5 | 0 | 0 | 0 | 0 | 112.6 | K481 Y482 K489 | K481-S485 PolarHBondContact O-N 3.06Å; K481-S485 PolarHBondContact O-OG 2.9Å; Y482-S485 PolarHBondContact O-N 3.28Å; S485-K489 PolarHBondContact O-N 3.48Å; S485-K489 VanDerWaalsContact O-N 3.09Å |
| 486 | R | 73 | Confident | 71 | Confident | 148 Ų | 148 | 115.1 Ų | 115.1 | 56% | 0.558 | 55% | 0.548 | S | S | * | . | H | α-helix | trans | -66.1 | -39.3 | 175.5 | -171.5 | 176 | 173 | -176.5 | -2.8 | 112.1 | Y482 L483 I484 K489 I490 | Y482-R486 PolarHBondContact O-N 3.32Å; L483-R486 PolarHBondContact O-N 3.26Å; I484-R486 VanDerWaalsContact C-N 3.28Å; I484-R486 PolarHBondContact O-N 2.92Å; R486-K489 PolarHBondContact O-N 3.13Å; R486-I490 HydrophobicContact CG-CD1 4.16Å; R486-I490 WeakPolarHBondContact O-CG1 3.24Å; R486-I490 PolarHBondContact O-N 2.92Å |
| 487 | K | 67.2 | Low | 69.9 | Low | 163 Ų | 163 | 115.8 Ų | 115.8 | 71% | 0.709 | 55% | 0.549 | S | S | * | . | H | α-helix | trans | -65 | -42.7 | 177.8 | -166.3 | 176.3 | -179.4 | -179.2 | 0 | 112 | L483 I484 K489 I490 S491 | L483-K487 PolarHBondContact O-N 3.14Å; I484-K487 PolarHBondContact O-N 2.98Å; I484-K487 VanDerWaalsContact O-N 3.09Å; K487-K489 VanDerWaalsContact C-N 3.33Å; K487-K489 PolarHBondContact O-N 3.45Å; K487-I490 PolarHBondContact O-N 3.25Å; K487-S491 PolarHBondContact O-N 3.01Å |
| 488 | Y | 67.8 | Low | 68.9 | Low | 162 Ų | 162 | 117.8 Ų | 117.8 | 64% | 0.635 | 56% | 0.556 | S | S | * | * | H | α-helix | trans | -62.6 | -39.1 | 173.1 | -81.5 | -76.4 | 0 | 0 | 0 | 112.4 | I484 S491 F492 | I484-Y488 HydrophobicContact CG2-CD2 3.75Å; I484-Y488 HydrophobicContact CG2-CE2 3.56Å; I484-Y488 VanDerWaalsContact O-CD2 3.29Å; I484-Y488 WeakPolarHBondContact O-CD2 3.41Å; I484-Y488 PolarHBondContact O-N 3.27Å; Y488-S491 PolarHBondContact O-N 3.2Å; Y488-F492 WeakPolarHBondContact O-CB 3.4Å; Y488-F492 PolarHBondContact O-N 3.01Å |
| 489 | K | 59 | Low | 67.9 | Low | 76 Ų | 76 | 121.5 Ų | 121.5 | 33% | 0.33 | 58% | 0.576 | S | S | . | * | H | α-helix | trans | -65.7 | -42.9 | 178.5 | -158.1 | 167.5 | -165.5 | 167.1 | 0 | 112.2 | A7 E10 S485 R486 K487 S491 F492 F493 | A7-K489 PolarHBondContact O-NZ 3.43Å; E10-K489 IonicContact OE2-NZ 3.68Å; S485-K489 PolarHBondContact O-N 3.48Å; S485-K489 VanDerWaalsContact O-N 3.09Å; R486-K489 PolarHBondContact O-N 3.13Å; K487-K489 VanDerWaalsContact C-N 3.33Å; K487-K489 PolarHBondContact O-N 3.45Å; K489-S491 VanDerWaalsContact C-N 3.33Å; K489-S491 PolarHBondContact O-N 3.38Å; K489-F492 PolarHBondContact O-N 2.73Å; K489-F493 HydrophobicContact CG-CD2 4.14Å; K489-F493 HydrophobicContact CG-CE2 4.16Å; K489-F493 WeakPolarHBondContact O-CD2 3.42Å; K489-F493 PolarHBondContact O-N 3.24Å |
| 490 | I | 62.6 | Low | 66.8 | Low | 90 Ų | 90 | 120.8 Ų | 120.8 | 46% | 0.462 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -63.2 | -41.6 | 175.3 | -66.7 | 165.4 | 0 | 0 | 0 | 110.6 | R486 K487 F492 F493 L494 | R486-I490 HydrophobicContact CG-CD1 4.16Å; R486-I490 WeakPolarHBondContact O-CG1 3.24Å; R486-I490 PolarHBondContact O-N 2.92Å; K487-I490 PolarHBondContact O-N 3.25Å; I490-F492 VanDerWaalsContact C-N 3.32Å; I490-F492 PolarHBondContact O-N 3.02Å; I490-F493 PolarHBondContact O-N 2.95Å; I490-L494 HydrophobicContact CG2-CD1 3.67Å; I490-L494 HydrophobicContact CG2-CG 4.49Å; I490-L494 WeakPolarHBondContact O-CB 3.47Å; I490-L494 WeakPolarHBondContact O-CD1 3.45Å; I490-L494 VanDerWaalsContact O-CG 3.31Å; I490-L494 WeakPolarHBondContact O-CG 3.37Å; I490-L494 PolarHBondContact O-N 3.04Å; I490-L494 VanDerWaalsContact O-N 3.15Å |
| 491 | S | 55.1 | Low | 65.5 | Low | 77 Ų | 77 | 119.9 Ų | 119.9 | 54% | 0.538 | 58% | 0.581 | S | S | . | * | H | α-helix | trans | -65.2 | -33.1 | 176.1 | -166.2 | 0 | 0 | 0 | 0 | 113.4 | K487 Y488 K489 S495 | K487-S491 PolarHBondContact O-N 3.01Å; Y488-S491 PolarHBondContact O-N 3.2Å; K489-S491 VanDerWaalsContact C-N 3.33Å; K489-S491 PolarHBondContact O-N 3.38Å; S491-S495 PolarHBondContact O-N 3.31Å |
| 492 | F | 57.6 | Low | 64.3 | Low | 163 Ų | 163 | 119.4 Ų | 119.4 | 72% | 0.715 | 58% | 0.583 | S | S | * | * | H | α-helix | trans | -75.1 | -29.3 | 177 | -175.2 | -94.2 | 0 | 0 | 0 | 112.9 | Y488 K489 I490 | Y488-F492 WeakPolarHBondContact O-CB 3.4Å; Y488-F492 PolarHBondContact O-N 3.01Å; K489-F492 PolarHBondContact O-N 2.73Å; I490-F492 VanDerWaalsContact C-N 3.32Å; I490-F492 PolarHBondContact O-N 3.02Å |
| 493 | F | 51.2 | Low | 63.2 | Low | 162 Ų | 162 | 120.8 Ų | 120.8 | 71% | 0.711 | 60% | 0.597 | S | S | * | * | H | α-helix | trans | -81.9 | -15.2 | 174.1 | -91 | -84.4 | 0 | 0 | 0 | 113.6 | K489 I490 | K489-F493 HydrophobicContact CG-CD2 4.14Å; K489-F493 HydrophobicContact CG-CE2 4.16Å; K489-F493 WeakPolarHBondContact O-CD2 3.42Å; K489-F493 PolarHBondContact O-N 3.24Å; I490-F493 PolarHBondContact O-N 2.95Å |
| 494 | L | 52.4 | Low | 62.1 | Low | 145 Ų | 145 | 121.9 Ų | 121.9 | 76% | 0.759 | 60% | 0.6 | S | S | * | * | trans | -98.2 | -7.3 | 177.9 | -73.2 | 168.1 | 0 | 0 | 0 | 113.2 | I490 | I490-L494 HydrophobicContact CG2-CD1 3.67Å; I490-L494 HydrophobicContact CG2-CG 4.49Å; I490-L494 WeakPolarHBondContact O-CB 3.47Å; I490-L494 WeakPolarHBondContact O-CD1 3.45Å; I490-L494 VanDerWaalsContact O-CG 3.31Å; I490-L494 WeakPolarHBondContact O-CG 3.37Å; I490-L494 PolarHBondContact O-N 3.04Å; I490-L494 VanDerWaalsContact O-N 3.15Å | ||
| 495 | S | 49.9 | Very low | 60.9 | Low | 151 Ų | 151 | 125.5 Ų | 125.5 | 100% | 1.056 | 62% | 0.616 | S | S | * | * | trans | -104.7 | 0 | 171.5 | -178.7 | 0 | 0 | 0 | 0 | 109.8 | S491 | S491-S495 PolarHBondContact O-N 3.31Š|
Retrieved 495 of 495 residues in 284.7 ms
(Link to these results)