| 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 | 36 | Very low | 30 | Very low | 239 Ų | 239 | 156.2 Ų | 156.2 | 100% | 1.177 | 86% | 0.855 | S | S | * | * | 0 | 97.1 | 0 | -158.2 | 167.8 | -173.5 | 0 | 0 | 105.7 | |||||
| 2 | E | 32.4 | Very low | 30.2 | Very low | 173 Ų | 173 | 152.7 Ų | 152.7 | 81% | 0.808 | 83% | 0.834 | S | S | * | * | trans | -63.1 | 142.6 | 176.3 | -65.8 | 176.5 | 108.5 | 0 | 0 | 109.6 | ||||
| 3 | L | 26.6 | Very low | 30.7 | Very low | 169 Ų | 169 | 147.7 Ų | 147.7 | 89% | 0.885 | 81% | 0.814 | S | S | * | * | trans | -136.9 | 106.8 | 152.5 | -111.7 | 125.6 | 0 | 0 | 0 | 107.8 | ||||
| 4 | Q | 28.2 | Very low | 30.9 | Very low | 171 Ų | 171 | 144.4 Ų | 144.4 | 80% | 0.799 | 81% | 0.806 | S | S | * | * | P | Polyproline II helix | trans | -63.8 | 134.6 | 170.4 | -71.1 | 167.5 | -32.8 | 0 | 0 | 109.4 | ||
| 5 | D | 29.3 | Very low | 31.3 | Very low | 170 Ų | 170 | 143.3 Ų | 143.3 | 91% | 0.909 | 80% | 0.798 | S | S | * | * | P | Polyproline II helix | trans | -103.7 | 134.5 | 159.3 | -101.1 | -41.6 | 0 | 0 | 0 | 110.5 | ||
| 6 | A | 26.3 | Very low | 31.5 | Very low | 90 Ų | 90 | 136.6 Ų | 136.6 | 74% | 0.744 | 77% | 0.767 | S | S | * | * | P | Polyproline II helix | trans | -75.4 | 139.3 | -156.9 | 0 | 0 | 0 | 0 | 0 | 114 | M8 | A6-M8 PolarHBondContact O-N 3.25Å; A6-M8 VanDerWaalsContact O-N 3.17Å |
| 7 | K | 29.8 | Very low | 31.6 | Very low | 200 Ų | 200 | 133.1 Ų | 133.1 | 87% | 0.87 | 75% | 0.749 | S | S | * | * | trans | -55.1 | 112.1 | 157.1 | -91.2 | 173.7 | 170.2 | 172.9 | 0 | 109.3 | ||||
| 8 | M | 27.8 | Very low | 31.8 | Very low | 186 Ų | 186 | 128.9 Ų | 128.9 | 92% | 0.916 | 73% | 0.725 | S | S | * | * | trans | -103.8 | 98.1 | 159.9 | -128.4 | 176.5 | 119.6 | 0 | 0 | 108.6 | A6 G10 | A6-M8 PolarHBondContact O-N 3.25Å; A6-M8 VanDerWaalsContact O-N 3.17Å; M8-G10 PolarHBondContact O-N 3.21Å; M8-G10 VanDerWaalsContact O-N 3.08Å | ||
| 9 | N | 32.8 | Very low | 32 | Very low | 159 Ų | 159 | 130.9 Ų | 130.9 | 85% | 0.85 | 72% | 0.721 | S | S | * | * | trans | -65.7 | 97.8 | 162.6 | -76.4 | -19.9 | 0 | 0 | 0 | 107.8 | ||||
| 10 | G | 29.1 | Very low | 32 | Very low | 59 Ų | 59 | 132.5 Ų | 132.5 | 61% | 0.608 | 72% | 0.716 | S | S | * | * | trans | -114 | 120.8 | 167.7 | 0 | 0 | 0 | 0 | 0 | 108.9 | M8 L12 | M8-G10 PolarHBondContact O-N 3.21Å; M8-G10 VanDerWaalsContact O-N 3.08Å; G10-L12 PolarHBondContact O-N 3.44Å | ||
| 11 | A | 31.8 | Very low | 32 | Very low | 102 Ų | 102 | 132.4 Ų | 132.4 | 84% | 0.843 | 71% | 0.711 | S | S | * | * | P | Polyproline II helix | trans | -52.7 | 126.4 | 171.5 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||
| 12 | L | 32.6 | Very low | 32.2 | Very low | 114 Ų | 114 | 128.2 Ų | 128.2 | 60% | 0.597 | 69% | 0.688 | S | S | * | * | P | Polyproline II helix | trans | -59 | 136.5 | 173.7 | -86.8 | 132.1 | 0 | 0 | 0 | 109.4 | G10 A16 | G10-L12 PolarHBondContact O-N 3.44Å; L12-A16 HydrophobicContact CB-CB 4.46Å; L12-A16 HydrophobicContact CD2-CB 3.53Å |
| 13 | P | 37 | Very low | 32.3 | Very low | 88 Ų | 88 | 130.2 Ų | 130.2 | 57% | 0.571 | 69% | 0.688 | S | S | * | * | P | Polyproline II helix | trans | -59.2 | 141.9 | 171.5 | 19.6 | -25 | 0 | 0 | 0 | 109.5 | D15 A16 | P13-D15 PolarHBondContact O-N 3.18Å; P13-A16 HydrophobicContact CG-CB 4.35Å; P13-A16 WeakPolarHBondContact O-CB 3.1Å; P13-A16 PolarHBondContact O-N 3.27Å |
| 14 | S | 33.3 | Very low | 32.8 | Very low | 101 Ų | 101 | 129.4 Ų | 129.4 | 71% | 0.706 | 68% | 0.68 | S | S | * | * | H | α-helix | trans | -47 | -31.5 | -179.1 | -174.7 | 0 | 0 | 0 | 0 | 113.4 | A16 V17 D18 | S14-A16 PolarHBondContact O-N 3.39Å; S14-V17 PolarHBondContact O-N 3.29Å; S14-D18 PolarHBondContact O-N 3.49Å |
| 15 | D | 36.6 | Very low | 33 | Very low | 129 Ų | 129 | 123.8 Ų | 123.8 | 69% | 0.69 | 67% | 0.668 | S | S | * | * | H | α-helix | trans | -69.2 | -27.7 | 178.5 | -65.4 | -22.9 | 0 | 0 | 0 | 114.1 | P13 V17 Y19 | P13-D15 PolarHBondContact O-N 3.18Å; D15-V17 VanDerWaalsContact C-N 3.33Å; D15-Y19 PolarHBondContact O-N 3Å |
| 16 | A | 34.9 | Very low | 33.6 | Very low | 36 Ų | 36 | 123.5 Ų | 123.5 | 30% | 0.298 | 66% | 0.659 | S | S | . | * | H | α-helix | trans | -78.1 | -22.8 | 176.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | L12 P13 S14 R20 | L12-A16 HydrophobicContact CB-CB 4.46Å; L12-A16 HydrophobicContact CD2-CB 3.53Å; P13-A16 HydrophobicContact CG-CB 4.35Å; P13-A16 WeakPolarHBondContact O-CB 3.1Å; P13-A16 PolarHBondContact O-N 3.27Å; S14-A16 PolarHBondContact O-N 3.39Å; A16-R20 PolarHBondContact O-N 3.15Å |
| 17 | V | 32.8 | Very low | 34.1 | Very low | 76 Ų | 76 | 126.7 Ų | 126.7 | 46% | 0.461 | 66% | 0.662 | S | S | . | * | H | α-helix | trans | -75.9 | -44 | 172.5 | -175.6 | 0 | 0 | 0 | 0 | 109.6 | S14 D15 Y19 R20 Q21 | S14-V17 PolarHBondContact O-N 3.29Å; D15-V17 VanDerWaalsContact C-N 3.33Å; V17-Y19 VanDerWaalsContact C-N 3.29Å; V17-Y19 PolarHBondContact O-N 3.04Å; V17-R20 PolarHBondContact O-N 2.9Å; V17-R20 VanDerWaalsContact O-N 3.11Å; V17-Q21 WeakPolarHBondContact O-CB 2.96Å; V17-Q21 PolarHBondContact O-N 3.33Å |
| 18 | D | 35.2 | Very low | 34.3 | Very low | 58 Ų | 58 | 123.2 Ų | 123.2 | 31% | 0.31 | 66% | 0.66 | S | S | . | * | H | α-helix | trans | -60.2 | -39 | 176.1 | -138.9 | 11.5 | 0 | 0 | 0 | 111.1 | S14 R20 Q21 E22 R288 | S14-D18 PolarHBondContact O-N 3.49Å; D18-R20 PolarHBondContact O-N 3.01Å; D18-Q21 PolarHBondContact O-N 3.05Å; D18-E22 PolarHBondContact O-N 3.44Å; D18-R288 IonicContact OD2-CZ 3.46Å; D18-R288 IonicContact OD2-NH1 3Å; D18-R288 PolarHBondContact OD2-NH1 3.47Å; D18-R288 IonicContact OD2-NH2 3.37Å; D18-R288 PolarHBondContact OD2-NH2 2.93Å |
| 19 | Y | 36.1 | Very low | 34.7 | Very low | 168 Ų | 168 | 120.3 Ų | 120.3 | 66% | 0.659 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -67.3 | -30.3 | 176.3 | -153.4 | -92.5 | 0 | 0 | 0 | 114 | D15 V17 | D15-Y19 PolarHBondContact O-N 3Å; V17-Y19 VanDerWaalsContact C-N 3.29Å; V17-Y19 PolarHBondContact O-N 3.04Å |
| 20 | R | 31.5 | Very low | 34.8 | Very low | 162 Ų | 162 | 124.3 Ų | 124.3 | 61% | 0.611 | 66% | 0.661 | S | S | * | * | H | α-helix | trans | -82.9 | -34.9 | 176.2 | -169.4 | -179.6 | -70.7 | -159.8 | -0.9 | 111.2 | A16 V17 D18 R23 E24 | A16-R20 PolarHBondContact O-N 3.15Å; V17-R20 PolarHBondContact O-N 2.9Å; V17-R20 VanDerWaalsContact O-N 3.11Å; D18-R20 PolarHBondContact O-N 3.01Å; R20-R23 VanDerWaalsContact O-CB 3.29Å; R20-R23 WeakPolarHBondContact O-CB 2.9Å; R20-R23 PolarHBondContact O-N 3.19Å; R20-E24 PolarHBondContact O-N 2.9Å |
| 21 | Q | 32.2 | Very low | 35.1 | Very low | 131 Ų | 131 | 124.7 Ų | 124.7 | 61% | 0.612 | 67% | 0.665 | S | S | * | * | H | α-helix | trans | -69.8 | -32.4 | -177.4 | -153.2 | 166.7 | 6.1 | 0 | 0 | 112.4 | V17 D18 R23 E24 | V17-Q21 WeakPolarHBondContact O-CB 2.96Å; V17-Q21 PolarHBondContact O-N 3.33Å; D18-Q21 PolarHBondContact O-N 3.05Å; Q21-R23 PolarHBondContact O-N 2.95Å; Q21-E24 PolarHBondContact O-N 3.32Å |
| 22 | E | 39.9 | Very low | 35.2 | Very low | 150 Ų | 150 | 125 Ų | 125 | 70% | 0.701 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -62.1 | -20.8 | 168.7 | -80 | -171.1 | 155.7 | 0 | 0 | 113.3 | D18 | D18-E22 PolarHBondContact O-N 3.44Å |
| 23 | R | 34.5 | Very low | 35.6 | Very low | 215 Ų | 215 | 123 Ų | 123 | 81% | 0.811 | 66% | 0.658 | S | S | * | * | H | α-helix | trans | -90 | -23.5 | -177.9 | -124.6 | -171.6 | -174.9 | -152.6 | 2.4 | 114.3 | R20 Q21 | R20-R23 VanDerWaalsContact O-CB 3.29Å; R20-R23 WeakPolarHBondContact O-CB 2.9Å; R20-R23 PolarHBondContact O-N 3.19Å; Q21-R23 PolarHBondContact O-N 2.95Å |
| 24 | E | 36.2 | Very low | 35.4 | Very low | 153 Ų | 153 | 125.5 Ų | 125.5 | 72% | 0.715 | 67% | 0.674 | S | S | * | * | H | α-helix | trans | -99.4 | -6.5 | -170.4 | -70.8 | -172.5 | 174.7 | 0 | 0 | 114.1 | R20 Q21 | R20-E24 PolarHBondContact O-N 2.9Å; Q21-E24 PolarHBondContact O-N 3.32Å |
| 25 | G | 34.2 | Very low | 35.7 | Very low | 52 Ų | 52 | 124.6 Ų | 124.6 | 54% | 0.536 | 68% | 0.681 | S | S | . | * | S | Bend | trans | -86.6 | -4.5 | -167 | 0 | 0 | 0 | 0 | 0 | 119.1 | ||
| 26 | F | 40.2 | Very low | 35.6 | Very low | 165 Ų | 165 | 122.1 Ų | 122.1 | 72% | 0.724 | 67% | 0.674 | S | S | * | * | S | Bend | trans | -137.7 | 13 | -157.6 | -79.5 | -77.5 | 0 | 0 | 0 | 119.3 | ||
| 27 | L | 37.4 | Very low | 35.3 | Very low | 156 Ų | 156 | 129.6 Ų | 129.6 | 82% | 0.817 | 70% | 0.7 | S | S | * | * | trans | -140.6 | 132.1 | 171.7 | -68 | 171.9 | 0 | 0 | 0 | 112.3 | S29 | L27-S29 PolarHBondContact O-N 3.27Š| ||
| 28 | P | 34.7 | Very low | 35.2 | Very low | 127 Ų | 127 | 130.7 Ų | 130.7 | 83% | 0.825 | 71% | 0.708 | S | S | * | * | trans | -64.4 | 124.9 | 165.5 | 25.1 | -29.5 | 0 | 0 | 0 | 109.6 | R30 | P28-R30 PolarHBondContact O-N 3.09Š| ||
| 29 | S | 34.7 | Very low | 35.1 | Very low | 125 Ų | 125 | 134.2 Ų | 134.2 | 87% | 0.874 | 73% | 0.732 | S | S | * | * | trans | -56.7 | 95.5 | -179 | -67.1 | 0 | 0 | 0 | 0 | 112.9 | L27 | L27-S29 PolarHBondContact O-N 3.27Š| ||
| 30 | R | 36.2 | Very low | 34.9 | Very low | 244 Ų | 244 | 133.3 Ų | 133.3 | 92% | 0.921 | 73% | 0.734 | S | S | * | * | trans | -97.2 | 108.2 | 143.2 | -108.2 | -179.2 | 172.6 | 170.8 | -1.5 | 106.7 | P28 | P28-R30 PolarHBondContact O-N 3.09Š| ||
| 31 | G | 34.8 | Very low | 35.2 | Very low | 66 Ų | 66 | 134.7 Ų | 134.7 | 68% | 0.68 | 75% | 0.745 | S | S | * | * | P | Polyproline II helix | trans | -53.6 | 143.4 | -179.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | ||
| 32 | P | 35.2 | Very low | 35.7 | Very low | 109 Ų | 109 | 133.6 Ų | 133.6 | 71% | 0.708 | 74% | 0.74 | S | S | * | * | P | Polyproline II helix | trans | -66.6 | 139.2 | -179.3 | 26.6 | -31.4 | 0 | 0 | 0 | 110.3 | ||
| 33 | A | 39.6 | Very low | 35.6 | Very low | 71 Ų | 71 | 134 Ų | 134 | 59% | 0.587 | 75% | 0.747 | S | S | * | * | P | Polyproline II helix | trans | -57.9 | 138.5 | 168 | 0 | 0 | 0 | 0 | 0 | 109.7 | G35 S36 | A33-G35 PolarHBondContact O-N 3.28Å; A33-S36 PolarHBondContact O-N 3.05Å |
| 34 | P | 33 | Very low | 36.3 | Very low | 141 Ų | 141 | 131.1 Ų | 131.1 | 92% | 0.916 | 74% | 0.741 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.6 | 113.8 | -177.1 | 23.4 | -30.6 | 0 | 0 | 0 | 109.8 | ||
| 35 | G | 40.7 | Very low | 37.3 | Very low | 82 Ų | 82 | 130.7 Ų | 130.7 | 85% | 0.845 | 74% | 0.739 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 120.8 | -7.3 | 174.7 | 0 | 0 | 0 | 0 | 0 | 116.5 | A33 K37 | A33-G35 PolarHBondContact O-N 3.28Å; G35-K37 PolarHBondContact O-N 3.49Å |
| 36 | S | 32.9 | Very low | 38.9 | Very low | 78 Ų | 78 | 128.3 Ų | 128.3 | 55% | 0.545 | 72% | 0.715 | S | S | . | * | trans | -85.4 | 109.5 | 172.1 | 62.9 | 0 | 0 | 0 | 0 | 110.8 | A33 | A33-S36 PolarHBondContact O-N 3.05Š| ||
| 37 | K | 29.3 | Very low | 40.8 | Very low | 192 Ų | 192 | 129.6 Ų | 129.6 | 84% | 0.835 | 72% | 0.72 | S | S | * | * | trans | -60.8 | 131.8 | 168.2 | -71.2 | -178.2 | 178.2 | -179.6 | 0 | 108 | G35 V39 | G35-K37 PolarHBondContact O-N 3.49Å; K37-V39 PolarHBondContact O-N 3.23Å | ||
| 38 | P | 30.3 | Very low | 43 | Very low | 99 Ų | 99 | 123.5 Ų | 123.5 | 64% | 0.643 | 69% | 0.689 | S | S | * | * | trans | -57.7 | 140.3 | 169.9 | 25.3 | -31.6 | 0 | 0 | 0 | 108.1 | Q40 | P38-Q40 PolarHBondContact O-N 2.76Š| ||
| 39 | V | 34.5 | Very low | 45.7 | Very low | 133 Ų | 133 | 120.3 Ų | 120.3 | 81% | 0.806 | 67% | 0.67 | S | S | * | * | trans | -65.1 | 89.3 | 175.9 | -177.3 | 0 | 0 | 0 | 0 | 107.8 | K37 F41 | K37-V39 PolarHBondContact O-N 3.23Å; V39-F41 HydrophobicContact CG1-CD2 3.96Å; V39-F41 PolarHBondContact O-N 3.21Å | ||
| 40 | Q | 32 | Very low | 48.4 | Very low | 149 Ų | 149 | 117.9 Ų | 117.9 | 70% | 0.696 | 64% | 0.644 | S | S | * | * | trans | -90.6 | 86.1 | -177.7 | -160 | 170.4 | 6.5 | 0 | 0 | 106.9 | P38 | P38-Q40 PolarHBondContact O-N 2.76Š| ||
| 41 | F | 36.8 | Very low | 51 | Low | 191 Ų | 191 | 107.9 Ų | 107.9 | 84% | 0.838 | 62% | 0.616 | S | S | * | * | trans | -103.9 | 61.2 | 179.5 | -120.7 | -74.3 | 0 | 0 | 0 | 111 | V39 | V39-F41 HydrophobicContact CG1-CD2 3.96Å; V39-F41 PolarHBondContact O-N 3.21Å | ||
| 42 | M | 42.4 | Very low | 53.6 | Low | 107 Ų | 107 | 106.4 Ų | 106.4 | 53% | 0.527 | 59% | 0.592 | S | S | . | * | trans | -154.2 | 81.4 | 162.7 | -73.1 | -162.2 | 76.5 | 0 | 0 | 111.2 | R109 P285 | M42-R109 VanDerWaalsContact CE-CZ 3.44Å; M42-P285 HydrophobicContact CE-CG 4.37Å | ||
| 43 | D | 38.2 | Very low | 56.2 | Low | 158 Ų | 158 | 101.2 Ų | 101.2 | 85% | 0.845 | 56% | 0.559 | S | S | * | * | trans | -103 | 21.2 | 167.6 | -83 | -18.1 | 0 | 0 | 0 | 112.4 | ||||
| 44 | F | 49.1 | Very low | 58.8 | Low | 155 Ų | 155 | 98.6 Ų | 98.6 | 68% | 0.68 | 54% | 0.536 | S | S | * | . | trans | -117 | 94.3 | 172.5 | -150.8 | -96.3 | 0 | 0 | 0 | 109.8 | G46 | F44-G46 PolarHBondContact O-N 3.17Š| ||
| 45 | E | 57.8 | Low | 61.6 | Low | 145 Ų | 145 | 96.4 Ų | 96.4 | 68% | 0.678 | 51% | 0.512 | S | S | * | . | trans | -73.1 | 111.9 | 169.8 | -157.3 | 173.6 | -171.6 | 0 | 0 | 108 | K47 | E45-K47 PolarHBondContact O-N 3.09Š| ||
| 46 | G | 66.8 | Low | 63.9 | Low | 2 Ų | 2 | 92.8 Ų | 92.8 | 2% | 0.021 | 47% | 0.473 | C | S | . | . | trans | -55.6 | 134.6 | 176.8 | 0 | 0 | 0 | 0 | 0 | 110.9 | F44 E281 C283 | F44-G46 PolarHBondContact O-N 3.17Å; G46-E281 CarbonylContact C-O 3.42Å; G46-E281 WeakPolarHBondContact CA-O 3.2Å; G46-C283 WeakPolarHBondContact O-CA 3.34Å; G46-C283 WeakPolarHBondContact O-CB 3.38Å | ||
| 47 | K | 80.2 | Confident | 66.8 | Low | 191 Ų | 191 | 89 Ų | 89 | 83% | 0.83 | 45% | 0.447 | S | S | * | . | trans | -98.1 | -7.8 | -176.1 | -63 | -175.5 | -179.6 | -178.3 | 0 | 112.9 | E45 E281 | E45-K47 PolarHBondContact O-N 3.09Å; K47-E281 PolarHBondContact N-O 3.1Å; K47-E281 VanDerWaalsContact N-O 3.17Å | ||
| 48 | T | 83.6 | Confident | 69.8 | Low | 28 Ų | 28 | 80.1 Ų | 80.1 | 17% | 0.172 | 41% | 0.408 | C | S | . | . | B | Isolated β-bridge | trans | -86.2 | 128.7 | -168.9 | -26 | 0 | 0 | 0 | 0 | 110.4 | M52 E281 C283 | T48-M52 HydrophobicContact CG2-CB 3.84Å; T48-E281 WeakPolarHBondContact CB-O 3.38Å; T48-E281 PolarHBondContact N-O 3.41Å; T48-E281 WeakPolarHBondContact OG1-CB 3.48Å; T48-E281 PolarHBondContact OG1-O 3.33Å; T48-C283 WeakPolarHBondContact O-CB 3.39Å; T48-C283 PolarHBondContact O-N 3.41Å |
| 49 | S | 90.7 | Very high | 72.7 | Confident | 60 Ų | 60 | 75.4 Ų | 75.4 | 42% | 0.42 | 38% | 0.378 | S | S | . | . | trans | -70 | 165.5 | -179.9 | 72.1 | 0 | 0 | 0 | 0 | 112 | G51 M52 S53 | S49-G51 PolarHBondContact O-N 2.9Å; S49-M52 PolarHBondContact O-N 3.32Å; S49-M52 WeakPolarHBondContact OG-CB 3.14Å; S49-M52 VanDerWaalsContact OG-CG 3.29Å; S49-M52 WeakPolarHBondContact OG-CG 3.34Å; S49-M52 PolarHBondContact OG-N 2.69Å; S49-S53 WeakPolarHBondContact O-CB 3.37Å; S49-S53 PolarHBondContact O-N 2.86Å; S49-S53 PolarHBondContact O-OG 2.94Å | ||
| 50 | F | 92.3 | Very high | 75.3 | Confident | 74 Ų | 74 | 69.9 Ų | 69.9 | 33% | 0.325 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -58 | -49.2 | 177.1 | 178.7 | -92.4 | 0 | 0 | 0 | 111.9 | M52 S53 V54 A292 V293 | F50-M52 PolarHBondContact O-N 3.35Å; F50-S53 WeakPolarHBondContact O-CB 3.48Å; F50-S53 PolarHBondContact O-N 3Å; F50-S53 VanDerWaalsContact O-N 3.17Å; F50-V54 HydrophobicContact CD1-CG2 4.23Å; F50-V54 HydrophobicContact CE1-CG2 3.84Å; F50-V54 HydrophobicContact CZ-CG2 4.13Å; F50-V54 WeakPolarHBondContact O-CG2 3.36Å; F50-V54 PolarHBondContact O-N 2.83Å; F50-A292 HydrophobicContact CE2-CB 4Å; F50-A292 HydrophobicContact CZ-CB 4.21Å; F50-V293 HydrophobicContact CD2-CG2 3.49Å; F50-V293 VanDerWaalsContact CD2-CG2 3.49Å; F50-V293 HydrophobicContact CE2-CB 4.34Å; F50-V293 HydrophobicContact CE2-CG2 3.38Å; F50-V293 HydrophobicContact CG-CG2 4.34Å; F50-V293 HydrophobicContact CZ-CG2 4.15Å |
| 51 | G | 90.8 | Very high | 78.2 | Confident | 34 Ų | 34 | 63 Ų | 63 | 35% | 0.351 | 31% | 0.314 | S | S | . | . | H | α-helix | trans | -63.4 | -41.1 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113.2 | S49 S53 V54 F55 | S49-G51 PolarHBondContact O-N 2.9Å; G51-S53 VanDerWaalsContact C-N 3.28Å; G51-S53 PolarHBondContact O-N 3.48Å; G51-V54 WeakPolarHBondContact O-CB 3.42Å; G51-V54 PolarHBondContact O-N 3.3Å; G51-F55 WeakPolarHBondContact O-CD2 3.42Å; G51-F55 WeakPolarHBondContact O-CG 3.4Å; G51-F55 PolarHBondContact O-N 3.43Å |
| 52 | M | 89.5 | Confident | 80.6 | Confident | 35 Ų | 35 | 54 Ų | 54 | 17% | 0.172 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -64.1 | -34.7 | 174.9 | -71.7 | -73.2 | -95.2 | 0 | 0 | 112.1 | T48 S49 F50 F55 N56 G195 Y196 | T48-M52 HydrophobicContact CG2-CB 3.84Å; S49-M52 PolarHBondContact O-N 3.32Å; S49-M52 WeakPolarHBondContact OG-CB 3.14Å; S49-M52 VanDerWaalsContact OG-CG 3.29Å; S49-M52 WeakPolarHBondContact OG-CG 3.34Å; S49-M52 PolarHBondContact OG-N 2.69Å; F50-M52 PolarHBondContact O-N 3.35Å; M52-F55 PolarHBondContact O-N 3.16Å; M52-F55 HydrophobicContact SD-CD2 4.43Å; M52-N56 PolarHBondContact O-N 3.29Å; M52-G195 VanDerWaalsContact CE-C 3.45Å; M52-G195 VanDerWaalsContact CE-CA 3.41Å; M52-Y196 HydrophobicContact CE-CD1 4.07Å; M52-Y196 HydrophobicContact CE-CD2 3.78Å; M52-Y196 HydrophobicContact CE-CE1 4.04Å; M52-Y196 HydrophobicContact CE-CE2 3.74Å; M52-Y196 HydrophobicContact CE-CG 3.95Å |
| 53 | S | 90.9 | Very high | 82.3 | Confident | 1 Ų | 1 | 49.2 Ų | 49.2 | 1% | 0.007 | 25% | 0.253 | C | S | . | . | H | α-helix | trans | -69.1 | -37.2 | 175 | -54.1 | 0 | 0 | 0 | 0 | 111.7 | S49 F50 G51 N56 L57 L282 | S49-S53 WeakPolarHBondContact O-CB 3.37Å; S49-S53 PolarHBondContact O-N 2.86Å; S49-S53 PolarHBondContact O-OG 2.94Å; F50-S53 WeakPolarHBondContact O-CB 3.48Å; F50-S53 PolarHBondContact O-N 3Å; F50-S53 VanDerWaalsContact O-N 3.17Å; G51-S53 VanDerWaalsContact C-N 3.28Å; G51-S53 PolarHBondContact O-N 3.48Å; S53-N56 PolarHBondContact O-N 3.3Å; S53-L57 WeakPolarHBondContact O-CB 3.49Å; S53-L57 PolarHBondContact O-N 3.06Å; S53-L282 VanDerWaalsContact OG-CD1 3.28Å; S53-L282 WeakPolarHBondContact OG-CD1 3.13Å |
| 54 | V | 93.5 | Very high | 84.5 | Confident | 16 Ų | 16 | 41.7 Ų | 41.7 | 10% | 0.097 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -62.6 | -43.4 | 171.1 | 171 | 0 | 0 | 0 | 0 | 110.5 | F50 G51 L57 S58 V293 V296 S297 | F50-V54 HydrophobicContact CD1-CG2 4.23Å; F50-V54 HydrophobicContact CE1-CG2 3.84Å; F50-V54 HydrophobicContact CZ-CG2 4.13Å; F50-V54 WeakPolarHBondContact O-CG2 3.36Å; F50-V54 PolarHBondContact O-N 2.83Å; G51-V54 WeakPolarHBondContact O-CB 3.42Å; G51-V54 PolarHBondContact O-N 3.3Å; V54-L57 PolarHBondContact O-N 2.86Å; V54-S58 WeakPolarHBondContact O-CB 3.3Å; V54-S58 PolarHBondContact O-N 3.42Å; V54-S58 PolarHBondContact O-OG 2.98Å; V54-V293 HydrophobicContact CG2-CB 4.33Å; V54-V293 HydrophobicContact CG2-CG1 4.02Å; V54-V293 HydrophobicContact CG2-CG2 4.3Å; V54-V296 HydrophobicContact CG1-CG1 3.94Å; V54-V296 HydrophobicContact CG2-CB 4.41Å; V54-V296 HydrophobicContact CG2-CG1 4.25Å; V54-S297 PolarHBondContact O-OG 3.44Å |
| 55 | F | 91.2 | Very high | 86.2 | Confident | 95 Ų | 95 | 34.4 Ų | 34.4 | 42% | 0.417 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -64.9 | -43.2 | 176.7 | -67.1 | -37 | 0 | 0 | 0 | 112.7 | G51 M52 S58 N59 L202 | G51-F55 WeakPolarHBondContact O-CD2 3.42Å; G51-F55 WeakPolarHBondContact O-CG 3.4Å; G51-F55 PolarHBondContact O-N 3.43Å; M52-F55 PolarHBondContact O-N 3.16Å; M52-F55 HydrophobicContact SD-CD2 4.43Å; F55-S58 PolarHBondContact O-N 3.26Å; F55-N59 WeakPolarHBondContact O-CB 3.36Å; F55-N59 PolarHBondContact O-N 3.33Å; F55-L202 HydrophobicContact CB-CD1 3.85Å; F55-L202 HydrophobicContact CD1-CD1 3.53Å; F55-L202 HydrophobicContact CE1-CD1 4.46Å; F55-L202 HydrophobicContact CG-CD1 4.06Å; F55-L202 WeakPolarHBondContact O-CD1 3.4Å |
| 56 | N | 89.9 | Confident | 87.7 | Confident | 5 Ų | 5 | 27.8 Ų | 27.8 | 3% | 0.027 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -60 | -48.3 | 175.5 | -75.8 | -7.7 | 0 | 0 | 0 | 111.7 | M52 S53 N59 A60 L194 G195 S198 I278 | M52-N56 PolarHBondContact O-N 3.29Å; S53-N56 PolarHBondContact O-N 3.3Å; N56-N59 PolarHBondContact O-N 3.44Å; N56-A60 PolarHBondContact O-N 3Å; N56-L194 VanDerWaalsContact OD1-C 3.25Å; N56-L194 PolarHBondContact OD1-O 3.01Å; N56-G195 WeakPolarHBondContact OD1-CA 3.15Å; N56-G195 PolarHBondContact OD1-N 2.91Å; N56-S198 PolarHBondContact OD1-OG 3.3Å; N56-I278 HydrophobicContact CB-CD1 3.94Å; N56-I278 HydrophobicContact CB-CG1 4.35Å |
| 57 | L | 92.2 | Very high | 88.7 | Confident | 0 Ų | 0 | 27.9 Ų | 27.9 | 0% | 0 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -70.5 | -36.9 | -178.6 | -172 | 63.1 | 0 | 0 | 0 | 111.8 | S53 V54 A60 I61 C271 V275 I278 M290 V293 A294 | S53-L57 WeakPolarHBondContact O-CB 3.49Å; S53-L57 PolarHBondContact O-N 3.06Å; V54-L57 PolarHBondContact O-N 2.86Å; L57-A60 WeakPolarHBondContact O-CB 3.33Å; L57-A60 PolarHBondContact O-N 3.41Å; L57-I61 HydrophobicContact CG-CD1 4.36Å; L57-I61 WeakPolarHBondContact O-CG1 3.3Å; L57-I61 PolarHBondContact O-N 3.28Å; L57-C271 HydrophobicContact CD1-CB 3.79Å; L57-V275 HydrophobicContact CD1-CG2 4.09Å; L57-I278 HydrophobicContact CB-CD1 3.89Å; L57-I278 HydrophobicContact CD1-CD1 3.99Å; L57-M290 HydrophobicContact CD2-CE 4.28Å; L57-V293 HydrophobicContact CB-CG1 4.35Å; L57-V293 HydrophobicContact CD2-CG1 3.98Å; L57-A294 HydrophobicContact CD2-CB 4.05Å |
| 58 | S | 93.3 | Very high | 89.1 | Confident | 4 Ų | 4 | 18.8 Ų | 18.8 | 3% | 0.028 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -63.9 | -41 | 173.9 | -61.3 | 0 | 0 | 0 | 0 | 111.2 | V54 F55 A60 I61 M62 S297 | V54-S58 WeakPolarHBondContact O-CB 3.3Å; V54-S58 PolarHBondContact O-N 3.42Å; V54-S58 PolarHBondContact O-OG 2.98Å; F55-S58 PolarHBondContact O-N 3.26Å; S58-A60 VanDerWaalsContact C-N 3.31Å; S58-A60 PolarHBondContact O-N 3.36Å; S58-I61 PolarHBondContact O-N 3.03Å; S58-M62 WeakPolarHBondContact O-CB 3.15Å; S58-M62 PolarHBondContact O-N 3.37Å; S58-S297 WeakPolarHBondContact OG-CB 3.45Å |
| 59 | N | 90.2 | Very high | 89.5 | Confident | 1 Ų | 1 | 17.5 Ų | 17.5 | 1% | 0.005 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -64.7 | -36.1 | 175.9 | -168.8 | 52.5 | 0 | 0 | 0 | 112.3 | F55 N56 M62 S201 T349 | F55-N59 WeakPolarHBondContact O-CB 3.36Å; F55-N59 PolarHBondContact O-N 3.33Å; N56-N59 PolarHBondContact O-N 3.44Å; N59-M62 WeakPolarHBondContact OD1-CE 3.4Å; N59-S201 VanDerWaalsContact OD1-CB 3.23Å; N59-S201 WeakPolarHBondContact OD1-CB 3.32Å; N59-S201 PolarHBondContact OD1-OG 3.1Å; N59-T349 PolarHBondContact ND2-OG1 3.38Å; N59-T349 PolarHBondContact OD1-OG1 3.04Å |
| 60 | A | 89.3 | Confident | 89.6 | Confident | 17 Ų | 17 | 14.7 Ų | 14.7 | 14% | 0.14 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -65.1 | -38.2 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | N56 L57 S58 E274 | N56-A60 PolarHBondContact O-N 3Å; L57-A60 WeakPolarHBondContact O-CB 3.33Å; L57-A60 PolarHBondContact O-N 3.41Å; S58-A60 VanDerWaalsContact C-N 3.31Å; S58-A60 PolarHBondContact O-N 3.36Å; A60-E274 HydrophobicContact CB-CB 4.15Å; A60-E274 HydrophobicContact CB-CG 3.71Å |
| 61 | I | 92.7 | Very high | 89.5 | Confident | 5 Ų | 5 | 11.6 Ų | 11.6 | 3% | 0.026 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -70.7 | -56.8 | 176.1 | -64.8 | 163.5 | 0 | 0 | 0 | 109.7 | L57 S58 G63 A268 F269 C271 I298 M301 Y305 | L57-I61 HydrophobicContact CG-CD1 4.36Å; L57-I61 WeakPolarHBondContact O-CG1 3.3Å; L57-I61 PolarHBondContact O-N 3.28Å; S58-I61 PolarHBondContact O-N 3.03Å; I61-G63 VanDerWaalsContact C-N 3.32Å; I61-G63 PolarHBondContact O-N 3.45Å; I61-A268 WeakPolarHBondContact CG2-O 3.45Å; I61-A268 VanDerWaalsContact O-O 3.04Å; I61-F269 HydrophobicContact CG2-CD1 4.15Å; I61-C271 HydrophobicContact CD1-CB 4.37Å; I61-C271 HydrophobicContact CG1-CB 3.49Å; I61-C271 VanDerWaalsContact CG1-CB 3.49Å; I61-I298 HydrophobicContact CD1-CG1 3.83Å; I61-M301 HydrophobicContact CB-CB 4.41Å; I61-M301 HydrophobicContact CB-CG 3.84Å; I61-M301 HydrophobicContact CD1-CG 4.29Å; I61-M301 HydrophobicContact CG2-CB 3.61Å; I61-M301 HydrophobicContact CG2-CG 3.59Å; I61-Y305 HydrophobicContact CG2-CE2 4.06Å; I61-Y305 PolarHBondContact O-OH 2.92Å |
| 62 | M | 87.8 | Confident | 89.5 | Confident | 1 Ų | 1 | 10 Ų | 10 | 1% | 0.005 | 5% | 0.053 | C | C | . | . | H | α-helix | trans | -47.2 | -49.6 | -169.2 | -174.6 | 171.8 | 55.5 | 0 | 0 | 114 | S58 N59 L202 M205 M301 Y305 | S58-M62 WeakPolarHBondContact O-CB 3.15Å; S58-M62 PolarHBondContact O-N 3.37Å; N59-M62 WeakPolarHBondContact OD1-CE 3.4Å; M62-L202 HydrophobicContact CE-CB 4.49Å; M62-L202 HydrophobicContact CE-CD2 3.61Å; M62-L202 HydrophobicContact CE-CG 3.9Å; M62-L202 HydrophobicContact SD-CD2 3.55Å; M62-L202 VanDerWaalsContact SD-CD2 3.55Å; M62-L202 HydrophobicContact SD-CG 4.4Å; M62-M205 HydrophobicContact CE-CB 4.18Å; M62-M205 HydrophobicContact CE-CE 3.34Å; M62-M205 HydrophobicContact CE-CG 3.87Å; M62-M205 HydrophobicContact CE-SD 3.04Å; M62-M205 WeakPolarHBondContact CE-SD 3.33Å; M62-M205 HydrophobicContact CG-CB 4.33Å; M62-M205 HydrophobicContact CG-CE 3.93Å; M62-M205 HydrophobicContact CG-CG 3.89Å; M62-M205 HydrophobicContact CG-SD 4.17Å; M62-M205 HydrophobicContact SD-CB 3.23Å; M62-M205 WeakPolarHBondContact SD-CB 3.47Å; M62-M205 HydrophobicContact SD-CE 3.88Å; M62-M205 HydrophobicContact SD-CG 3.24Å; M62-M205 WeakPolarHBondContact SD-CG 3.22Å; M62-M205 HydrophobicContact SD-SD 3.36Å; M62-M301 HydrophobicContact CB-SD 3.71Å; M62-M301 HydrophobicContact CG-SD 4.21Å; M62-Y305 WeakPolarHBondContact CA-OH 3.45Å; M62-Y305 PolarHBondContact N-OH 2.95Å; M62-Y305 PolarHBondContact O-OH 3.35Å |
| 63 | G | 79.4 | Confident | 89.6 | Confident | 6 Ų | 6 | 8.3 Ų | 8.3 | 6% | 0.062 | 5% | 0.045 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 30.8 | -151.1 | 176.3 | 0 | 0 | 0 | 0 | 0 | 118.3 | I61 G65 Y142 | I61-G63 VanDerWaalsContact C-N 3.32Å; I61-G63 PolarHBondContact O-N 3.45Å; G63-G65 VanDerWaalsContact C-N 3.33Å; G63-Y142 VanDerWaalsContact C-CE1 3.5Å; G63-Y142 WeakPolarHBondContact CA-OH 3.44Å |
| 64 | S | 84 | Confident | 89.6 | Confident | 1 Ų | 1 | 8.7 Ų | 8.7 | 1% | 0.007 | 5% | 0.048 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -85.7 | -13.3 | 177 | 55.8 | 0 | 0 | 0 | 0 | 111.7 | I66 L67 S141 F401 | S64-I66 PolarHBondContact O-N 3.22Å; S64-L67 PolarHBondContact O-N 3.23Å; S64-S141 WeakPolarHBondContact OG-CB 3.39Å; S64-S141 PolarHBondContact OG-OG 2.86Å; S64-F401 WeakPolarHBondContact O-CZ 3.48Å; S64-F401 WeakPolarHBondContact OG-CE1 3.23Å |
| 65 | G | 83.8 | Confident | 89.3 | Confident | 1 Ų | 1 | 9.1 Ų | 9.1 | 1% | 0.01 | 5% | 0.049 | C | C | . | . | H | α-helix | trans | -58.8 | -32.9 | -177.3 | 0 | 0 | 0 | 0 | 0 | 112.3 | G63 L67 G68 L69 | G63-G65 VanDerWaalsContact C-N 3.33Å; G65-L67 PolarHBondContact O-N 3.17Å; G65-L67 VanDerWaalsContact O-N 3.16Å; G65-G68 PolarHBondContact O-N 3.16Å; G65-G68 VanDerWaalsContact O-N 3.08Å; G65-L69 WeakPolarHBondContact O-CG 3.33Å; G65-L69 PolarHBondContact O-N 3.15Å |
| 66 | I | 90.1 | Very high | 89.2 | Confident | 6 Ų | 6 | 4.6 Ų | 4.6 | 3% | 0.031 | 3% | 0.029 | C | C | . | . | H | α-helix | trans | -53.4 | -35.3 | 178.4 | -165.5 | 170 | 0 | 0 | 0 | 113.8 | S64 G68 L69 F208 Y305 T308 | S64-I66 PolarHBondContact O-N 3.22Å; I66-G68 VanDerWaalsContact C-N 3.33Å; I66-G68 PolarHBondContact O-N 3.43Å; I66-L69 PolarHBondContact O-N 2.96Å; I66-F208 HydrophobicContact CD1-CD1 4.39Å; I66-F208 HydrophobicContact CD1-CE1 4.26Å; I66-F208 HydrophobicContact CG1-CE1 4.34Å; I66-Y305 HydrophobicContact CB-CD1 4.16Å; I66-Y305 HydrophobicContact CB-CE1 3.84Å; I66-Y305 HydrophobicContact CD1-CD1 4.09Å; I66-Y305 HydrophobicContact CD1-CE1 4.23Å; I66-Y305 HydrophobicContact CG1-CD1 3.89Å; I66-Y305 HydrophobicContact CG1-CE1 4.06Å; I66-T308 HydrophobicContact CD1-CG2 4.18Å; I66-T308 HydrophobicContact CG1-CG2 3.96Å |
| 67 | L | 87.5 | Confident | 89.3 | Confident | 4 Ų | 4 | 4.4 Ų | 4.4 | 2% | 0.021 | 3% | 0.028 | C | C | . | . | H | α-helix | trans | -72.5 | -26.9 | -177.4 | -62.1 | -179.6 | 0 | 0 | 0 | 112.8 | S64 G65 I145 F208 V342 | S64-L67 PolarHBondContact O-N 3.23Å; G65-L67 PolarHBondContact O-N 3.17Å; G65-L67 VanDerWaalsContact O-N 3.16Å; L67-I145 HydrophobicContact CD1-CD1 3.45Å; L67-I145 VanDerWaalsContact CD1-CD1 3.45Å; L67-I145 HydrophobicContact CD1-CG1 3.79Å; L67-I145 HydrophobicContact CD1-CG2 4.24Å; L67-F208 HydrophobicContact CD2-CE1 3.94Å; L67-F208 HydrophobicContact CD2-CE2 4.41Å; L67-F208 HydrophobicContact CD2-CZ 3.68Å; L67-V342 HydrophobicContact CD1-CG1 4.33Å |
| 68 | G | 88.1 | Confident | 89.3 | Confident | 1 Ų | 1 | 5.3 Ų | 5.3 | 1% | 0.01 | 3% | 0.034 | C | C | . | . | H | α-helix | trans | -90 | -4.5 | 177.5 | 0 | 0 | 0 | 0 | 0 | 114.3 | G65 I66 Y71 A72 | G65-G68 PolarHBondContact O-N 3.16Å; G65-G68 VanDerWaalsContact O-N 3.08Å; I66-G68 VanDerWaalsContact C-N 3.33Å; I66-G68 PolarHBondContact O-N 3.43Å; G68-Y71 WeakPolarHBondContact O-CB 3.36Å; G68-Y71 PolarHBondContact O-N 2.91Å; G68-A72 PolarHBondContact O-N 3.3Å |
| 69 | L | 92.3 | Very high | 89.2 | Confident | 0 Ų | 0 | 10.3 Ų | 10.3 | 0% | 0 | 6% | 0.059 | C | C | . | . | H | α-helix | trans | -75.1 | -30.6 | -175.6 | -69.9 | -179 | 0 | 0 | 0 | 113.7 | G65 I66 A72 M73 F81 I264 M265 A268 Y305 A309 | G65-L69 WeakPolarHBondContact O-CG 3.33Å; G65-L69 PolarHBondContact O-N 3.15Å; I66-L69 PolarHBondContact O-N 2.96Å; L69-A72 WeakPolarHBondContact O-CB 3.08Å; L69-A72 PolarHBondContact O-N 3.29Å; L69-M73 PolarHBondContact O-N 2.78Å; L69-F81 HydrophobicContact CB-CZ 4.05Å; L69-F81 HydrophobicContact CD2-CE2 4.34Å; L69-F81 HydrophobicContact CD2-CZ 4.13Å; L69-F81 WeakPolarHBondContact O-CE2 3.28Å; L69-I264 HydrophobicContact CD2-CG2 4.25Å; L69-M265 HydrophobicContact CD2-CG 4.13Å; L69-A268 HydrophobicContact CD2-CB 4.26Å; L69-Y305 VanDerWaalsContact CD1-CB 3.45Å; L69-Y305 HydrophobicContact CD1-CD1 3.67Å; L69-Y305 HydrophobicContact CD1-CD2 3.77Å; L69-Y305 HydrophobicContact CD1-CE1 4.28Å; L69-Y305 HydrophobicContact CD1-CE2 4.38Å; L69-Y305 HydrophobicContact CD1-CG 3.35Å; L69-A309 HydrophobicContact CB-CB 3.89Å |
| 70 | A | 92.3 | Very high | 89.3 | Confident | 2 Ų | 2 | 13.3 Ų | 13.3 | 2% | 0.017 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -66.6 | -40.9 | 173.8 | 0 | 0 | 0 | 0 | 0 | 111 | M73 A74 V320 M324 | A70-M73 PolarHBondContact O-N 3.43Å; A70-A74 PolarHBondContact O-N 3.33Å; A70-V320 HydrophobicContact CB-CG1 3.91Å; A70-M324 HydrophobicContact CB-CB 4.47Å; A70-M324 HydrophobicContact CB-CG 4.45Å; A70-M324 HydrophobicContact CB-SD 3.69Å |
| 71 | Y | 90.6 | Very high | 89.5 | Confident | 9 Ų | 9 | 12.5 Ų | 12.5 | 4% | 0.035 | 7% | 0.065 | C | C | . | . | H | α-helix | trans | -58.9 | -48.9 | 172.2 | 173.9 | -95.8 | 0 | 0 | 0 | 111.3 | G68 M73 A74 H75 I264 V320 A322 Q398 | G68-Y71 WeakPolarHBondContact O-CB 3.36Å; G68-Y71 PolarHBondContact O-N 2.91Å; Y71-M73 VanDerWaalsContact C-N 3.29Å; Y71-M73 PolarHBondContact O-N 2.88Å; Y71-A74 WeakPolarHBondContact O-CB 3.32Å; Y71-A74 PolarHBondContact O-N 3.49Å; Y71-A74 VanDerWaalsContact O-N 3.1Å; Y71-H75 AromaticContact CD2-CD2 3.95Å; Y71-H75 AromaticContact CD2-NE2 3.82Å; Y71-H75 AromaticContact CE1-CD2 3.85Å; Y71-H75 AromaticContact CE2-CD2 3.52Å; Y71-H75 AromaticContact CE2-NE2 3.13Å; Y71-H75 WeakPolarHBondContact CE2-NE2 3.31Å; Y71-H75 AromaticContact CZ-CD2 3.44Å; Y71-H75 VanDerWaalsContact CZ-CD2 3.44Å; Y71-H75 AromaticContact CZ-NE2 3.37Å; Y71-H75 PolarHBondContact O-CD2 3.3Å; Y71-H75 PolarHBondContact O-N 2.99Å; Y71-H75 PolarHBondContact OH-NE2 3.41Å; Y71-I264 HydrophobicContact CD1-CD1 3.94Å; Y71-I264 HydrophobicContact CE1-CD1 4.26Å; Y71-V320 WeakPolarHBondContact CD2-O 3.49Å; Y71-A322 HydrophobicContact CD2-CB 4.36Å; Y71-A322 HydrophobicContact CG-CB 4.41Å; Y71-Q398 HydrophobicContact CE1-CG 4.5Å; Y71-Q398 PolarHBondContact OH-NE2 3.32Å; Y71-Q398 PolarHBondContact OH-OE1 3.15Å |
| 72 | A | 91.3 | Very high | 89.7 | Confident | 0 Ų | 0 | 15.1 Ų | 15.1 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -54.7 | -44.8 | 175.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | G68 L69 A74 H75 T76 F81 T261 | G68-A72 PolarHBondContact O-N 3.3Å; L69-A72 WeakPolarHBondContact O-CB 3.08Å; L69-A72 PolarHBondContact O-N 3.29Å; A72-A74 PolarHBondContact O-N 3.44Å; A72-H75 PolarHBondContact O-N 2.92Å; A72-T76 PolarHBondContact O-N 2.9Å; A72-T76 PolarHBondContact O-OG1 3.01Å; A72-F81 HydrophobicContact CB-CD2 4.23Å; A72-F81 HydrophobicContact CB-CE2 3.77Å; A72-T261 HydrophobicContact CB-CG2 3.57Å; A72-T261 PolarHBondContact O-OG1 3.16Å |
| 73 | M | 92.5 | Very high | 90 | Very high | 0 Ų | 0 | 17.7 Ų | 17.7 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -63.8 | -38 | 177.3 | -175.6 | 178 | -71.4 | 0 | 0 | 112.7 | L69 A70 Y71 H75 T76 G77 V78 F81 A309 Y313 | L69-M73 PolarHBondContact O-N 2.78Å; A70-M73 PolarHBondContact O-N 3.43Å; Y71-M73 VanDerWaalsContact C-N 3.29Å; Y71-M73 PolarHBondContact O-N 2.88Å; M73-H75 PolarHBondContact O-N 3.27Å; M73-T76 PolarHBondContact O-N 2.97Å; M73-G77 WeakPolarHBondContact O-CA 3.26Å; M73-G77 PolarHBondContact O-N 2.92Å; M73-V78 HydrophobicContact CG-CG2 4.45Å; M73-V78 HydrophobicContact SD-CB 4.49Å; M73-V78 HydrophobicContact SD-CG1 4.44Å; M73-V78 HydrophobicContact SD-CG2 4.05Å; M73-F81 HydrophobicContact CB-CB 4.23Å; M73-F81 HydrophobicContact CB-CD1 4.27Å; M73-F81 HydrophobicContact CB-CD2 3.83Å; M73-F81 HydrophobicContact CB-CE2 4.23Å; M73-F81 HydrophobicContact CB-CG 3.83Å; M73-F81 HydrophobicContact CE-CB 4.24Å; M73-F81 HydrophobicContact CE-CD1 3.14Å; M73-F81 HydrophobicContact CE-CE1 3.53Å; M73-F81 HydrophobicContact CE-CG 3.79Å; M73-F81 HydrophobicContact CE-CZ 4.47Å; M73-F81 HydrophobicContact CG-CB 4.01Å; M73-F81 HydrophobicContact CG-CD1 4.36Å; M73-F81 HydrophobicContact CG-CG 4.04Å; M73-A309 HydrophobicContact CE-CB 3.72Å; M73-Y313 HydrophobicContact CB-CG 4.46Å; M73-Y313 HydrophobicContact CG-CD1 4.14Å; M73-Y313 HydrophobicContact CG-CD2 4.48Å; M73-Y313 HydrophobicContact CG-CG 3.94Å; M73-Y313 VanDerWaalsContact SD-CB 3.56Å; M73-Y313 HydrophobicContact SD-CD1 3.8Å; M73-Y313 HydrophobicContact SD-CG 3.86Å |
| 74 | A | 89.2 | Confident | 90.7 | Very high | 8 Ų | 8 | 18.9 Ų | 18.9 | 7% | 0.066 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -59.5 | -34.2 | 179 | 0 | 0 | 0 | 0 | 0 | 113.1 | A70 Y71 A72 Y313 V320 | A70-A74 PolarHBondContact O-N 3.33Å; Y71-A74 WeakPolarHBondContact O-CB 3.32Å; Y71-A74 PolarHBondContact O-N 3.49Å; Y71-A74 VanDerWaalsContact O-N 3.1Å; A72-A74 PolarHBondContact O-N 3.44Å; A74-Y313 HydrophobicContact CB-CD2 3.79Å; A74-Y313 HydrophobicContact CB-CE2 3.96Å; A74-V320 HydrophobicContact CB-CB 4.05Å; A74-V320 HydrophobicContact CB-CG2 4.17Å |
| 75 | H | 88.3 | Confident | 91.2 | Very high | 26 Ų | 26 | 18.8 Ų | 18.8 | 12% | 0.12 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -94.9 | -8.8 | -178.5 | -66.5 | -72.3 | 0 | 0 | 0 | 115.1 | Y71 A72 M73 D255 Q257 | Y71-H75 AromaticContact CD2-CD2 3.95Å; Y71-H75 AromaticContact CD2-NE2 3.82Å; Y71-H75 AromaticContact CE1-CD2 3.85Å; Y71-H75 AromaticContact CE2-CD2 3.52Å; Y71-H75 AromaticContact CE2-NE2 3.13Å; Y71-H75 WeakPolarHBondContact CE2-NE2 3.31Å; Y71-H75 AromaticContact CZ-CD2 3.44Å; Y71-H75 VanDerWaalsContact CZ-CD2 3.44Å; Y71-H75 AromaticContact CZ-NE2 3.37Å; Y71-H75 PolarHBondContact O-CD2 3.3Å; Y71-H75 PolarHBondContact O-N 2.99Å; Y71-H75 PolarHBondContact OH-NE2 3.41Å; A72-H75 PolarHBondContact O-N 2.92Å; M73-H75 PolarHBondContact O-N 3.27Å; H75-D255 HydrophobicContact CB-CB 4.5Å; H75-D255 IonicContact CE1-OD2 3.76Å; H75-D255 PolarHBondContact CE1-OD2 2.99Å; H75-D255 IonicContact CG-OD2 2.85Å; H75-D255 IonicContact ND1-OD2 3.55Å; H75-D255 PolarHBondContact ND1-OD2 3.35Å; H75-Q257 HydrophobicContact CB-CB 4.27Å |
| 76 | T | 89.5 | Confident | 91.8 | Very high | 0 Ų | 0 | 22.6 Ų | 22.6 | 0% | 0 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -110.1 | -20.9 | 175.1 | 50.1 | 0 | 0 | 0 | 0 | 114.3 | A72 M73 F80 F81 L84 T253 M258 T261 | A72-T76 PolarHBondContact O-N 2.9Å; A72-T76 PolarHBondContact O-OG1 3.01Å; M73-T76 PolarHBondContact O-N 2.97Å; T76-F80 HydrophobicContact CG2-CD1 4.03Å; T76-F80 HydrophobicContact CG2-CE1 4.33Å; T76-F81 WeakPolarHBondContact OG1-CB 3.09Å; T76-L84 HydrophobicContact CG2-CD1 4.44Å; T76-T253 CarbonylContact C-O 3.23Å; T76-T253 WeakPolarHBondContact CA-O 3.43Å; T76-T253 PolarHBondContact O-N 3.41Å; T76-M258 HydrophobicContact CG2-CG 3.99Å; T76-T261 HydrophobicContact CG2-CG2 3.36Å |
| 77 | G | 90.6 | Very high | 92.1 | Very high | 0 Ų | 0 | 25.1 Ų | 25.1 | 0% | 0 | 14% | 0.142 | C | C | . | . | trans | 79.2 | 160.7 | -166.9 | 0 | 0 | 0 | 0 | 0 | 113 | M73 F81 Q250 | M73-G77 WeakPolarHBondContact O-CA 3.26Å; M73-G77 PolarHBondContact O-N 2.92Å; G77-F81 WeakPolarHBondContact O-CB 3.42Å; G77-F81 PolarHBondContact O-N 3.46Å; G77-Q250 CarbonylContact C-O 3.58Å; G77-Q250 WeakPolarHBondContact CA-O 3.38Å | ||
| 78 | V | 91.8 | Very high | 92.5 | Very high | 20 Ų | 20 | 25.5 Ų | 25.5 | 12% | 0.121 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -64.9 | -48.2 | -167.8 | -178.2 | 0 | 0 | 0 | 0 | 112.9 | M73 L82 Q250 M251 Y313 | M73-V78 HydrophobicContact CG-CG2 4.45Å; M73-V78 HydrophobicContact SD-CB 4.49Å; M73-V78 HydrophobicContact SD-CG1 4.44Å; M73-V78 HydrophobicContact SD-CG2 4.05Å; V78-L82 HydrophobicContact CG1-CD1 4.12Å; V78-L82 WeakPolarHBondContact O-CG 3.28Å; V78-L82 PolarHBondContact O-N 2.87Å; V78-L82 VanDerWaalsContact O-N 3.07Å; V78-Q250 PolarHBondContact N-O 2.93Å; V78-M251 HydrophobicContact CB-SD 4.38Å; V78-M251 PolarHBondContact N-O 3.46Å; V78-Y313 HydrophobicContact CG2-CD1 3.74Å; V78-Y313 HydrophobicContact CG2-CE1 3.54Å |
| 79 | I | 92.5 | Very high | 92.8 | Very high | 109 Ų | 109 | 25.8 Ų | 25.8 | 56% | 0.559 | 15% | 0.146 | S | C | * | . | H | α-helix | trans | -68.5 | -47.2 | -174 | -61.4 | -179 | 0 | 0 | 0 | 110 | L82 A83 M251 | I79-L82 PolarHBondContact O-N 2.91Å; I79-A83 WeakPolarHBondContact O-CB 3.17Å; I79-A83 PolarHBondContact O-N 3.26Å; I79-M251 HydrophobicContact CD1-CB 3.89Å; I79-M251 HydrophobicContact CD1-CG 4.26Å; I79-M251 HydrophobicContact CD1-SD 4.15Å; I79-M251 HydrophobicContact CG1-CB 4.14Å; I79-M251 HydrophobicContact CG1-SD 4.04Å; I79-M251 PolarHBondContact N-O 2.99Å; I79-M251 VanDerWaalsContact N-O 3.16Å |
| 80 | F | 91.7 | Very high | 93 | Very high | 63 Ų | 63 | 31.1 Ų | 31.1 | 28% | 0.276 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -66.3 | -39.8 | -179.2 | -170.9 | -128.5 | 0 | 0 | 0 | 111.6 | T76 A83 L84 F252 M258 | T76-F80 HydrophobicContact CG2-CD1 4.03Å; T76-F80 HydrophobicContact CG2-CE1 4.33Å; F80-A83 PolarHBondContact O-N 2.98Å; F80-L84 HydrophobicContact CD1-CD1 3.87Å; F80-L84 HydrophobicContact CD2-CG 4.32Å; F80-L84 HydrophobicContact CE1-CD1 3.5Å; F80-L84 HydrophobicContact CE1-CG 4.24Å; F80-L84 HydrophobicContact CE2-CD1 4.2Å; F80-L84 HydrophobicContact CE2-CD2 4.21Å; F80-L84 HydrophobicContact CE2-CG 4.03Å; F80-L84 HydrophobicContact CG-CD1 4.34Å; F80-L84 HydrophobicContact CZ-CD1 3.69Å; F80-L84 HydrophobicContact CZ-CD2 4.1Å; F80-L84 HydrophobicContact CZ-CG 3.98Å; F80-L84 WeakPolarHBondContact O-CB 3.25Å; F80-L84 WeakPolarHBondContact O-CG 3.41Å; F80-L84 PolarHBondContact O-N 3.47Å; F80-F252 HydrophobicContact CB-CD2 3.95Å; F80-F252 HydrophobicContact CB-CE2 4.24Å; F80-F252 HydrophobicContact CD1-CE2 4.39Å; F80-F252 HydrophobicContact CD2-CE2 4.2Å; F80-F252 HydrophobicContact CG-CD2 4.27Å; F80-F252 HydrophobicContact CG-CE2 4.04Å; F80-M258 HydrophobicContact CE1-SD 4.03Å |
| 81 | F | 94.4 | Very high | 93.2 | Very high | 0 Ų | 0 | 32.9 Ų | 32.9 | 0% | 0 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -57 | -52.2 | 173.1 | 179.8 | -91.6 | 0 | 0 | 0 | 112.1 | L69 A72 M73 T76 G77 A83 L84 L85 M265 A309 | L69-F81 HydrophobicContact CB-CZ 4.05Å; L69-F81 HydrophobicContact CD2-CE2 4.34Å; L69-F81 HydrophobicContact CD2-CZ 4.13Å; L69-F81 WeakPolarHBondContact O-CE2 3.28Å; A72-F81 HydrophobicContact CB-CD2 4.23Å; A72-F81 HydrophobicContact CB-CE2 3.77Å; M73-F81 HydrophobicContact CB-CB 4.23Å; M73-F81 HydrophobicContact CB-CD1 4.27Å; M73-F81 HydrophobicContact CB-CD2 3.83Å; M73-F81 HydrophobicContact CB-CE2 4.23Å; M73-F81 HydrophobicContact CB-CG 3.83Å; M73-F81 HydrophobicContact CE-CB 4.24Å; M73-F81 HydrophobicContact CE-CD1 3.14Å; M73-F81 HydrophobicContact CE-CE1 3.53Å; M73-F81 HydrophobicContact CE-CG 3.79Å; M73-F81 HydrophobicContact CE-CZ 4.47Å; M73-F81 HydrophobicContact CG-CB 4.01Å; M73-F81 HydrophobicContact CG-CD1 4.36Å; M73-F81 HydrophobicContact CG-CG 4.04Å; T76-F81 WeakPolarHBondContact OG1-CB 3.09Å; G77-F81 WeakPolarHBondContact O-CB 3.42Å; G77-F81 PolarHBondContact O-N 3.46Å; F81-A83 VanDerWaalsContact C-N 3.3Å; F81-A83 PolarHBondContact O-N 2.81Å; F81-L84 PolarHBondContact O-N 3.48Å; F81-L85 HydrophobicContact CE1-CB 4.38Å; F81-L85 HydrophobicContact CE1-CD1 4.22Å; F81-L85 HydrophobicContact CE1-CD2 4.02Å; F81-L85 HydrophobicContact CE1-CG 4.46Å; F81-L85 HydrophobicContact CZ-CD1 4Å; F81-L85 VanDerWaalsContact O-CB 3.32Å; F81-L85 WeakPolarHBondContact O-CB 3.28Å; F81-L85 PolarHBondContact O-N 3.12Å; F81-M265 HydrophobicContact CD2-CE 3.89Å; F81-M265 HydrophobicContact CD2-SD 4Å; F81-M265 HydrophobicContact CE2-CE 3.78Å; F81-M265 HydrophobicContact CE2-CG 4.14Å; F81-M265 HydrophobicContact CE2-SD 3.95Å; F81-M265 HydrophobicContact CG-CE 4.39Å; F81-M265 HydrophobicContact CZ-CE 4.2Å; F81-M265 WeakPolarHBondContact O-CE 3.21Å; F81-A309 HydrophobicContact CE1-CB 3.6Å; F81-A309 HydrophobicContact CZ-CB 3.66Å |
| 82 | L | 95.6 | Very high | 93.4 | Very high | 60 Ų | 60 | 32.5 Ų | 32.5 | 31% | 0.314 | 18% | 0.181 | S | C | . | . | H | α-helix | trans | -63.6 | -37.5 | -178 | -70.6 | 173.9 | 0 | 0 | 0 | 111.9 | V78 I79 L85 L86 | V78-L82 HydrophobicContact CG1-CD1 4.12Å; V78-L82 WeakPolarHBondContact O-CG 3.28Å; V78-L82 PolarHBondContact O-N 2.87Å; V78-L82 VanDerWaalsContact O-N 3.07Å; I79-L82 PolarHBondContact O-N 2.91Å; L82-L85 PolarHBondContact O-N 3.07Å; L82-L86 WeakPolarHBondContact O-CB 3.35Å; L82-L86 PolarHBondContact O-N 3.34Å |
| 83 | A | 94.9 | Very high | 93.6 | Very high | 55 Ų | 55 | 33.8 Ų | 33.8 | 46% | 0.455 | 19% | 0.19 | S | C | . | . | H | α-helix | trans | -64 | -45.4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | I79 F80 F81 L86 C87 | I79-A83 WeakPolarHBondContact O-CB 3.17Å; I79-A83 PolarHBondContact O-N 3.26Å; F80-A83 PolarHBondContact O-N 2.98Å; F81-A83 VanDerWaalsContact C-N 3.3Å; F81-A83 PolarHBondContact O-N 2.81Å; A83-L86 PolarHBondContact O-N 2.87Å; A83-C87 WeakPolarHBondContact O-CB 3.18Å; A83-C87 PolarHBondContact O-N 3.31Å |
| 84 | L | 93.6 | Very high | 93.8 | Very high | 31 Ų | 31 | 36.9 Ų | 36.9 | 16% | 0.162 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -64.3 | -40.5 | 175.6 | -75.2 | 177.2 | 0 | 0 | 0 | 112 | T76 F80 F81 L86 C87 I88 V262 M265 | T76-L84 HydrophobicContact CG2-CD1 4.44Å; F80-L84 HydrophobicContact CD1-CD1 3.87Å; F80-L84 HydrophobicContact CD2-CG 4.32Å; F80-L84 HydrophobicContact CE1-CD1 3.5Å; F80-L84 HydrophobicContact CE1-CG 4.24Å; F80-L84 HydrophobicContact CE2-CD1 4.2Å; F80-L84 HydrophobicContact CE2-CD2 4.21Å; F80-L84 HydrophobicContact CE2-CG 4.03Å; F80-L84 HydrophobicContact CG-CD1 4.34Å; F80-L84 HydrophobicContact CZ-CD1 3.69Å; F80-L84 HydrophobicContact CZ-CD2 4.1Å; F80-L84 HydrophobicContact CZ-CG 3.98Å; F80-L84 WeakPolarHBondContact O-CB 3.25Å; F80-L84 WeakPolarHBondContact O-CG 3.41Å; F80-L84 PolarHBondContact O-N 3.47Å; F81-L84 PolarHBondContact O-N 3.48Å; L84-L86 VanDerWaalsContact C-N 3.35Å; L84-C87 WeakPolarHBondContact O-CB 3.37Å; L84-C87 PolarHBondContact O-N 3.41Å; L84-I88 WeakPolarHBondContact O-CG1 3.35Å; L84-I88 PolarHBondContact O-N 3.14Å; L84-V262 HydrophobicContact CD1-CG2 4.4Å; L84-M265 HydrophobicContact CB-CE 3.67Å; L84-M265 HydrophobicContact CB-SD 4.08Å; L84-M265 HydrophobicContact CD1-SD 4.46Å |
| 85 | L | 95.6 | Very high | 94.1 | Very high | 0 Ų | 0 | 36.5 Ų | 36.5 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -62.9 | -44.9 | 179.2 | -165.3 | 79.7 | 0 | 0 | 0 | 110.3 | F81 L82 A89 M265 F269 F302 | F81-L85 HydrophobicContact CE1-CB 4.38Å; F81-L85 HydrophobicContact CE1-CD1 4.22Å; F81-L85 HydrophobicContact CE1-CD2 4.02Å; F81-L85 HydrophobicContact CE1-CG 4.46Å; F81-L85 HydrophobicContact CZ-CD1 4Å; F81-L85 VanDerWaalsContact O-CB 3.32Å; F81-L85 WeakPolarHBondContact O-CB 3.28Å; F81-L85 PolarHBondContact O-N 3.12Å; L82-L85 PolarHBondContact O-N 3.07Å; L85-A89 VanDerWaalsContact O-CB 3.29Å; L85-A89 WeakPolarHBondContact O-CB 3.23Å; L85-A89 PolarHBondContact O-N 3.14Å; L85-M265 HydrophobicContact CB-CE 3.55Å; L85-M265 HydrophobicContact CD1-CE 3.68Å; L85-M265 HydrophobicContact CG-CE 4.26Å; L85-F269 HydrophobicContact CD1-CE2 3.55Å; L85-F269 HydrophobicContact CD1-CZ 4.25Å; L85-F269 HydrophobicContact CG-CE2 3.9Å; L85-F269 HydrophobicContact CG-CZ 4.27Å; L85-F302 HydrophobicContact CB-CD2 4.45Å; L85-F302 HydrophobicContact CB-CE2 4.18Å; L85-F302 HydrophobicContact CD2-CD2 3.76Å; L85-F302 HydrophobicContact CD2-CE2 3.87Å; L85-F302 HydrophobicContact CG-CD2 3.93Å; L85-F302 HydrophobicContact CG-CE2 4.11Å |
| 86 | L | 96.7 | Very high | 94.4 | Very high | 80 Ų | 80 | 35.3 Ų | 35.3 | 42% | 0.419 | 19% | 0.194 | S | C | . | . | H | α-helix | trans | -64.1 | -44 | 175.6 | -179.5 | 62.1 | 0 | 0 | 0 | 111.1 | L82 A83 L84 A89 L90 F302 | L82-L86 WeakPolarHBondContact O-CB 3.35Å; L82-L86 PolarHBondContact O-N 3.34Å; A83-L86 PolarHBondContact O-N 2.87Å; L84-L86 VanDerWaalsContact C-N 3.35Å; L86-A89 PolarHBondContact O-N 2.99Å; L86-L90 HydrophobicContact CD1-CD1 4.21Å; L86-L90 HydrophobicContact CD1-CG 4.19Å; L86-L90 HydrophobicContact CG-CD1 4.07Å; L86-L90 HydrophobicContact CG-CG 4.45Å; L86-L90 VanDerWaalsContact O-CG 3.28Å; L86-L90 WeakPolarHBondContact O-CG 3.38Å; L86-L90 PolarHBondContact O-N 3.44Å; L86-F302 HydrophobicContact CB-CE2 3.76Å; L86-F302 HydrophobicContact CB-CZ 4.14Å; L86-F302 HydrophobicContact CD1-CE2 4.15Å; L86-F302 HydrophobicContact CD1-CZ 4.1Å |
| 87 | C | 95.6 | Very high | 94.7 | Very high | 60 Ų | 60 | 38.9 Ų | 38.9 | 41% | 0.405 | 21% | 0.21 | S | C | . | . | H | α-helix | trans | -57.7 | -52.6 | 177.8 | -172.6 | 0 | 0 | 0 | 0 | 111.3 | A83 L84 A89 L90 L91 | A83-C87 WeakPolarHBondContact O-CB 3.18Å; A83-C87 PolarHBondContact O-N 3.31Å; L84-C87 WeakPolarHBondContact O-CB 3.37Å; L84-C87 PolarHBondContact O-N 3.41Å; C87-A89 VanDerWaalsContact C-N 3.34Å; C87-A89 PolarHBondContact O-N 3.08Å; C87-L90 PolarHBondContact O-N 3.37Å; C87-L91 WeakPolarHBondContact O-CB 3.17Å; C87-L91 WeakPolarHBondContact O-CD1 3.46Å; C87-L91 WeakPolarHBondContact O-CG 3.41Å; C87-L91 PolarHBondContact O-N 2.94Å; C87-L91 VanDerWaalsContact SG-CD1 3.53Å |
| 88 | I | 94.8 | Very high | 94.8 | Very high | 12 Ų | 12 | 39 Ų | 39 | 6% | 0.062 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -63 | -39.5 | 179.1 | -67.1 | 169.5 | 0 | 0 | 0 | 111.3 | L84 L91 S92 V262 M265 F269 | L84-I88 WeakPolarHBondContact O-CG1 3.35Å; L84-I88 PolarHBondContact O-N 3.14Å; I88-L91 PolarHBondContact O-N 3.19Å; I88-S92 VanDerWaalsContact O-CB 3.28Å; I88-S92 WeakPolarHBondContact O-CB 3.32Å; I88-S92 PolarHBondContact O-N 3.31Å; I88-V262 HydrophobicContact CD1-CG1 4.35Å; I88-M265 HydrophobicContact CD1-CB 3.54Å; I88-F269 HydrophobicContact CB-CD2 4.41Å; I88-F269 HydrophobicContact CG2-CB 3.88Å; I88-F269 HydrophobicContact CG2-CD2 3.73Å; I88-F269 HydrophobicContact CG2-CG 4.12Å |
| 89 | A | 96.1 | Very high | 94.9 | Very high | 6 Ų | 6 | 38 Ų | 38 | 5% | 0.05 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -61.5 | -45.3 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | L85 L86 C87 S92 S93 F269 I298 F302 | L85-A89 VanDerWaalsContact O-CB 3.29Å; L85-A89 WeakPolarHBondContact O-CB 3.23Å; L85-A89 PolarHBondContact O-N 3.14Å; L86-A89 PolarHBondContact O-N 2.99Å; C87-A89 VanDerWaalsContact C-N 3.34Å; C87-A89 PolarHBondContact O-N 3.08Å; A89-S92 PolarHBondContact O-N 2.92Å; A89-S93 PolarHBondContact O-N 2.66Å; A89-F269 HydrophobicContact CB-CD1 4.5Å; A89-F269 HydrophobicContact CB-CE1 3.93Å; A89-F269 HydrophobicContact CB-CE2 4.36Å; A89-F269 HydrophobicContact CB-CZ 3.85Å; A89-I298 HydrophobicContact CB-CG2 3.85Å; A89-F302 HydrophobicContact CB-CD2 4.33Å |
| 90 | L | 96.4 | Very high | 94.9 | Very high | 112 Ų | 112 | 32.9 Ų | 32.9 | 59% | 0.586 | 18% | 0.179 | S | C | * | . | H | α-helix | trans | -65.2 | -43.4 | 177 | -68.5 | 174.2 | 0 | 0 | 0 | 111.7 | L86 C87 S92 S93 Y94 | L86-L90 HydrophobicContact CD1-CD1 4.21Å; L86-L90 HydrophobicContact CD1-CG 4.19Å; L86-L90 HydrophobicContact CG-CD1 4.07Å; L86-L90 HydrophobicContact CG-CG 4.45Å; L86-L90 VanDerWaalsContact O-CG 3.28Å; L86-L90 WeakPolarHBondContact O-CG 3.38Å; L86-L90 PolarHBondContact O-N 3.44Å; C87-L90 PolarHBondContact O-N 3.37Å; L90-S92 VanDerWaalsContact C-N 3.34Å; L90-S92 PolarHBondContact O-N 3.47Å; L90-S93 PolarHBondContact O-N 2.9Å; L90-Y94 PolarHBondContact O-N 3.33Å |
| 91 | L | 95.3 | Very high | 94.8 | Very high | 40 Ų | 40 | 30.9 Ų | 30.9 | 21% | 0.209 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -63.3 | -39.6 | 177.1 | -68.6 | 166.1 | 0 | 0 | 0 | 111.5 | C87 I88 Y94 S95 F414 F443 | C87-L91 WeakPolarHBondContact O-CB 3.17Å; C87-L91 WeakPolarHBondContact O-CD1 3.46Å; C87-L91 WeakPolarHBondContact O-CG 3.41Å; C87-L91 PolarHBondContact O-N 2.94Å; C87-L91 VanDerWaalsContact SG-CD1 3.53Å; I88-L91 PolarHBondContact O-N 3.19Å; L91-Y94 PolarHBondContact O-N 3.41Å; L91-S95 WeakPolarHBondContact O-CB 3.29Å; L91-S95 PolarHBondContact O-N 3.07Å; L91-F414 HydrophobicContact CB-CE1 4.13Å; L91-F414 HydrophobicContact CB-CZ 4.38Å; L91-F414 HydrophobicContact CD1-CE1 3.94Å; L91-F414 HydrophobicContact CD1-CZ 4.19Å; L91-F414 HydrophobicContact CG-CE1 4.41Å; L91-F443 HydrophobicContact CB-CE2 3.94Å; L91-F443 HydrophobicContact CB-CZ 4.41Å; L91-F443 HydrophobicContact CD2-CD2 4Å; L91-F443 HydrophobicContact CD2-CE2 3.57Å; L91-F443 HydrophobicContact CG-CE2 4.28Å; L91-F443 WeakPolarHBondContact O-CZ 3.48Å |
| 92 | S | 95.3 | Very high | 94.6 | Very high | 0 Ų | 0 | 30.9 Ų | 30.9 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -64.5 | -43.7 | 174.4 | -171.8 | 0 | 0 | 0 | 0 | 111.8 | I88 A89 L90 Y94 S95 I96 F269 H272 | I88-S92 VanDerWaalsContact O-CB 3.28Å; I88-S92 WeakPolarHBondContact O-CB 3.32Å; I88-S92 PolarHBondContact O-N 3.31Å; A89-S92 PolarHBondContact O-N 2.92Å; L90-S92 VanDerWaalsContact C-N 3.34Å; L90-S92 PolarHBondContact O-N 3.47Å; S92-Y94 PolarHBondContact O-N 2.7Å; S92-S95 WeakPolarHBondContact O-CB 3.29Å; S92-S95 PolarHBondContact O-N 3.43Å; S92-I96 WeakPolarHBondContact O-CG1 3.21Å; S92-I96 PolarHBondContact O-N 3.14Å; S92-F269 PolarHBondContact OG-O 2.99Å; S92-H272 PolarHBondContact OG-CE1 3.49Å |
| 93 | S | 95.5 | Very high | 94.3 | Very high | 27 Ų | 27 | 28.1 Ų | 28.1 | 19% | 0.189 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -61.3 | -43.3 | 175.1 | 175 | 0 | 0 | 0 | 0 | 112.4 | A89 L90 I96 H97 Q291 N295 | A89-S93 PolarHBondContact O-N 2.66Å; L90-S93 PolarHBondContact O-N 2.9Å; S93-I96 PolarHBondContact O-N 3.32Å; S93-H97 PolarHBondContact O-N 2.85Å; S93-H97 VanDerWaalsContact O-N 3.11Å; S93-Q291 PolarHBondContact O-NE2 3.49Å; S93-N295 PolarHBondContact OG-OD1 3.33Å |
| 94 | Y | 95.6 | Very high | 93.8 | Very high | 66 Ų | 66 | 28 Ų | 28 | 26% | 0.259 | 16% | 0.161 | S | C | . | . | H | α-helix | trans | -63.4 | -43.2 | 175.7 | 175.8 | -108.7 | 0 | 0 | 0 | 112.3 | L90 L91 S92 I96 H97 L98 F443 | L90-Y94 PolarHBondContact O-N 3.33Å; L91-Y94 PolarHBondContact O-N 3.41Å; S92-Y94 PolarHBondContact O-N 2.7Å; Y94-I96 VanDerWaalsContact C-N 3.34Å; Y94-I96 PolarHBondContact O-N 3.37Å; Y94-H97 WeakPolarHBondContact O-CA 3.17Å; Y94-H97 VanDerWaalsContact O-CB 3.31Å; Y94-H97 WeakPolarHBondContact O-CB 3.34Å; Y94-H97 PolarHBondContact O-N 3.46Å; Y94-H97 VanDerWaalsContact O-N 3.1Å; Y94-L98 HydrophobicContact CD1-CD1 4.18Å; Y94-L98 HydrophobicContact CE1-CD1 3.61Å; Y94-L98 HydrophobicContact CE1-CD2 4.44Å; Y94-L98 HydrophobicContact CE1-CG 4.08Å; Y94-L98 HydrophobicContact CE2-CD2 4.39Å; Y94-L98 PolarHBondContact O-N 2.88Å; Y94-F443 HydrophobicContact CD1-CD1 4.17Å; Y94-F443 HydrophobicContact CD1-CD2 4.27Å; Y94-F443 HydrophobicContact CD1-CE1 4.2Å; Y94-F443 HydrophobicContact CD1-CE2 4.27Å; Y94-F443 HydrophobicContact CD1-CG 4.24Å; Y94-F443 HydrophobicContact CD1-CZ 4.26Å; Y94-F443 HydrophobicContact CE1-CB 4.36Å; Y94-F443 HydrophobicContact CE1-CD1 4.09Å; Y94-F443 HydrophobicContact CE1-CD2 4.44Å; Y94-F443 HydrophobicContact CE1-CG 4.06Å |
| 95 | S | 96 | Very high | 93.4 | Very high | 0 Ų | 0 | 30.7 Ų | 30.7 | 0% | 0 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -57.8 | -45.1 | 174.7 | 169.4 | 0 | 0 | 0 | 0 | 112.6 | L91 S92 H97 L98 L99 H272 I413 P417 | L91-S95 WeakPolarHBondContact O-CB 3.29Å; L91-S95 PolarHBondContact O-N 3.07Å; S92-S95 WeakPolarHBondContact O-CB 3.29Å; S92-S95 PolarHBondContact O-N 3.43Å; S95-H97 PolarHBondContact O-N 3.48Å; S95-L98 WeakPolarHBondContact O-CB 3.29Å; S95-L98 PolarHBondContact O-N 3.06Å; S95-L98 VanDerWaalsContact O-N 3.12Å; S95-L99 PolarHBondContact O-N 3.4Å; S95-H272 VanDerWaalsContact CB-NE2 3.29Å; S95-H272 WeakPolarHBondContact CB-NE2 3.37Å; S95-H272 PolarHBondContact OG-CD2 3.46Å; S95-H272 PolarHBondContact OG-NE2 3.42Å; S95-I413 WeakPolarHBondContact CB-O 3.4Å; S95-I413 PolarHBondContact OG-O 2.89Å; S95-P417 WeakPolarHBondContact OG-CG 3.49Å |
| 96 | I | 95.6 | Very high | 92.9 | Very high | 0 Ų | 0 | 32.6 Ų | 32.6 | 0% | 0 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -60.5 | -38.5 | 175.8 | -68.5 | 173.1 | 0 | 0 | 0 | 110.7 | S92 S93 Y94 L98 L99 L100 V275 A294 I298 | S92-I96 WeakPolarHBondContact O-CG1 3.21Å; S92-I96 PolarHBondContact O-N 3.14Å; S93-I96 PolarHBondContact O-N 3.32Å; Y94-I96 VanDerWaalsContact C-N 3.34Å; Y94-I96 PolarHBondContact O-N 3.37Å; I96-L98 PolarHBondContact O-N 3.47Å; I96-L99 PolarHBondContact O-N 3.05Å; I96-L100 HydrophobicContact CG2-CD1 3.8Å; I96-L100 HydrophobicContact CG2-CG 4.07Å; I96-L100 WeakPolarHBondContact O-CB 3.49Å; I96-L100 WeakPolarHBondContact O-CG 3.39Å; I96-L100 PolarHBondContact O-N 3.46Å; I96-V275 HydrophobicContact CD1-CG2 4.01Å; I96-V275 HydrophobicContact CG1-CG2 4.15Å; I96-V275 HydrophobicContact CG2-CG1 4.1Å; I96-V275 HydrophobicContact CG2-CG2 4.49Å; I96-A294 HydrophobicContact CD1-CB 3.87Å; I96-A294 HydrophobicContact CG2-CB 3.78Å; I96-I298 HydrophobicContact CD1-CD1 3.76Å |
| 97 | H | 94.5 | Very high | 92 | Very high | 75 Ų | 75 | 31.6 Ų | 31.6 | 35% | 0.347 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -61 | -44.3 | 174.5 | 175.7 | -92.5 | 0 | 0 | 0 | 112.2 | S93 Y94 S95 T101 K287 | S93-H97 PolarHBondContact O-N 2.85Å; S93-H97 VanDerWaalsContact O-N 3.11Å; Y94-H97 WeakPolarHBondContact O-CA 3.17Å; Y94-H97 VanDerWaalsContact O-CB 3.31Å; Y94-H97 WeakPolarHBondContact O-CB 3.34Å; Y94-H97 PolarHBondContact O-N 3.46Å; Y94-H97 VanDerWaalsContact O-N 3.1Å; S95-H97 PolarHBondContact O-N 3.48Å; H97-T101 WeakPolarHBondContact O-CB 3.43Å; H97-T101 PolarHBondContact O-N 2.91Å; H97-T101 PolarHBondContact O-OG1 3.32Å; H97-K287 PolarHBondContact NE2-NZ 2.89Å |
| 98 | L | 93.4 | Very high | 91.3 | Very high | 3 Ų | 3 | 30.3 Ų | 30.3 | 2% | 0.016 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -60.4 | -46.9 | 174.5 | -65 | 178.6 | 0 | 0 | 0 | 111.2 | Y94 S95 I96 T101 C102 P417 Y421 F443 | Y94-L98 HydrophobicContact CD1-CD1 4.18Å; Y94-L98 HydrophobicContact CE1-CD1 3.61Å; Y94-L98 HydrophobicContact CE1-CD2 4.44Å; Y94-L98 HydrophobicContact CE1-CG 4.08Å; Y94-L98 HydrophobicContact CE2-CD2 4.39Å; Y94-L98 PolarHBondContact O-N 2.88Å; S95-L98 WeakPolarHBondContact O-CB 3.29Å; S95-L98 PolarHBondContact O-N 3.06Å; S95-L98 VanDerWaalsContact O-N 3.12Å; I96-L98 PolarHBondContact O-N 3.47Å; L98-T101 WeakPolarHBondContact O-CB 3.47Å; L98-T101 PolarHBondContact O-N 2.9Å; L98-C102 PolarHBondContact O-N 2.86Å; L98-C102 PolarHBondContact O-SG 2.83Å; L98-P417 HydrophobicContact CB-CB 4.3Å; L98-Y421 HydrophobicContact CB-CD2 4.35Å; L98-Y421 HydrophobicContact CD2-CD1 4.35Å; L98-Y421 HydrophobicContact CD2-CD2 3.49Å; L98-Y421 VanDerWaalsContact CD2-CD2 3.49Å; L98-Y421 HydrophobicContact CD2-CE2 3.79Å; L98-Y421 HydrophobicContact CD2-CG 3.79Å; L98-F443 HydrophobicContact CD1-CD1 4.02Å; L98-F443 HydrophobicContact CD1-CE1 4.39Å |
| 99 | L | 93.6 | Very high | 90.4 | Very high | 0 Ų | 0 | 32.2 Ų | 32.2 | 0% | 0 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -60.3 | -48.4 | 179.7 | -177 | 68.3 | 0 | 0 | 0 | 112 | S95 I96 T101 C102 A103 Y111 L114 V275 L276 F420 | S95-L99 PolarHBondContact O-N 3.4Å; I96-L99 PolarHBondContact O-N 3.05Å; L99-T101 VanDerWaalsContact C-N 3.29Å; L99-T101 PolarHBondContact O-N 3.42Å; L99-C102 PolarHBondContact O-N 2.72Å; L99-A103 WeakPolarHBondContact O-CB 3.39Å; L99-A103 PolarHBondContact O-N 2.94Å; L99-Y111 HydrophobicContact CD1-CD2 4.09Å; L99-Y111 HydrophobicContact CD1-CE2 3.66Å; L99-Y111 HydrophobicContact CD2-CD2 3.97Å; L99-Y111 HydrophobicContact CD2-CE2 3.56Å; L99-Y111 HydrophobicContact CG-CE2 4.27Å; L99-L114 HydrophobicContact CD1-CD2 3.7Å; L99-V275 HydrophobicContact CD2-CB 4.46Å; L99-V275 HydrophobicContact CD2-CG1 4.49Å; L99-L276 HydrophobicContact CD1-CD1 4.46Å; L99-L276 HydrophobicContact CD2-CG 4.38Å; L99-F420 HydrophobicContact CD1-CD2 4.44Å |
| 100 | L | 92.3 | Very high | 89.8 | Confident | 1 Ų | 1 | 32 Ų | 32 | 1% | 0.005 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -66.1 | -32.1 | 178.7 | -70.7 | 178.5 | 0 | 0 | 0 | 112.1 | I96 G104 V275 L276 Y279 K287 M290 Q291 | I96-L100 HydrophobicContact CG2-CD1 3.8Å; I96-L100 HydrophobicContact CG2-CG 4.07Å; I96-L100 WeakPolarHBondContact O-CB 3.49Å; I96-L100 WeakPolarHBondContact O-CG 3.39Å; I96-L100 PolarHBondContact O-N 3.46Å; L100-G104 PolarHBondContact O-N 2.99Å; L100-V275 HydrophobicContact CD2-CG1 3.9Å; L100-V275 HydrophobicContact CG-CG1 4.35Å; L100-L276 HydrophobicContact CD2-CD2 4.3Å; L100-Y279 HydrophobicContact CD2-CD1 3.86Å; L100-Y279 HydrophobicContact CD2-CE1 4.17Å; L100-K287 HydrophobicContact CB-CG 4.22Å; L100-M290 HydrophobicContact CD1-CB 4.09Å; L100-M290 HydrophobicContact CD1-CG 4Å; L100-M290 HydrophobicContact CD2-CB 4.37Å; L100-M290 HydrophobicContact CD2-CG 3.87Å; L100-Q291 HydrophobicContact CD1-CB 4.22Å |
| 101 | T | 90.4 | Very high | 89.4 | Confident | 20 Ų | 20 | 26.8 Ų | 26.8 | 12% | 0.123 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -64.2 | -48.3 | 173.4 | -55 | 0 | 0 | 0 | 0 | 110.9 | H97 L98 L99 A103 G104 I105 K287 Y421 | H97-T101 WeakPolarHBondContact O-CB 3.43Å; H97-T101 PolarHBondContact O-N 2.91Å; H97-T101 PolarHBondContact O-OG1 3.32Å; L98-T101 WeakPolarHBondContact O-CB 3.47Å; L98-T101 PolarHBondContact O-N 2.9Å; L99-T101 VanDerWaalsContact C-N 3.29Å; L99-T101 PolarHBondContact O-N 3.42Å; T101-A103 PolarHBondContact O-N 3.31Å; T101-G104 PolarHBondContact O-N 2.84Å; T101-I105 HydrophobicContact CG2-CD1 4.09Å; T101-I105 WeakPolarHBondContact O-CG1 3.47Å; T101-I105 PolarHBondContact O-N 3.37Å; T101-I105 VanDerWaalsContact O-N 3.09Å; T101-K287 VanDerWaalsContact OG1-CE 3.27Å; T101-K287 WeakPolarHBondContact OG1-CE 3.46Å; T101-K287 PolarHBondContact OG1-NZ 3.22Å; T101-Y421 HydrophobicContact CG2-CE2 4.03Å |
| 102 | C | 90.1 | Very high | 89 | Confident | 0 Ų | 0 | 25.4 Ų | 25.4 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -61.6 | -45.3 | 177.3 | -61.7 | 0 | 0 | 0 | 0 | 111.8 | L98 L99 G104 I105 V106 L114 Y421 I424 | L98-C102 PolarHBondContact O-N 2.86Å; L98-C102 PolarHBondContact O-SG 2.83Å; L99-C102 PolarHBondContact O-N 2.72Å; C102-G104 VanDerWaalsContact C-N 3.3Å; C102-G104 PolarHBondContact O-N 3.42Å; C102-I105 PolarHBondContact O-N 3.41Å; C102-V106 WeakPolarHBondContact O-CG2 3.42Å; C102-V106 PolarHBondContact O-N 3.24Å; C102-L114 HydrophobicContact CB-CD1 4.11Å; C102-L114 HydrophobicContact CB-CD2 3.92Å; C102-Y421 WeakPolarHBondContact SG-CA 3.46Å; C102-Y421 PolarHBondContact SG-N 2.97Å; C102-I424 HydrophobicContact CB-CD1 4.19Å |
| 103 | A | 88.3 | Confident | 88.7 | Confident | 3 Ų | 3 | 28.7 Ų | 28.7 | 3% | 0.025 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -61.2 | -38.3 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | L99 T101 G107 I108 L276 | L99-A103 WeakPolarHBondContact O-CB 3.39Å; L99-A103 PolarHBondContact O-N 2.94Å; T101-A103 PolarHBondContact O-N 3.31Å; A103-G107 WeakPolarHBondContact O-CA 3.4Å; A103-G107 PolarHBondContact O-N 2.73Å; A103-I108 WeakPolarHBondContact CB-O 3.49Å; A103-I108 PolarHBondContact O-N 3.45Å; A103-L276 HydrophobicContact CB-CD2 3.73Å |
| 104 | G | 86.2 | Confident | 88.4 | Confident | 51 Ų | 51 | 27.4 Ų | 27.4 | 53% | 0.526 | 16% | 0.16 | S | C | . | . | H | α-helix | trans | -64.5 | -45.5 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.2 | L100 T101 C102 G107 | L100-G104 PolarHBondContact O-N 2.99Å; T101-G104 PolarHBondContact O-N 2.84Å; C102-G104 VanDerWaalsContact C-N 3.3Å; C102-G104 PolarHBondContact O-N 3.42Å; G104-G107 PolarHBondContact O-N 3.44Å |
| 105 | I | 84.5 | Confident | 88.1 | Confident | 88 Ų | 88 | 24.2 Ų | 24.2 | 45% | 0.451 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -65.2 | -42.8 | -178.5 | -67.5 | 166.7 | 0 | 0 | 0 | 111.7 | T101 C102 I424 V425 | T101-I105 HydrophobicContact CG2-CD1 4.09Å; T101-I105 WeakPolarHBondContact O-CG1 3.47Å; T101-I105 PolarHBondContact O-N 3.37Å; T101-I105 VanDerWaalsContact O-N 3.09Å; C102-I105 PolarHBondContact O-N 3.41Å; I105-I424 HydrophobicContact CG2-CG2 4.38Å; I105-V425 HydrophobicContact CD1-CG2 3.82Å |
| 106 | V | 83.9 | Confident | 87.9 | Confident | 40 Ų | 40 | 28.3 Ų | 28.3 | 24% | 0.242 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -85.8 | -18.6 | -176.5 | -166.5 | 0 | 0 | 0 | 0 | 112 | C102 I108 L114 R117 I424 | C102-V106 WeakPolarHBondContact O-CG2 3.42Å; C102-V106 PolarHBondContact O-N 3.24Å; V106-I108 HydrophobicContact CB-CB 4.4Å; V106-I108 HydrophobicContact CB-CD1 4.36Å; V106-I108 HydrophobicContact CB-CG1 4.25Å; V106-I108 HydrophobicContact CG1-CB 4.29Å; V106-I108 HydrophobicContact CG1-CD1 3.4Å; V106-I108 HydrophobicContact CG1-CG1 3.64Å; V106-I108 PolarHBondContact O-N 2.87Å; V106-L114 HydrophobicContact CG2-CD1 4.28Å; V106-R117 HydrophobicContact CG1-CB 4.29Å; V106-R117 HydrophobicContact CG1-CG 3.68Å; V106-R117 HydrophobicContact CG2-CG 4.23Å; V106-I424 HydrophobicContact CG2-CD1 4.29Å; V106-I424 HydrophobicContact CG2-CG2 3.29Å |
| 107 | G | 79.8 | Confident | 87.6 | Confident | 60 Ų | 60 | 36 Ų | 36 | 62% | 0.619 | 20% | 0.196 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 70.1 | 18.8 | -171.9 | 0 | 0 | 0 | 0 | 0 | 113.5 | A103 G104 | A103-G107 WeakPolarHBondContact O-CA 3.4Å; A103-G107 PolarHBondContact O-N 2.73Å; G104-G107 PolarHBondContact O-N 3.44Å |
| 108 | I | 80.1 | Confident | 87.4 | Confident | 33 Ų | 33 | 33.5 Ų | 33.5 | 17% | 0.169 | 19% | 0.188 | C | C | . | . | trans | -99 | 130.6 | 179.6 | -70.4 | 178 | 0 | 0 | 0 | 109.6 | A103 V106 A110 Q113 R117 | A103-I108 WeakPolarHBondContact CB-O 3.49Å; A103-I108 PolarHBondContact O-N 3.45Å; V106-I108 HydrophobicContact CB-CB 4.4Å; V106-I108 HydrophobicContact CB-CD1 4.36Å; V106-I108 HydrophobicContact CB-CG1 4.25Å; V106-I108 HydrophobicContact CG1-CB 4.29Å; V106-I108 HydrophobicContact CG1-CD1 3.4Å; V106-I108 HydrophobicContact CG1-CG1 3.64Å; V106-I108 PolarHBondContact O-N 2.87Å; I108-A110 WeakPolarHBondContact CG2-O 3.19Å; I108-Q113 HydrophobicContact CD1-CB 4.33Å; I108-Q113 HydrophobicContact CG2-CB 3.38Å; I108-R117 HydrophobicContact CD1-CB 4.13Å | ||
| 109 | R | 76.3 | Confident | 87.3 | Confident | 52 Ų | 52 | 37.7 Ų | 37.7 | 20% | 0.196 | 21% | 0.206 | C | C | . | . | trans | -117.2 | 30.2 | -178.9 | -56.1 | -172.5 | 175 | -162.6 | -0.5 | 113.5 | M42 Y279 T280 | M42-R109 VanDerWaalsContact CE-CZ 3.44Å; R109-Y279 PolarHBondContact NH1-O 3.26Å; R109-T280 HydrophobicContact CB-CG2 3.36Å; R109-T280 HydrophobicContact CG-CG2 4.15Å | ||
| 110 | A | 83.1 | Confident | 87.2 | Confident | 1 Ų | 1 | 38.9 Ų | 38.9 | 1% | 0.008 | 22% | 0.219 | C | C | . | . | trans | -134.2 | 134.6 | 172.7 | 0 | 0 | 0 | 0 | 0 | 109.5 | I108 E112 Q113 L114 | I108-A110 WeakPolarHBondContact CG2-O 3.19Å; A110-E112 PolarHBondContact O-N 3.32Å; A110-Q113 HydrophobicContact CB-CB 4.1Å; A110-Q113 HydrophobicContact CB-CG 3.9Å; A110-Q113 PolarHBondContact O-N 3.39Å; A110-L114 PolarHBondContact O-N 2.95Å; A110-L114 VanDerWaalsContact O-N 3.16Å | ||
| 111 | Y | 87.1 | Confident | 87.1 | Confident | 3 Ų | 3 | 43.8 Ų | 43.8 | 1% | 0.012 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -67.6 | -42.6 | -169.8 | -155.8 | -58 | 0 | 0 | 0 | 110.8 | L99 Q113 L114 G115 V127 I131 H272 L276 L412 L416 F420 | L99-Y111 HydrophobicContact CD1-CD2 4.09Å; L99-Y111 HydrophobicContact CD1-CE2 3.66Å; L99-Y111 HydrophobicContact CD2-CD2 3.97Å; L99-Y111 HydrophobicContact CD2-CE2 3.56Å; L99-Y111 HydrophobicContact CG-CE2 4.27Å; Y111-Q113 VanDerWaalsContact C-N 3.3Å; Y111-Q113 PolarHBondContact O-N 3.5Å; Y111-L114 WeakPolarHBondContact O-CB 3.46Å; Y111-L114 PolarHBondContact O-N 2.99Å; Y111-L114 VanDerWaalsContact O-N 3.17Å; Y111-G115 PolarHBondContact O-N 3.33Å; Y111-V127 HydrophobicContact CD1-CG1 3.42Å; Y111-V127 VanDerWaalsContact CD1-CG1 3.42Å; Y111-V127 HydrophobicContact CE1-CG1 3.93Å; Y111-V127 HydrophobicContact CG-CG1 4.47Å; Y111-I131 HydrophobicContact CD1-CD1 4.01Å; Y111-I131 HydrophobicContact CG-CD1 3.93Å; Y111-H272 WeakPolarHBondContact CD2-O 3.07Å; Y111-H272 HydrophobicContact CE2-CB 3.98Å; Y111-L276 HydrophobicContact CD2-CD1 4.32Å; Y111-L276 HydrophobicContact CG-CD1 4.39Å; Y111-L412 HydrophobicContact CE1-CD2 4.44Å; Y111-L412 PolarHBondContact OH-O 3.43Å; Y111-L416 HydrophobicContact CE1-CB 4.3Å; Y111-L416 HydrophobicContact CE1-CD1 4.1Å; Y111-F420 HydrophobicContact CD1-CE2 4.02Å; Y111-F420 AromaticContact CE1-CE2 3.51Å; Y111-F420 HydrophobicContact CE1-CE2 3.51Å; Y111-F420 HydrophobicContact CE1-CZ 4.14Å |
| 112 | E | 88.3 | Confident | 87.2 | Confident | 11 Ų | 11 | 46 Ų | 46 | 5% | 0.051 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -62.9 | -34 | 176.8 | 71.6 | -77.6 | -170.1 | 0 | 0 | 113.1 | A110 L114 G115 Q116 K124 V127 Q363 | A110-E112 PolarHBondContact O-N 3.32Å; E112-L114 VanDerWaalsContact C-N 3.35Å; E112-G115 PolarHBondContact O-N 2.9Å; E112-Q116 PolarHBondContact O-N 2.98Å; E112-K124 HydrophobicContact CB-CG 4.44Å; E112-V127 HydrophobicContact CB-CG1 4.49Å; E112-Q363 HydrophobicContact CG-CB 4.49Å |
| 113 | Q | 87.5 | Confident | 87.2 | Confident | 68 Ų | 68 | 46.3 Ų | 46.3 | 32% | 0.318 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -73.6 | -30.1 | 177.5 | -68.5 | -178.3 | -21 | 0 | 0 | 111.6 | I108 A110 Y111 G115 Q116 R117 | I108-Q113 HydrophobicContact CD1-CB 4.33Å; I108-Q113 HydrophobicContact CG2-CB 3.38Å; A110-Q113 HydrophobicContact CB-CB 4.1Å; A110-Q113 HydrophobicContact CB-CG 3.9Å; A110-Q113 PolarHBondContact O-N 3.39Å; Y111-Q113 VanDerWaalsContact C-N 3.3Å; Y111-Q113 PolarHBondContact O-N 3.5Å; Q113-G115 VanDerWaalsContact C-N 3.33Å; Q113-Q116 WeakPolarHBondContact O-CB 3.2Å; Q113-Q116 PolarHBondContact O-N 2.97Å; Q113-R117 PolarHBondContact O-N 3.45Å |
| 114 | L | 89.1 | Confident | 87.3 | Confident | 0 Ų | 0 | 47.4 Ų | 47.4 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -64.4 | -42 | 172.1 | -163.3 | 65.4 | 0 | 0 | 0 | 110.7 | L99 C102 V106 A110 Y111 E112 Q116 R117 A118 F420 I424 | L99-L114 HydrophobicContact CD1-CD2 3.7Å; C102-L114 HydrophobicContact CB-CD1 4.11Å; C102-L114 HydrophobicContact CB-CD2 3.92Å; V106-L114 HydrophobicContact CG2-CD1 4.28Å; A110-L114 PolarHBondContact O-N 2.95Å; A110-L114 VanDerWaalsContact O-N 3.16Å; Y111-L114 WeakPolarHBondContact O-CB 3.46Å; Y111-L114 PolarHBondContact O-N 2.99Å; Y111-L114 VanDerWaalsContact O-N 3.17Å; E112-L114 VanDerWaalsContact C-N 3.35Å; L114-Q116 VanDerWaalsContact C-N 3.32Å; L114-Q116 PolarHBondContact O-N 3.49Å; L114-R117 PolarHBondContact O-N 3.25Å; L114-A118 PolarHBondContact O-N 3.15Å; L114-F420 HydrophobicContact CB-CE2 4.29Å; L114-F420 HydrophobicContact CD2-CB 4.4Å; L114-F420 HydrophobicContact CD2-CD2 3.43Å; L114-F420 VanDerWaalsContact CD2-CD2 3.43Å; L114-F420 HydrophobicContact CD2-CE2 3.88Å; L114-F420 HydrophobicContact CD2-CG 4.13Å; L114-F420 HydrophobicContact CG-CD2 3.88Å; L114-F420 HydrophobicContact CG-CE2 4.16Å; L114-F420 HydrophobicContact CG-CG 4.25Å; L114-I424 HydrophobicContact CD1-CD1 3.39Å; L114-I424 HydrophobicContact CG-CD1 3.75Å |
| 115 | G | 90.8 | Very high | 87.6 | Confident | 0 Ų | 0 | 48.5 Ų | 48.5 | 0% | 0 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -57.9 | -42.8 | 169.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | Y111 E112 Q113 R117 A118 F119 | Y111-G115 PolarHBondContact O-N 3.33Å; E112-G115 PolarHBondContact O-N 2.9Å; Q113-G115 VanDerWaalsContact C-N 3.33Å; G115-R117 VanDerWaalsContact C-N 3.32Å; G115-R117 PolarHBondContact O-N 2.63Å; G115-A118 PolarHBondContact O-N 3.15Å; G115-F119 PolarHBondContact O-N 2.65Å |
| 116 | Q | 90.8 | Very high | 88 | Confident | 86 Ų | 86 | 48.2 Ų | 48.2 | 40% | 0.402 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -61.3 | -40.1 | 175.8 | -166.7 | 174.7 | -13.3 | 0 | 0 | 112.3 | E112 Q113 L114 G120 K124 | E112-Q116 PolarHBondContact O-N 2.98Å; Q113-Q116 WeakPolarHBondContact O-CB 3.2Å; Q113-Q116 PolarHBondContact O-N 2.97Å; L114-Q116 VanDerWaalsContact C-N 3.32Å; L114-Q116 PolarHBondContact O-N 3.49Å; Q116-G120 WeakPolarHBondContact CA-O 3.24Å; Q116-G120 WeakPolarHBondContact O-CA 3.37Å; Q116-G120 PolarHBondContact O-N 3.49Å; Q116-K124 HydrophobicContact CB-CB 3.93Å; Q116-K124 HydrophobicContact CB-CG 4.36Å; Q116-K124 HydrophobicContact CG-CB 4.31Å |
| 117 | R | 90.2 | Very high | 88.4 | Confident | 161 Ų | 161 | 46.4 Ų | 46.4 | 61% | 0.608 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -69.4 | -35.9 | 179.1 | -177.3 | 66.1 | 179.9 | 80 | -0.7 | 112.7 | V106 I108 Q113 L114 G115 | V106-R117 HydrophobicContact CG1-CB 4.29Å; V106-R117 HydrophobicContact CG1-CG 3.68Å; V106-R117 HydrophobicContact CG2-CG 4.23Å; I108-R117 HydrophobicContact CD1-CB 4.13Å; Q113-R117 PolarHBondContact O-N 3.45Å; L114-R117 PolarHBondContact O-N 3.25Å; G115-R117 VanDerWaalsContact C-N 3.32Å; G115-R117 PolarHBondContact O-N 2.63Å |
| 118 | A | 90.5 | Very high | 88.9 | Confident | 22 Ų | 22 | 43.8 Ų | 43.8 | 18% | 0.182 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -78.9 | -41.5 | -176.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | L114 G115 F420 I424 | L114-A118 PolarHBondContact O-N 3.15Å; G115-A118 PolarHBondContact O-N 3.15Å; A118-F420 HydrophobicContact CB-CD1 3.86Å; A118-F420 HydrophobicContact CB-CE1 4.25Å; A118-I424 HydrophobicContact CB-CD1 4.26Å; A118-I424 HydrophobicContact CB-CG1 4.21Å |
| 119 | F | 91.7 | Very high | 89.5 | Confident | 91 Ų | 91 | 44.8 Ų | 44.8 | 40% | 0.399 | 25% | 0.252 | S | S | . | . | H | α-helix | trans | -131.6 | 13.7 | -171.8 | -64 | -75.5 | 0 | 0 | 0 | 114.4 | G115 I419 R423 | G115-F119 PolarHBondContact O-N 2.65Å; F119-I419 HydrophobicContact CE1-CG2 4.41Å; F119-I419 HydrophobicContact CE2-CG2 3.29Å; F119-I419 HydrophobicContact CZ-CG2 3.13Å; F119-R423 HydrophobicContact CE1-CG 4.24Å; F119-R423 HydrophobicContact CZ-CG 3.82Å |
| 120 | G | 91.4 | Very high | 90.4 | Very high | 25 Ų | 25 | 43.3 Ų | 43.3 | 26% | 0.258 | 25% | 0.249 | S | C | . | . | H | α-helix | trans | 68.1 | -156.1 | -177.1 | 0 | 0 | 0 | 0 | 0 | 112.9 | Q116 A122 G123 K124 | Q116-G120 WeakPolarHBondContact CA-O 3.24Å; Q116-G120 WeakPolarHBondContact O-CA 3.37Å; Q116-G120 PolarHBondContact O-N 3.49Å; G120-A122 VanDerWaalsContact C-N 3.29Å; G120-A122 PolarHBondContact O-N 3.34Å; G120-G123 PolarHBondContact O-N 3.25Å; G120-G123 VanDerWaalsContact O-N 3.15Å; G120-K124 PolarHBondContact O-N 3.02Å |
| 121 | P | 89.8 | Confident | 90.8 | Very high | 104 Ų | 104 | 43.6 Ų | 43.6 | 68% | 0.675 | 25% | 0.25 | S | C | * | . | H | α-helix | trans | -58.3 | -36.7 | -174.6 | -25.1 | 34.5 | 0 | 0 | 0 | 114.1 | G123 K124 V125 | P121-G123 PolarHBondContact O-N 3.33Å; P121-K124 WeakPolarHBondContact O-CB 3.48Å; P121-K124 PolarHBondContact O-N 3.21Å; P121-V125 WeakPolarHBondContact O-CG2 3.28Å; P121-V125 PolarHBondContact O-N 3.41Å |
| 122 | A | 91.4 | Very high | 91 | Very high | 67 Ų | 67 | 44.9 Ų | 44.9 | 55% | 0.554 | 26% | 0.259 | S | S | * | . | H | α-helix | trans | -62.4 | -43.5 | 178 | 0 | 0 | 0 | 0 | 0 | 111.7 | G120 K124 V125 V126 | G120-A122 VanDerWaalsContact C-N 3.29Å; G120-A122 PolarHBondContact O-N 3.34Å; A122-K124 VanDerWaalsContact C-N 3.31Å; A122-K124 PolarHBondContact O-N 3.42Å; A122-V125 PolarHBondContact O-N 3.43Å; A122-V126 WeakPolarHBondContact O-CG2 3.2Å; A122-V126 PolarHBondContact O-N 3.41Å |
| 123 | G | 91.2 | Very high | 91.2 | Very high | 6 Ų | 6 | 48 Ų | 48 | 6% | 0.062 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -58.9 | -41.5 | 175.1 | 0 | 0 | 0 | 0 | 0 | 113.2 | G120 P121 V125 V126 V127 | G120-G123 PolarHBondContact O-N 3.25Å; G120-G123 VanDerWaalsContact O-N 3.15Å; P121-G123 PolarHBondContact O-N 3.33Å; G123-V125 VanDerWaalsContact C-N 3.33Å; G123-V125 PolarHBondContact O-N 2.93Å; G123-V126 PolarHBondContact O-N 3.26Å; G123-V127 WeakPolarHBondContact O-CB 3.49Å; G123-V127 WeakPolarHBondContact O-CG2 3.36Å; G123-V127 PolarHBondContact O-N 2.92Å |
| 124 | K | 90.3 | Very high | 91.5 | Very high | 27 Ų | 27 | 45.2 Ų | 45.2 | 12% | 0.117 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -57 | -47.5 | 175.4 | -171.8 | -174 | 178.3 | 177.4 | 0 | 111.4 | E112 Q116 G120 P121 A122 A128 Q363 | E112-K124 HydrophobicContact CB-CG 4.44Å; Q116-K124 HydrophobicContact CB-CB 3.93Å; Q116-K124 HydrophobicContact CB-CG 4.36Å; Q116-K124 HydrophobicContact CG-CB 4.31Å; G120-K124 PolarHBondContact O-N 3.02Å; P121-K124 WeakPolarHBondContact O-CB 3.48Å; P121-K124 PolarHBondContact O-N 3.21Å; A122-K124 VanDerWaalsContact C-N 3.31Å; A122-K124 PolarHBondContact O-N 3.42Å; K124-A128 VanDerWaalsContact O-CB 3.28Å; K124-A128 WeakPolarHBondContact O-CB 3.32Å; K124-A128 PolarHBondContact O-N 2.97Å; K124-Q363 WeakPolarHBondContact CE-O 3.28Å; K124-Q363 PolarHBondContact NZ-O 3.2Å |
| 125 | V | 91.6 | Very high | 91.7 | Very high | 73 Ų | 73 | 45.4 Ų | 45.4 | 44% | 0.442 | 26% | 0.263 | S | S | . | . | H | α-helix | trans | -66 | -47.5 | -178.1 | -179.2 | 0 | 0 | 0 | 0 | 111.1 | P121 A122 G123 V127 A128 A129 L364 | P121-V125 WeakPolarHBondContact O-CG2 3.28Å; P121-V125 PolarHBondContact O-N 3.41Å; A122-V125 PolarHBondContact O-N 3.43Å; G123-V125 VanDerWaalsContact C-N 3.33Å; G123-V125 PolarHBondContact O-N 2.93Å; V125-V127 VanDerWaalsContact C-N 3.33Å; V125-V127 PolarHBondContact O-N 3.29Å; V125-A128 PolarHBondContact O-N 3.48Å; V125-A129 WeakPolarHBondContact O-CB 3.22Å; V125-A129 PolarHBondContact O-N 3.19Å; V125-L364 HydrophobicContact CB-CD1 4.19Å; V125-L364 HydrophobicContact CG1-CD1 4.28Å; V125-L364 HydrophobicContact CG2-CD1 3.64Å |
| 126 | V | 93.3 | Very high | 91.8 | Very high | 83 Ų | 83 | 46.2 Ų | 46.2 | 50% | 0.503 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -58.6 | -47.1 | 179.9 | 170.7 | 0 | 0 | 0 | 0 | 110.9 | A122 G123 A129 V130 | A122-V126 WeakPolarHBondContact O-CG2 3.2Å; A122-V126 PolarHBondContact O-N 3.41Å; G123-V126 PolarHBondContact O-N 3.26Å; V126-A129 PolarHBondContact O-N 3.36Å; V126-V130 WeakPolarHBondContact O-CG2 3.34Å; V126-V130 PolarHBondContact O-N 3.42Å |
| 127 | V | 92.3 | Very high | 91.9 | Very high | 1 Ų | 1 | 42.2 Ų | 42.2 | 1% | 0.006 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -65.8 | -44.3 | -179.4 | 171.7 | 0 | 0 | 0 | 0 | 111.7 | Y111 E112 G123 V125 A129 V130 I131 L416 F420 | Y111-V127 HydrophobicContact CD1-CG1 3.42Å; Y111-V127 VanDerWaalsContact CD1-CG1 3.42Å; Y111-V127 HydrophobicContact CE1-CG1 3.93Å; Y111-V127 HydrophobicContact CG-CG1 4.47Å; E112-V127 HydrophobicContact CB-CG1 4.49Å; G123-V127 WeakPolarHBondContact O-CB 3.49Å; G123-V127 WeakPolarHBondContact O-CG2 3.36Å; G123-V127 PolarHBondContact O-N 2.92Å; V125-V127 VanDerWaalsContact C-N 3.33Å; V125-V127 PolarHBondContact O-N 3.29Å; V127-A129 VanDerWaalsContact C-N 3.28Å; V127-A129 PolarHBondContact O-N 3.03Å; V127-V130 PolarHBondContact O-N 3.45Å; V127-I131 HydrophobicContact CG1-CD1 3.88Å; V127-I131 VanDerWaalsContact O-CG1 3.32Å; V127-I131 WeakPolarHBondContact O-CG1 3.26Å; V127-I131 PolarHBondContact O-N 3.32Å; V127-L416 HydrophobicContact CG2-CD1 4.31Å; V127-L416 HydrophobicContact CG2-CD2 3.91Å; V127-F420 HydrophobicContact CG2-CE1 4.21Å; V127-F420 HydrophobicContact CG2-CZ 3.61Å |
| 128 | A | 91.2 | Very high | 92 | Very high | 6 Ų | 6 | 34.9 Ų | 34.9 | 5% | 0.05 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -61.4 | -38.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.8 | K124 V125 C132 A360 | K124-A128 VanDerWaalsContact O-CB 3.28Å; K124-A128 WeakPolarHBondContact O-CB 3.32Å; K124-A128 PolarHBondContact O-N 2.97Å; V125-A128 PolarHBondContact O-N 3.48Å; A128-C132 WeakPolarHBondContact O-CB 3.21Å; A128-C132 PolarHBondContact O-N 3.25Å; A128-A360 HydrophobicContact CB-CB 4.45Å |
| 129 | A | 92.6 | Very high | 92.1 | Very high | 54 Ų | 54 | 33.8 Ų | 33.8 | 45% | 0.446 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -66 | -44.1 | 177.1 | 0 | 0 | 0 | 0 | 0 | 112.1 | V125 V126 V127 C132 L133 | V125-A129 WeakPolarHBondContact O-CB 3.22Å; V125-A129 PolarHBondContact O-N 3.19Å; V126-A129 PolarHBondContact O-N 3.36Å; V127-A129 VanDerWaalsContact C-N 3.28Å; V127-A129 PolarHBondContact O-N 3.03Å; A129-C132 PolarHBondContact O-N 3.09Å; A129-L133 WeakPolarHBondContact O-CB 3.46Å; A129-L133 PolarHBondContact O-N 2.96Å |
| 130 | V | 93.9 | Very high | 92.2 | Very high | 21 Ų | 21 | 29.5 Ų | 29.5 | 13% | 0.127 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -63.6 | -43.6 | 176.9 | 172.2 | 0 | 0 | 0 | 0 | 111.4 | V126 V127 L133 H134 L412 L416 | V126-V130 WeakPolarHBondContact O-CG2 3.34Å; V126-V130 PolarHBondContact O-N 3.42Å; V127-V130 PolarHBondContact O-N 3.45Å; V130-L133 PolarHBondContact O-N 3.25Å; V130-H134 WeakPolarHBondContact O-CB 3.48Å; V130-H134 PolarHBondContact O-N 3.02Å; V130-L412 HydrophobicContact CG1-CD1 4.26Å; V130-L412 HydrophobicContact CG1-CD2 3.88Å; V130-L412 HydrophobicContact CG1-CG 3.67Å; V130-L416 HydrophobicContact CB-CD1 4.35Å; V130-L416 HydrophobicContact CG1-CD1 4.11Å |
| 131 | I | 91.8 | Very high | 92.3 | Very high | 6 Ų | 6 | 28.3 Ų | 28.3 | 3% | 0.031 | 18% | 0.184 | C | C | . | . | H | α-helix | trans | -62.9 | -44.2 | 175.5 | -68.3 | 167.6 | 0 | 0 | 0 | 110.7 | Y111 V127 H134 N135 P273 L412 | Y111-I131 HydrophobicContact CD1-CD1 4.01Å; Y111-I131 HydrophobicContact CG-CD1 3.93Å; V127-I131 HydrophobicContact CG1-CD1 3.88Å; V127-I131 VanDerWaalsContact O-CG1 3.32Å; V127-I131 WeakPolarHBondContact O-CG1 3.26Å; V127-I131 PolarHBondContact O-N 3.32Å; I131-H134 PolarHBondContact O-N 3.44Å; I131-N135 WeakPolarHBondContact O-CB 3.3Å; I131-N135 PolarHBondContact O-N 3.28Å; I131-P273 HydrophobicContact CG1-CB 4.43Å; I131-P273 HydrophobicContact CG1-CG 4.34Å; I131-P273 HydrophobicContact CG2-CB 4.06Å; I131-P273 HydrophobicContact CG2-CG 4.42Å; I131-L412 HydrophobicContact CG1-CD2 4.01Å |
| 132 | C | 91.7 | Very high | 92.5 | Very high | 30 Ų | 30 | 23.6 Ų | 23.6 | 20% | 0.203 | 15% | 0.153 | C | C | . | . | H | α-helix | trans | -60.8 | -47.6 | 177.4 | -170.5 | 0 | 0 | 0 | 0 | 111 | A128 A129 H134 N135 V136 | A128-C132 WeakPolarHBondContact O-CB 3.21Å; A128-C132 PolarHBondContact O-N 3.25Å; A129-C132 PolarHBondContact O-N 3.09Å; C132-H134 PolarHBondContact O-N 3.09Å; C132-N135 PolarHBondContact O-N 2.89Å; C132-V136 VanDerWaalsContact O-CB 3.26Å; C132-V136 WeakPolarHBondContact O-CB 3.35Å; C132-V136 VanDerWaalsContact O-CG2 3.22Å; C132-V136 WeakPolarHBondContact O-CG2 3.32Å; C132-V136 PolarHBondContact O-N 3.4Å |
| 133 | L | 93.4 | Very high | 92.6 | Very high | 77 Ų | 77 | 20.4 Ų | 20.4 | 40% | 0.403 | 13% | 0.126 | S | C | . | . | H | α-helix | trans | -57.5 | -48.6 | 177 | 179 | 64.3 | 0 | 0 | 0 | 111.3 | A129 V130 G137 I404 | A129-L133 WeakPolarHBondContact O-CB 3.46Å; A129-L133 PolarHBondContact O-N 2.96Å; V130-L133 PolarHBondContact O-N 3.25Å; L133-G137 PolarHBondContact O-N 2.89Å; L133-I404 HydrophobicContact CD1-CD1 4.04Å; L133-I404 HydrophobicContact CG-CD1 4.28Å |
| 134 | H | 93.3 | Very high | 92.7 | Very high | 9 Ų | 9 | 21 Ų | 21 | 4% | 0.042 | 13% | 0.128 | C | C | . | . | H | α-helix | trans | -59.3 | -53 | 179.6 | -175.9 | 62.7 | 0 | 0 | 0 | 112.2 | V130 I131 C132 G137 A138 F267 V270 S408 L412 | V130-H134 WeakPolarHBondContact O-CB 3.48Å; V130-H134 PolarHBondContact O-N 3.02Å; I131-H134 PolarHBondContact O-N 3.44Å; C132-H134 PolarHBondContact O-N 3.09Å; H134-G137 WeakPolarHBondContact O-CA 3.46Å; H134-G137 PolarHBondContact O-N 2.94Å; H134-G137 VanDerWaalsContact O-N 3.15Å; H134-A138 PolarHBondContact O-N 3.45Å; H134-F267 AromaticContact CE1-CD2 3.85Å; H134-F267 AromaticContact CE1-CE2 3.98Å; H134-V270 WeakPolarHBondContact CE1-CB 3.42Å; H134-V270 VanDerWaalsContact CE1-CG1 3.44Å; H134-V270 WeakPolarHBondContact CE1-CG1 3.27Å; H134-V270 WeakPolarHBondContact NE2-CB 3.45Å; H134-V270 VanDerWaalsContact NE2-CG1 3.26Å; H134-V270 WeakPolarHBondContact NE2-CG1 3.46Å; H134-S408 PolarHBondContact ND1-OG 3.13Å; H134-L412 HydrophobicContact CB-CD1 3.56Å |
| 135 | N | 92.3 | Very high | 92.8 | Very high | 4 Ų | 4 | 19.8 Ų | 19.8 | 2% | 0.021 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -71.9 | -33.4 | -174.6 | -73.7 | 12.1 | 0 | 0 | 0 | 112.1 | I131 C132 G137 A138 M139 V353 I357 | I131-N135 WeakPolarHBondContact O-CB 3.3Å; I131-N135 PolarHBondContact O-N 3.28Å; C132-N135 PolarHBondContact O-N 2.89Å; N135-G137 VanDerWaalsContact C-N 3.3Å; N135-A138 PolarHBondContact O-N 3.09Å; N135-M139 WeakPolarHBondContact O-CB 3.41Å; N135-M139 VanDerWaalsContact O-CG 3.28Å; N135-M139 WeakPolarHBondContact O-CG 3.33Å; N135-M139 PolarHBondContact O-N 3.47Å; N135-V353 HydrophobicContact CB-CG1 3.64Å; N135-V353 PolarHBondContact ND2-O 3.39Å; N135-I357 HydrophobicContact CB-CD1 3.45Å; N135-I357 VanDerWaalsContact CB-CD1 3.45Å; N135-I357 HydrophobicContact CB-CG1 3.27Å |
| 136 | V | 92.8 | Very high | 92.9 | Very high | 18 Ų | 18 | 16.4 Ų | 16.4 | 11% | 0.109 | 10% | 0.101 | C | C | . | . | H | α-helix | trans | -61.2 | -43 | 169.2 | 164.5 | 0 | 0 | 0 | 0 | 110.1 | C132 M139 S140 I357 V387 | C132-V136 VanDerWaalsContact O-CB 3.26Å; C132-V136 WeakPolarHBondContact O-CB 3.35Å; C132-V136 VanDerWaalsContact O-CG2 3.22Å; C132-V136 WeakPolarHBondContact O-CG2 3.32Å; C132-V136 PolarHBondContact O-N 3.4Å; V136-M139 PolarHBondContact O-N 2.98Å; V136-S140 WeakPolarHBondContact O-CB 3.39Å; V136-S140 PolarHBondContact O-N 2.74Å; V136-S140 PolarHBondContact O-OG 2.98Å; V136-I357 HydrophobicContact CG2-CD1 4.26Å; V136-V387 HydrophobicContact CG1-CG2 4.26Å |
| 137 | G | 92.8 | Very high | 92.8 | Very high | 2 Ų | 2 | 14.2 Ų | 14.2 | 2% | 0.021 | 9% | 0.085 | C | C | . | . | H | α-helix | trans | -57.2 | -52 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.3 | L133 H134 N135 M139 S140 S141 | L133-G137 PolarHBondContact O-N 2.89Å; H134-G137 WeakPolarHBondContact O-CA 3.46Å; H134-G137 PolarHBondContact O-N 2.94Å; H134-G137 VanDerWaalsContact O-N 3.15Å; N135-G137 VanDerWaalsContact C-N 3.3Å; G137-M139 PolarHBondContact O-N 3.41Å; G137-S140 WeakPolarHBondContact O-CB 3.41Å; G137-S140 PolarHBondContact O-N 3.19Å; G137-S140 VanDerWaalsContact O-N 3.13Å; G137-S141 PolarHBondContact O-N 2.83Å; G137-S141 PolarHBondContact O-OG 3.42Å |
| 138 | A | 92.3 | Very high | 92.7 | Very high | 6 Ų | 6 | 15.6 Ų | 15.6 | 5% | 0.05 | 10% | 0.095 | C | C | . | . | H | α-helix | trans | -62.3 | -41.2 | 177.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | H134 N135 S140 S141 Y142 F267 V353 | H134-A138 PolarHBondContact O-N 3.45Å; N135-A138 PolarHBondContact O-N 3.09Å; A138-S140 VanDerWaalsContact C-N 3.3Å; A138-S140 PolarHBondContact O-N 3.26Å; A138-S141 PolarHBondContact O-N 3.12Å; A138-S141 PolarHBondContact O-OG 2.95Å; A138-Y142 HydrophobicContact CB-CE2 4.35Å; A138-Y142 WeakPolarHBondContact O-CD2 3.41Å; A138-Y142 WeakPolarHBondContact O-CE2 3.35Å; A138-Y142 PolarHBondContact O-N 3.27Å; A138-F267 HydrophobicContact CB-CE2 4.06Å; A138-F267 HydrophobicContact CB-CZ 4.06Å; A138-V353 HydrophobicContact CB-CG1 4.25Å |
| 139 | M | 92.8 | Very high | 92.7 | Very high | 0 Ų | 0 | 15.4 Ų | 15.4 | 0% | 0 | 9% | 0.093 | C | C | . | . | H | α-helix | trans | -61.7 | -40.1 | 172.8 | -75.8 | 179.2 | 65.2 | 0 | 0 | 112.1 | N135 V136 G137 Y142 L143 V350 V353 L354 I357 V387 | N135-M139 WeakPolarHBondContact O-CB 3.41Å; N135-M139 VanDerWaalsContact O-CG 3.28Å; N135-M139 WeakPolarHBondContact O-CG 3.33Å; N135-M139 PolarHBondContact O-N 3.47Å; V136-M139 PolarHBondContact O-N 2.98Å; G137-M139 PolarHBondContact O-N 3.41Å; M139-Y142 PolarHBondContact O-N 3.1Å; M139-L143 WeakPolarHBondContact O-CB 3.47Å; M139-L143 WeakPolarHBondContact O-CG 3.42Å; M139-L143 PolarHBondContact O-N 2.91Å; M139-V350 HydrophobicContact CE-CG1 3.84Å; M139-V350 HydrophobicContact CG-CG1 4.4Å; M139-V353 HydrophobicContact CG-CB 4.12Å; M139-V353 HydrophobicContact CG-CG1 3.77Å; M139-L354 HydrophobicContact CE-CB 4.25Å; M139-L354 HydrophobicContact CE-CD1 3.83Å; M139-L354 HydrophobicContact CE-CG 4.41Å; M139-L354 HydrophobicContact SD-CB 4.06Å; M139-I357 HydrophobicContact SD-CD1 3.48Å; M139-I357 WeakPolarHBondContact SD-CD1 3.26Å; M139-V387 HydrophobicContact CB-CG1 3.93Å; M139-V387 HydrophobicContact CB-CG2 4.28Å; M139-V387 HydrophobicContact CE-CG2 4.14Å |
| 140 | S | 93.8 | Very high | 92.6 | Very high | 0 Ų | 0 | 14.2 Ų | 14.2 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -65 | -40.9 | -179.4 | -56.7 | 0 | 0 | 0 | 0 | 111.4 | V136 G137 A138 L143 F144 V387 L390 V391 | V136-S140 WeakPolarHBondContact O-CB 3.39Å; V136-S140 PolarHBondContact O-N 2.74Å; V136-S140 PolarHBondContact O-OG 2.98Å; G137-S140 WeakPolarHBondContact O-CB 3.41Å; G137-S140 PolarHBondContact O-N 3.19Å; G137-S140 VanDerWaalsContact O-N 3.13Å; A138-S140 VanDerWaalsContact C-N 3.3Å; A138-S140 PolarHBondContact O-N 3.26Å; S140-L143 PolarHBondContact O-N 3.39Å; S140-F144 WeakPolarHBondContact O-CB 3.33Å; S140-F144 PolarHBondContact O-N 3.13Å; S140-V387 WeakPolarHBondContact OG-CG1 3.47Å; S140-L390 WeakPolarHBondContact OG-CD2 3.33Å; S140-V391 WeakPolarHBondContact O-CG2 3.08Å |
| 141 | S | 93.9 | Very high | 92.4 | Very high | 0 Ų | 0 | 13.8 Ų | 13.8 | 0% | 0 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -67.6 | -36.9 | 176.4 | 51.5 | 0 | 0 | 0 | 0 | 113.1 | S64 G137 A138 F144 I145 | S64-S141 WeakPolarHBondContact OG-CB 3.39Å; S64-S141 PolarHBondContact OG-OG 2.86Å; G137-S141 PolarHBondContact O-N 2.83Å; G137-S141 PolarHBondContact O-OG 3.42Å; A138-S141 PolarHBondContact O-N 3.12Å; A138-S141 PolarHBondContact O-OG 2.95Å; S141-F144 PolarHBondContact O-N 3.44Å; S141-I145 WeakPolarHBondContact O-CD1 3.2Å; S141-I145 VanDerWaalsContact O-CG1 3.32Å; S141-I145 WeakPolarHBondContact O-CG1 3.34Å; S141-I145 PolarHBondContact O-N 2.93Å; S141-I145 VanDerWaalsContact O-N 3.12Å |
| 142 | Y | 93.5 | Very high | 92.1 | Very high | 5 Ų | 5 | 14.2 Ų | 14.2 | 2% | 0.02 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -63.2 | -45.3 | 172 | -62.3 | -49.5 | 0 | 0 | 0 | 112.6 | G63 A138 M139 F144 I145 I146 V346 T349 V350 V353 | G63-Y142 VanDerWaalsContact C-CE1 3.5Å; G63-Y142 WeakPolarHBondContact CA-OH 3.44Å; A138-Y142 HydrophobicContact CB-CE2 4.35Å; A138-Y142 WeakPolarHBondContact O-CD2 3.41Å; A138-Y142 WeakPolarHBondContact O-CE2 3.35Å; A138-Y142 PolarHBondContact O-N 3.27Å; M139-Y142 PolarHBondContact O-N 3.1Å; Y142-F144 VanDerWaalsContact C-N 3.29Å; Y142-F144 PolarHBondContact O-N 2.93Å; Y142-I145 PolarHBondContact O-N 3.07Å; Y142-I146 WeakPolarHBondContact O-CG1 3.43Å; Y142-I146 PolarHBondContact O-N 2.9Å; Y142-I146 VanDerWaalsContact O-N 3.14Å; Y142-V346 HydrophobicContact CD1-CB 3.8Å; Y142-V346 HydrophobicContact CD1-CG1 3.76Å; Y142-V346 HydrophobicContact CE1-CG1 4.4Å; Y142-V346 HydrophobicContact CG-CB 4.28Å; Y142-T349 HydrophobicContact CE1-CG2 4.14Å; Y142-T349 HydrophobicContact CE2-CG2 3.81Å; Y142-T349 WeakPolarHBondContact OH-CG2 3.35Å; Y142-V350 HydrophobicContact CD2-CG2 3.82Å; Y142-V350 HydrophobicContact CG-CG2 4.01Å; Y142-V353 HydrophobicContact CE2-CG2 3.95Å |
| 143 | L | 93.8 | Very high | 92 | Very high | 0 Ų | 0 | 13 Ų | 13 | 0% | 0 | 7% | 0.071 | C | C | . | . | H | α-helix | trans | -65.4 | -34.9 | 177.9 | -75.8 | -160.9 | 0 | 0 | 0 | 111.2 | M139 S140 I146 K147 I174 I182 V350 V387 V391 | M139-L143 WeakPolarHBondContact O-CB 3.47Å; M139-L143 WeakPolarHBondContact O-CG 3.42Å; M139-L143 PolarHBondContact O-N 2.91Å; S140-L143 PolarHBondContact O-N 3.39Å; L143-I146 HydrophobicContact CD2-CD1 4.09Å; L143-I146 PolarHBondContact O-N 3.27Å; L143-K147 PolarHBondContact O-N 2.87Å; L143-I174 HydrophobicContact CB-CD1 3.8Å; L143-I174 HydrophobicContact CB-CG1 4.35Å; L143-I174 HydrophobicContact CD1-CD1 4.42Å; L143-I174 HydrophobicContact CD2-CG1 4.49Å; L143-I174 WeakPolarHBondContact O-CD1 3.47Å; L143-I182 HydrophobicContact CD2-CD1 3.43Å; L143-I182 VanDerWaalsContact CD2-CD1 3.43Å; L143-V350 HydrophobicContact CD2-CG2 4.41Å; L143-V387 HydrophobicContact CD1-CB 4.23Å; L143-V387 HydrophobicContact CD1-CG1 3.54Å; L143-V387 HydrophobicContact CG-CG1 4.23Å; L143-V391 HydrophobicContact CB-CG1 4.42Å; L143-V391 HydrophobicContact CB-CG2 3.89Å |
| 144 | F | 93.6 | Very high | 91.7 | Very high | 20 Ų | 20 | 11.3 Ų | 11.3 | 9% | 0.088 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -61.2 | -45.3 | 173.8 | -168.9 | -78.6 | 0 | 0 | 0 | 111.6 | S140 S141 Y142 I146 K147 S148 V391 I397 I400 | S140-F144 WeakPolarHBondContact O-CB 3.33Å; S140-F144 PolarHBondContact O-N 3.13Å; S141-F144 PolarHBondContact O-N 3.44Å; Y142-F144 VanDerWaalsContact C-N 3.29Å; Y142-F144 PolarHBondContact O-N 2.93Å; F144-I146 VanDerWaalsContact C-N 3.28Å; F144-I146 PolarHBondContact O-N 3.46Å; F144-K147 CarbonylContact O-C 3.57Å; F144-K147 WeakPolarHBondContact O-CA 3.39Å; F144-K147 WeakPolarHBondContact O-CB 3.38Å; F144-K147 PolarHBondContact O-N 3.24Å; F144-S148 PolarHBondContact O-N 3.5Å; F144-S148 PolarHBondContact O-OG 3.05Å; F144-V391 HydrophobicContact CB-CG1 4.05Å; F144-V391 HydrophobicContact CD2-CG1 4.21Å; F144-I397 HydrophobicContact CD1-CB 3.73Å; F144-I397 HydrophobicContact CD1-CD1 4.06Å; F144-I397 HydrophobicContact CD1-CG1 4.07Å; F144-I397 HydrophobicContact CE1-CB 3.8Å; F144-I397 HydrophobicContact CG-CB 4.26Å; F144-I397 HydrophobicContact CG-CG1 4.37Å; F144-I397 HydrophobicContact CZ-CB 4.37Å; F144-I400 HydrophobicContact CB-CD1 4.29Å; F144-I400 HydrophobicContact CD2-CD1 4.27Å |
| 145 | I | 92.4 | Very high | 91.3 | Very high | 0 Ų | 0 | 11.1 Ų | 11.1 | 0% | 0 | 6% | 0.062 | C | C | . | . | H | α-helix | trans | -59.1 | -40.9 | 175.4 | -64.5 | 158.9 | 0 | 0 | 0 | 110.9 | L67 S141 Y142 K147 S148 E149 V342 V346 I397 | L67-I145 HydrophobicContact CD1-CD1 3.45Å; L67-I145 VanDerWaalsContact CD1-CD1 3.45Å; L67-I145 HydrophobicContact CD1-CG1 3.79Å; L67-I145 HydrophobicContact CD1-CG2 4.24Å; S141-I145 WeakPolarHBondContact O-CD1 3.2Å; S141-I145 VanDerWaalsContact O-CG1 3.32Å; S141-I145 WeakPolarHBondContact O-CG1 3.34Å; S141-I145 PolarHBondContact O-N 2.93Å; S141-I145 VanDerWaalsContact O-N 3.12Å; Y142-I145 PolarHBondContact O-N 3.07Å; I145-K147 VanDerWaalsContact C-N 3.31Å; I145-K147 PolarHBondContact O-N 3.32Å; I145-S148 WeakPolarHBondContact CA-OG 3.43Å; I145-S148 PolarHBondContact O-N 3.32Å; I145-S148 PolarHBondContact O-OG 2.95Å; I145-E149 HydrophobicContact CG2-CG 4.19Å; I145-E149 VanDerWaalsContact O-CB 3.31Å; I145-E149 WeakPolarHBondContact O-CB 3.23Å; I145-E149 PolarHBondContact O-N 3.3Å; I145-V342 HydrophobicContact CG2-CG1 4.21Å; I145-V346 HydrophobicContact CD1-CG1 4.12Å; I145-V346 HydrophobicContact CG2-CG2 4.45Å; I145-I397 HydrophobicContact CD1-CD1 4.45Å; I145-I397 HydrophobicContact CG1-CD1 3.97Å |
| 146 | I | 92.9 | Very high | 90.9 | Very high | 2 Ų | 2 | 12.7 Ų | 12.7 | 1% | 0.01 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -63.3 | -40.8 | 175 | -64 | 168.9 | 0 | 0 | 0 | 110.6 | Y142 L143 F144 L150 V177 I182 L343 V346 | Y142-I146 WeakPolarHBondContact O-CG1 3.43Å; Y142-I146 PolarHBondContact O-N 2.9Å; Y142-I146 VanDerWaalsContact O-N 3.14Å; L143-I146 HydrophobicContact CD2-CD1 4.09Å; L143-I146 PolarHBondContact O-N 3.27Å; F144-I146 VanDerWaalsContact C-N 3.28Å; F144-I146 PolarHBondContact O-N 3.46Å; I146-L150 HydrophobicContact CG2-CB 4.33Å; I146-L150 HydrophobicContact CG2-CD2 4Å; I146-L150 WeakPolarHBondContact O-CB 3.49Å; I146-L150 PolarHBondContact O-N 3.44Å; I146-V177 HydrophobicContact CD1-CG1 4.37Å; I146-V177 HydrophobicContact CG2-CB 4.4Å; I146-V177 HydrophobicContact CG2-CG1 4.28Å; I146-V177 HydrophobicContact CG2-CG2 4.42Å; I146-I182 HydrophobicContact CD1-CD1 4.23Å; I146-L343 HydrophobicContact CB-CD2 4.35Å; I146-L343 HydrophobicContact CG1-CD2 4.06Å; I146-V346 HydrophobicContact CD1-CG2 4.22Å; I146-V346 HydrophobicContact CG1-CG2 3.84Å |
| 147 | K | 91.9 | Very high | 90.5 | Very high | 38 Ų | 38 | 17.3 Ų | 17.3 | 17% | 0.165 | 9% | 0.09 | C | C | . | . | H | α-helix | trans | -65 | -38.7 | 178.3 | 168.6 | -176.9 | 161.4 | -177.2 | 0 | 112.6 | L143 F144 I145 P151 G170 N171 I174 V391 | L143-K147 PolarHBondContact O-N 2.87Å; F144-K147 CarbonylContact O-C 3.57Å; F144-K147 WeakPolarHBondContact O-CA 3.39Å; F144-K147 WeakPolarHBondContact O-CB 3.38Å; F144-K147 PolarHBondContact O-N 3.24Å; I145-K147 VanDerWaalsContact C-N 3.31Å; I145-K147 PolarHBondContact O-N 3.32Å; K147-P151 WeakPolarHBondContact O-CD 3.12Å; K147-P151 WeakPolarHBondContact O-CG 3.4Å; K147-G170 WeakPolarHBondContact O-CA 3.28Å; K147-N171 WeakPolarHBondContact CE-OD1 3.41Å; K147-N171 PolarHBondContact NZ-OD1 3.43Å; K147-I174 HydrophobicContact CB-CB 4.4Å; K147-I174 HydrophobicContact CB-CD1 4.08Å; K147-V391 HydrophobicContact CB-CG1 4.5Å; K147-V391 HydrophobicContact CD-CG1 3.95Å; K147-V391 PolarHBondContact NZ-O 3.49Å |
| 148 | S | 89.9 | Confident | 90.1 | Very high | 30 Ų | 30 | 21.5 Ų | 21.5 | 21% | 0.21 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -81.4 | -44.8 | -179.1 | 50.5 | 0 | 0 | 0 | 0 | 112.7 | F144 I145 E323 | F144-S148 PolarHBondContact O-N 3.5Å; F144-S148 PolarHBondContact O-OG 3.05Å; I145-S148 WeakPolarHBondContact CA-OG 3.43Å; I145-S148 PolarHBondContact O-N 3.32Å; I145-S148 PolarHBondContact O-OG 2.95Å; S148-E323 PolarHBondContact OG-OE1 3.46Å; S148-E323 PolarHBondContact OG-OE2 3.42Å |
| 149 | E | 90.8 | Very high | 89.5 | Confident | 1 Ų | 1 | 31.8 Ų | 31.8 | 1% | 0.005 | 15% | 0.151 | C | C | . | . | H | α-helix | trans | -92.3 | -31.7 | -168.3 | -65.4 | -67.2 | 152 | 0 | 0 | 114.1 | I145 L152 V153 L325 R339 L343 | I145-E149 HydrophobicContact CG2-CG 4.19Å; I145-E149 VanDerWaalsContact O-CB 3.31Å; I145-E149 WeakPolarHBondContact O-CB 3.23Å; I145-E149 PolarHBondContact O-N 3.3Å; E149-L152 WeakPolarHBondContact O-CB 3.13Å; E149-L152 PolarHBondContact O-N 3.24Å; E149-V153 WeakPolarHBondContact O-CG2 3.03Å; E149-V153 PolarHBondContact O-N 2.93Å; E149-V153 VanDerWaalsContact O-N 3.15Å; E149-L325 HydrophobicContact CG-CD2 4.16Å; E149-R339 WeakPolarHBondContact OE2-CD 3.38Å; E149-R339 WeakPolarHBondContact OE2-CG 3.36Å; E149-R339 IonicContact OE2-CZ 2.85Å; E149-R339 IonicContact OE2-NE 3.99Å; E149-R339 PolarHBondContact OE2-NE 3.49Å; E149-L343 HydrophobicContact CB-CD1 4.42Å; E149-L343 HydrophobicContact CB-CD2 4.08Å; E149-L343 HydrophobicContact CB-CG 4.34Å |
| 150 | L | 90.9 | Very high | 88.6 | Confident | 29 Ų | 29 | 35.9 Ų | 35.9 | 15% | 0.152 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -62.7 | -42 | -177.4 | -175.9 | 61.1 | 0 | 0 | 0 | 113.7 | I146 L152 V153 I154 L173 V177 L343 | I146-L150 HydrophobicContact CG2-CB 4.33Å; I146-L150 HydrophobicContact CG2-CD2 4Å; I146-L150 WeakPolarHBondContact O-CB 3.49Å; I146-L150 PolarHBondContact O-N 3.44Å; L150-L152 VanDerWaalsContact C-N 3.28Å; L150-L152 PolarHBondContact O-N 3.43Å; L150-V153 PolarHBondContact O-N 2.96Å; L150-I154 HydrophobicContact CD1-CD1 3.97Å; L150-I154 HydrophobicContact CD1-CG1 4.18Å; L150-I154 HydrophobicContact CG-CD1 3.87Å; L150-I154 HydrophobicContact CG-CG1 4.46Å; L150-I154 WeakPolarHBondContact O-CG1 3.21Å; L150-I154 PolarHBondContact O-N 3.18Å; L150-L173 HydrophobicContact CD2-CB 4.1Å; L150-L173 HydrophobicContact CD2-CD2 4.27Å; L150-L173 HydrophobicContact CG-CD1 4.48Å; L150-V177 HydrophobicContact CD2-CG2 3.51Å; L150-L343 HydrophobicContact CB-CD1 4.32Å; L150-L343 HydrophobicContact CB-CD2 4.32Å; L150-L343 HydrophobicContact CD1-CD1 4.11Å |
| 151 | P | 89.4 | Confident | 87.4 | Confident | 12 Ų | 12 | 42.3 Ų | 42.3 | 8% | 0.078 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -55.4 | -42.5 | 173.1 | -27.1 | 36 | 0 | 0 | 0 | 113.2 | K147 V153 I154 G155 L168 L173 | K147-P151 WeakPolarHBondContact O-CD 3.12Å; K147-P151 WeakPolarHBondContact O-CG 3.4Å; P151-V153 VanDerWaalsContact C-N 3.35Å; P151-V153 PolarHBondContact O-N 3.03Å; P151-I154 PolarHBondContact O-N 3.1Å; P151-G155 PolarHBondContact O-N 3.29Å; P151-L168 VanDerWaalsContact CB-O 3.31Å; P151-L168 WeakPolarHBondContact CB-O 3.4Å; P151-L168 WeakPolarHBondContact CG-O 3.38Å; P151-L173 HydrophobicContact CB-CD1 4.28Å; P151-L173 HydrophobicContact CG-CD1 3.86Å |
| 152 | L | 86.3 | Confident | 85.9 | Confident | 16 Ų | 16 | 44.2 Ų | 44.2 | 8% | 0.084 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -64.5 | -42.4 | -178.1 | -58.5 | 177.5 | 0 | 0 | 0 | 111 | E149 L150 T156 P162 | E149-L152 WeakPolarHBondContact O-CB 3.13Å; E149-L152 PolarHBondContact O-N 3.24Å; L150-L152 VanDerWaalsContact C-N 3.28Å; L150-L152 PolarHBondContact O-N 3.43Å; L152-T156 PolarHBondContact O-N 2.82Å; L152-T156 PolarHBondContact O-OG1 2.97Å; L152-T156 VanDerWaalsContact O-OG1 3.04Å; L152-P162 HydrophobicContact CD2-CG 4.47Å |
| 153 | V | 88.9 | Confident | 84.2 | Confident | 4 Ų | 4 | 53.1 Ų | 53.1 | 2% | 0.024 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -63.3 | -48.4 | 177 | 173.8 | 0 | 0 | 0 | 0 | 110.9 | E149 L150 P151 T156 F157 L336 R339 L340 L343 | E149-V153 WeakPolarHBondContact O-CG2 3.03Å; E149-V153 PolarHBondContact O-N 2.93Å; E149-V153 VanDerWaalsContact O-N 3.15Å; L150-V153 PolarHBondContact O-N 2.96Å; P151-V153 VanDerWaalsContact C-N 3.35Å; P151-V153 PolarHBondContact O-N 3.03Å; V153-T156 PolarHBondContact O-N 3.43Å; V153-F157 HydrophobicContact CG1-CD2 3.74Å; V153-F157 HydrophobicContact CG1-CE2 3.65Å; V153-F157 WeakPolarHBondContact O-CD2 3.45Å; V153-F157 PolarHBondContact O-N 2.98Å; V153-L336 HydrophobicContact CB-CD1 4.29Å; V153-L336 HydrophobicContact CG1-CD1 4.07Å; V153-L336 HydrophobicContact CG2-CD1 4.16Å; V153-R339 HydrophobicContact CG2-CB 3.6Å; V153-R339 HydrophobicContact CG2-CG 4.49Å; V153-L340 HydrophobicContact CG1-CD2 3.58Å; V153-L340 HydrophobicContact CG1-CG 3.96Å; V153-L343 HydrophobicContact CB-CD1 4.43Å; V153-L343 HydrophobicContact CG2-CD1 3.82Å |
| 154 | I | 87.6 | Confident | 82.7 | Confident | 42 Ų | 42 | 56 Ų | 56 | 22% | 0.215 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -64.8 | -43.3 | -179.4 | -65.1 | 171.5 | 0 | 0 | 0 | 111 | L150 P151 T156 F157 L158 F167 L168 L173 | L150-I154 HydrophobicContact CD1-CD1 3.97Å; L150-I154 HydrophobicContact CD1-CG1 4.18Å; L150-I154 HydrophobicContact CG-CD1 3.87Å; L150-I154 HydrophobicContact CG-CG1 4.46Å; L150-I154 WeakPolarHBondContact O-CG1 3.21Å; L150-I154 PolarHBondContact O-N 3.18Å; P151-I154 PolarHBondContact O-N 3.1Å; I154-T156 PolarHBondContact O-N 3.43Å; I154-F157 PolarHBondContact O-N 3.46Å; I154-L158 HydrophobicContact CG2-CD1 3.62Å; I154-L158 HydrophobicContact CG2-CG 4.26Å; I154-L158 WeakPolarHBondContact O-CB 3.45Å; I154-L158 WeakPolarHBondContact O-CG 3.41Å; I154-L158 PolarHBondContact O-N 3.24Å; I154-F167 HydrophobicContact CG2-CE2 4.29Å; I154-L168 HydrophobicContact CB-CD2 4Å; I154-L168 HydrophobicContact CG2-CD2 3.79Å; I154-L173 HydrophobicContact CD1-CD1 4.01Å; I154-L173 HydrophobicContact CD1-CD2 3.61Å; I154-L173 HydrophobicContact CD1-CG 4.49Å |
| 155 | G | 84.4 | Confident | 81.7 | Confident | 4 Ų | 4 | 57.7 Ų | 57.7 | 4% | 0.041 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -58.7 | -45.9 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | P151 F157 L158 Y159 M160 | P151-G155 PolarHBondContact O-N 3.29Å; G155-F157 PolarHBondContact O-N 3.01Å; G155-L158 PolarHBondContact O-N 2.98Å; G155-Y159 PolarHBondContact O-N 3.01Å; G155-M160 CarbonylContact C-O 3.59Å; G155-M160 WeakPolarHBondContact CA-O 3.2Å; G155-M160 PolarHBondContact O-N 2.99Å; G155-M160 VanDerWaalsContact O-N 3.08Å |
| 156 | T | 84.9 | Confident | 80.9 | Confident | 38 Ų | 38 | 66.1 Ų | 66.1 | 23% | 0.233 | 33% | 0.332 | C | S | . | . | H | α-helix | trans | -63.6 | -39.9 | 176 | -58.7 | 0 | 0 | 0 | 0 | 112.4 | L152 V153 I154 Q330 L336 | L152-T156 PolarHBondContact O-N 2.82Å; L152-T156 PolarHBondContact O-OG1 2.97Å; L152-T156 VanDerWaalsContact O-OG1 3.04Å; V153-T156 PolarHBondContact O-N 3.43Å; I154-T156 PolarHBondContact O-N 3.43Å; T156-Q330 PolarHBondContact OG1-O 3.33Å; T156-L336 HydrophobicContact CG2-CD1 4.23Å; T156-L336 HydrophobicContact CG2-CD2 4.01Å |
| 157 | F | 84.6 | Confident | 80.1 | Confident | 114 Ų | 114 | 68.8 Ų | 68.8 | 50% | 0.5 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -68.9 | -34.8 | 178 | -86.8 | -65.8 | 0 | 0 | 0 | 113.7 | V153 I154 G155 L336 L340 | V153-F157 HydrophobicContact CG1-CD2 3.74Å; V153-F157 HydrophobicContact CG1-CE2 3.65Å; V153-F157 WeakPolarHBondContact O-CD2 3.45Å; V153-F157 PolarHBondContact O-N 2.98Å; I154-F157 PolarHBondContact O-N 3.46Å; G155-F157 PolarHBondContact O-N 3.01Å; F157-L336 HydrophobicContact CE1-CD2 4.31Å; F157-L336 HydrophobicContact CE2-CD1 4.23Å; F157-L336 HydrophobicContact CE2-CD2 4.1Å; F157-L336 HydrophobicContact CE2-CG 4.26Å; F157-L336 HydrophobicContact CZ-CD2 3.93Å; F157-L336 HydrophobicContact CZ-CG 4.39Å; F157-L340 HydrophobicContact CE2-CD1 3.85Å; F157-L340 HydrophobicContact CE2-CD2 4.37Å; F157-L340 HydrophobicContact CE2-CG 4.4Å; F157-L340 HydrophobicContact CZ-CD1 3.87Å |
| 158 | L | 83.7 | Confident | 79.4 | Confident | 90 Ų | 90 | 67.2 Ų | 67.2 | 47% | 0.471 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -88.5 | -4.7 | -179.1 | -64.7 | 177.1 | 0 | 0 | 0 | 113 | I154 G155 M160 F167 | I154-L158 HydrophobicContact CG2-CD1 3.62Å; I154-L158 HydrophobicContact CG2-CG 4.26Å; I154-L158 WeakPolarHBondContact O-CB 3.45Å; I154-L158 WeakPolarHBondContact O-CG 3.41Å; I154-L158 PolarHBondContact O-N 3.24Å; G155-L158 PolarHBondContact O-N 2.98Å; L158-M160 HydrophobicContact CB-CB 4.39Å; L158-M160 HydrophobicContact CB-CG 3.95Å; L158-M160 HydrophobicContact CB-SD 4.33Å; L158-M160 WeakPolarHBondContact O-CG 3.27Å; L158-M160 PolarHBondContact O-N 3.46Å; L158-F167 HydrophobicContact CD1-CE2 3.62Å; L158-F167 HydrophobicContact CD1-CZ 4.01Å |
| 159 | Y | 79 | Confident | 79.1 | Confident | 222 Ų | 222 | 72.2 Ų | 72.2 | 87% | 0.871 | 36% | 0.355 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 53.6 | 38.2 | -171.5 | -58.3 | -89.3 | 0 | 0 | 0 | 112.2 | G155 | G155-Y159 PolarHBondContact O-N 3.01Š|
| 160 | M | 74.4 | Confident | 78.6 | Confident | 86 Ų | 86 | 72.8 Ų | 72.8 | 42% | 0.424 | 36% | 0.361 | S | S | . | . | trans | -118.8 | 147.1 | -179.3 | -59.9 | -170.2 | 89.3 | 0 | 0 | 110.4 | G155 L158 D165 F167 | G155-M160 CarbonylContact C-O 3.59Å; G155-M160 WeakPolarHBondContact CA-O 3.2Å; G155-M160 PolarHBondContact O-N 2.99Å; G155-M160 VanDerWaalsContact O-N 3.08Å; L158-M160 HydrophobicContact CB-CB 4.39Å; L158-M160 HydrophobicContact CB-CG 3.95Å; L158-M160 HydrophobicContact CB-SD 4.33Å; L158-M160 WeakPolarHBondContact O-CG 3.27Å; L158-M160 PolarHBondContact O-N 3.46Å; M160-D165 VanDerWaalsContact CE-OD2 3.23Å; M160-D165 WeakPolarHBondContact CE-OD2 3.39Å; M160-F167 HydrophobicContact SD-CZ 4.2Å | ||
| 161 | D | 68.6 | Low | 78.5 | Confident | 135 Ų | 135 | 74.9 Ų | 74.9 | 72% | 0.722 | 37% | 0.372 | S | S | * | . | trans | -65.8 | 126.4 | 174.6 | -73.5 | -36.5 | 0 | 0 | 0 | 109.8 | E163 G164 | D161-E163 PolarHBondContact O-N 3.36Å; D161-G164 PolarHBondContact O-N 3.31Å; D161-G164 VanDerWaalsContact O-N 3.15Å | ||
| 162 | P | 61.5 | Low | 78.4 | Confident | 41 Ų | 41 | 77 Ų | 77 | 27% | 0.266 | 38% | 0.382 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -61.2 | -12.9 | -177.2 | 21.3 | -30.2 | 0 | 0 | 0 | 114 | L152 L168 | L152-P162 HydrophobicContact CD2-CG 4.47Å; P162-L168 VanDerWaalsContact O-CB 3.32Å; P162-L168 WeakPolarHBondContact O-CB 3.32Å |
| 163 | E | 59.7 | Low | 78.5 | Confident | 191 Ų | 191 | 76.9 Ų | 76.9 | 89% | 0.893 | 38% | 0.382 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.8 | -16.6 | -178.9 | -60 | -169.2 | 167.9 | 0 | 0 | 114.3 | D161 | D161-E163 PolarHBondContact O-N 3.36Š|
| 164 | G | 61.5 | Low | 78.7 | Confident | 62 Ų | 62 | 76.7 Ų | 76.7 | 64% | 0.639 | 38% | 0.38 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.8 | -36.5 | -166.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | D161 | D161-G164 PolarHBondContact O-N 3.31Å; D161-G164 VanDerWaalsContact O-N 3.15Å |
| 165 | D | 72.3 | Confident | 78.9 | Confident | 54 Ų | 54 | 78.3 Ų | 78.3 | 29% | 0.289 | 39% | 0.389 | S | S | . | . | trans | -116.3 | 146.3 | -165.5 | -71.4 | -42.9 | 0 | 0 | 0 | 114.9 | M160 F167 L168 | M160-D165 VanDerWaalsContact CE-OD2 3.23Å; M160-D165 WeakPolarHBondContact CE-OD2 3.39Å; D165-F167 HydrophobicContact CB-CD1 3.56Å; D165-F167 HydrophobicContact CB-CE1 3.24Å; D165-F167 HydrophobicContact CB-CG 4.4Å; D165-F167 HydrophobicContact CB-CZ 3.84Å; D165-F167 PolarHBondContact O-N 3.49Å; D165-F167 VanDerWaalsContact O-N 3.13Å; D165-F167 WeakPolarHBondContact OD2-CE1 3.23Å; D165-L168 HydrophobicContact CB-CD1 4.1Å; D165-L168 PolarHBondContact O-N 3.28Å | ||
| 166 | W | 75.6 | Confident | 79.2 | Confident | 178 Ų | 178 | 81.4 Ų | 81.4 | 67% | 0.674 | 40% | 0.404 | S | S | * | . | G | 310 helix | trans | -58.2 | -29.2 | -178.5 | 68 | -85.1 | 0 | 0 | 0 | 113.6 | L172 | W166-L172 HydrophobicContact CE3-CD2 3.41Å; W166-L172 VanDerWaalsContact CE3-CD2 3.41Å; W166-L172 HydrophobicContact CZ3-CD2 3.54Å; W166-L172 WeakPolarHBondContact O-CD2 3.23Å |
| 167 | F | 75.4 | Confident | 79.5 | Confident | 58 Ų | 58 | 80.4 Ų | 80.4 | 25% | 0.254 | 40% | 0.397 | S | S | . | . | G | 310 helix | trans | -81.4 | -14.5 | -179.5 | 69.1 | -95.2 | 0 | 0 | 0 | 113.5 | I154 L158 M160 D165 L173 | I154-F167 HydrophobicContact CG2-CE2 4.29Å; L158-F167 HydrophobicContact CD1-CE2 3.62Å; L158-F167 HydrophobicContact CD1-CZ 4.01Å; M160-F167 HydrophobicContact SD-CZ 4.2Å; D165-F167 HydrophobicContact CB-CD1 3.56Å; D165-F167 HydrophobicContact CB-CE1 3.24Å; D165-F167 HydrophobicContact CB-CG 4.4Å; D165-F167 HydrophobicContact CB-CZ 3.84Å; D165-F167 PolarHBondContact O-N 3.49Å; D165-F167 VanDerWaalsContact O-N 3.13Å; D165-F167 WeakPolarHBondContact OD2-CE1 3.23Å; F167-L173 WeakPolarHBondContact O-CD1 3.25Å; F167-L173 VanDerWaalsContact O-CG 3.23Å; F167-L173 WeakPolarHBondContact O-CG 3.47Å |
| 168 | L | 77.3 | Confident | 79.9 | Confident | 4 Ų | 4 | 75 Ų | 75 | 2% | 0.021 | 37% | 0.374 | C | S | . | . | G | 310 helix | trans | -88.2 | -5.3 | 174.5 | -72.4 | 154.8 | 0 | 0 | 0 | 112.2 | P151 I154 P162 D165 G170 | P151-L168 VanDerWaalsContact CB-O 3.31Å; P151-L168 WeakPolarHBondContact CB-O 3.4Å; P151-L168 WeakPolarHBondContact CG-O 3.38Å; I154-L168 HydrophobicContact CB-CD2 4Å; I154-L168 HydrophobicContact CG2-CD2 3.79Å; P162-L168 VanDerWaalsContact O-CB 3.32Å; P162-L168 WeakPolarHBondContact O-CB 3.32Å; D165-L168 HydrophobicContact CB-CD1 4.1Å; D165-L168 PolarHBondContact O-N 3.28Å; L168-G170 PolarHBondContact O-N 3.02Å; L168-G170 VanDerWaalsContact O-N 3.08Å |
| 169 | K | 83.5 | Confident | 80.3 | Confident | 136 Ų | 136 | 74.4 Ų | 74.4 | 59% | 0.591 | 37% | 0.374 | S | S | * | . | trans | -63.7 | 113.8 | 174.5 | -67.4 | -178.3 | 178.8 | 178.1 | 0 | 110.2 | N171 L172 L173 | K169-N171 PolarHBondContact O-N 2.89Å; K169-N171 VanDerWaalsContact O-N 3.11Å; K169-L172 HydrophobicContact CB-CB 4.37Å; K169-L172 WeakPolarHBondContact O-CB 3.26Å; K169-L172 PolarHBondContact O-N 3.15Å; K169-L173 PolarHBondContact O-N 3.07Å; K169-L173 VanDerWaalsContact O-N 3.09Å | ||
| 170 | G | 81.9 | Confident | 80.9 | Confident | 13 Ų | 13 | 69.6 Ų | 69.6 | 13% | 0.134 | 36% | 0.363 | C | S | . | . | H | α-helix | trans | -52.5 | -36.1 | 179.1 | 0 | 0 | 0 | 0 | 0 | 114 | K147 L168 L172 L173 I174 | K147-G170 WeakPolarHBondContact O-CA 3.28Å; L168-G170 PolarHBondContact O-N 3.02Å; L168-G170 VanDerWaalsContact O-N 3.08Å; G170-L172 VanDerWaalsContact C-N 3.27Å; G170-L172 PolarHBondContact O-N 2.89Å; G170-L173 PolarHBondContact O-N 2.77Å; G170-I174 WeakPolarHBondContact O-CB 3.48Å; G170-I174 WeakPolarHBondContact O-CG2 3.3Å; G170-I174 PolarHBondContact O-N 2.65Å |
| 171 | N | 87.9 | Confident | 81.7 | Confident | 72 Ų | 72 | 69.2 Ų | 69.2 | 39% | 0.385 | 36% | 0.361 | S | S | . | . | H | α-helix | trans | -64.2 | -26.4 | 176.2 | -68.1 | -16.2 | 0 | 0 | 0 | 114 | K147 K169 I174 I175 I392 | K147-N171 WeakPolarHBondContact CE-OD1 3.41Å; K147-N171 PolarHBondContact NZ-OD1 3.43Å; K169-N171 PolarHBondContact O-N 2.89Å; K169-N171 VanDerWaalsContact O-N 3.11Å; N171-I174 WeakPolarHBondContact O-CG2 3.37Å; N171-I175 WeakPolarHBondContact O-CD1 3.5Å; N171-I175 WeakPolarHBondContact O-CG1 3.33Å; N171-I392 HydrophobicContact CB-CG1 4.48Å |
| 172 | L | 88.4 | Confident | 82.8 | Confident | 56 Ų | 56 | 62.8 Ų | 62.8 | 29% | 0.293 | 33% | 0.327 | S | S | . | . | H | α-helix | trans | -87.5 | -44.5 | 175.5 | 178 | 66.9 | 0 | 0 | 0 | 110.6 | W166 K169 G170 I174 I175 I176 | W166-L172 HydrophobicContact CE3-CD2 3.41Å; W166-L172 VanDerWaalsContact CE3-CD2 3.41Å; W166-L172 HydrophobicContact CZ3-CD2 3.54Å; W166-L172 WeakPolarHBondContact O-CD2 3.23Å; K169-L172 HydrophobicContact CB-CB 4.37Å; K169-L172 WeakPolarHBondContact O-CB 3.26Å; K169-L172 PolarHBondContact O-N 3.15Å; G170-L172 VanDerWaalsContact C-N 3.27Å; G170-L172 PolarHBondContact O-N 2.89Å; L172-I174 VanDerWaalsContact C-N 3.3Å; L172-I174 PolarHBondContact O-N 3.43Å; L172-I175 WeakPolarHBondContact O-CB 3.48Å; L172-I175 PolarHBondContact O-N 2.87Å; L172-I176 HydrophobicContact CD1-CD1 4.43Å; L172-I176 HydrophobicContact CD2-CD1 4.42Å; L172-I176 HydrophobicContact CG-CD1 3.96Å; L172-I176 HydrophobicContact CG-CG1 4.49Å; L172-I176 WeakPolarHBondContact O-CG1 3.26Å; L172-I176 PolarHBondContact O-N 3.21Å |
| 173 | L | 88.3 | Confident | 84.1 | Confident | 14 Ų | 14 | 62.1 Ų | 62.1 | 7% | 0.073 | 32% | 0.321 | C | S | . | . | H | α-helix | trans | -58.4 | -41.2 | 180 | -80.6 | 165.8 | 0 | 0 | 0 | 112.4 | L150 P151 I154 F167 K169 G170 I175 I176 V177 | L150-L173 HydrophobicContact CD2-CB 4.1Å; L150-L173 HydrophobicContact CD2-CD2 4.27Å; L150-L173 HydrophobicContact CG-CD1 4.48Å; P151-L173 HydrophobicContact CB-CD1 4.28Å; P151-L173 HydrophobicContact CG-CD1 3.86Å; I154-L173 HydrophobicContact CD1-CD1 4.01Å; I154-L173 HydrophobicContact CD1-CD2 3.61Å; I154-L173 HydrophobicContact CD1-CG 4.49Å; F167-L173 WeakPolarHBondContact O-CD1 3.25Å; F167-L173 VanDerWaalsContact O-CG 3.23Å; F167-L173 WeakPolarHBondContact O-CG 3.47Å; K169-L173 PolarHBondContact O-N 3.07Å; K169-L173 VanDerWaalsContact O-N 3.09Å; G170-L173 PolarHBondContact O-N 2.77Å; L173-I175 VanDerWaalsContact C-N 3.28Å; L173-I175 PolarHBondContact O-N 3.48Å; L173-I176 PolarHBondContact O-N 3.29Å; L173-V177 WeakPolarHBondContact O-CG2 3.32Å; L173-V177 PolarHBondContact O-N 3.01Å |
| 174 | I | 92.2 | Very high | 85.6 | Confident | 0 Ų | 0 | 56.2 Ų | 56.2 | 0% | 0 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -58.9 | -38.8 | 175.3 | -164.5 | -176.3 | 0 | 0 | 0 | 112.3 | L143 K147 G170 N171 L172 S178 V391 | L143-I174 HydrophobicContact CB-CD1 3.8Å; L143-I174 HydrophobicContact CB-CG1 4.35Å; L143-I174 HydrophobicContact CD1-CD1 4.42Å; L143-I174 HydrophobicContact CD2-CG1 4.49Å; L143-I174 WeakPolarHBondContact O-CD1 3.47Å; K147-I174 HydrophobicContact CB-CB 4.4Å; K147-I174 HydrophobicContact CB-CD1 4.08Å; G170-I174 WeakPolarHBondContact O-CB 3.48Å; G170-I174 WeakPolarHBondContact O-CG2 3.3Å; G170-I174 PolarHBondContact O-N 2.65Å; N171-I174 WeakPolarHBondContact O-CG2 3.37Å; L172-I174 VanDerWaalsContact C-N 3.3Å; L172-I174 PolarHBondContact O-N 3.43Å; I174-S178 WeakPolarHBondContact O-CB 3.36Å; I174-S178 PolarHBondContact O-N 3.26Å; I174-S178 PolarHBondContact O-OG 3.49Å; I174-V391 HydrophobicContact CD1-CB 4.06Å; I174-V391 HydrophobicContact CD1-CG1 3.53Å |
| 175 | I | 91.8 | Very high | 86.8 | Confident | 76 Ų | 76 | 55.5 Ų | 55.5 | 39% | 0.39 | 28% | 0.281 | S | S | . | . | H | α-helix | trans | -68.8 | -44.7 | 178.2 | -63 | 171.5 | 0 | 0 | 0 | 109.4 | N171 L172 L173 S178 V179 I392 | N171-I175 WeakPolarHBondContact O-CD1 3.5Å; N171-I175 WeakPolarHBondContact O-CG1 3.33Å; L172-I175 WeakPolarHBondContact O-CB 3.48Å; L172-I175 PolarHBondContact O-N 2.87Å; L173-I175 VanDerWaalsContact C-N 3.28Å; L173-I175 PolarHBondContact O-N 3.48Å; I175-S178 PolarHBondContact O-N 3.41Å; I175-V179 HydrophobicContact CG2-CG2 4.45Å; I175-V179 WeakPolarHBondContact O-CG2 3.47Å; I175-V179 PolarHBondContact O-N 3.08Å; I175-I392 HydrophobicContact CD1-CD1 4.37Å |
| 176 | I | 91.7 | Very high | 87.4 | Confident | 69 Ų | 69 | 53.1 Ų | 53.1 | 35% | 0.354 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -60 | -51.6 | 178.4 | -66.5 | 171.5 | 0 | 0 | 0 | 110.5 | L172 L173 S178 V179 L180 | L172-I176 HydrophobicContact CD1-CD1 4.43Å; L172-I176 HydrophobicContact CD2-CD1 4.42Å; L172-I176 HydrophobicContact CG-CD1 3.96Å; L172-I176 HydrophobicContact CG-CG1 4.49Å; L172-I176 WeakPolarHBondContact O-CG1 3.26Å; L172-I176 PolarHBondContact O-N 3.21Å; L173-I176 PolarHBondContact O-N 3.29Å; I176-S178 VanDerWaalsContact C-N 3.31Å; I176-S178 PolarHBondContact O-N 3.45Å; I176-V179 PolarHBondContact O-N 3.05Å; I176-L180 HydrophobicContact CG2-CD1 3.65Å; I176-L180 HydrophobicContact CG2-CG 4.31Å; I176-L180 VanDerWaalsContact O-CB 3.31Å; I176-L180 WeakPolarHBondContact O-CB 3.1Å; I176-L180 WeakPolarHBondContact O-CG 2.84Å; I176-L180 PolarHBondContact O-N 3.46Å |
| 177 | V | 91.3 | Very high | 87.9 | Confident | 17 Ų | 17 | 46.5 Ų | 46.5 | 10% | 0.103 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -62.2 | -40.9 | 178 | 171.3 | 0 | 0 | 0 | 0 | 111.2 | I146 L150 L173 V179 I181 I182 | I146-V177 HydrophobicContact CD1-CG1 4.37Å; I146-V177 HydrophobicContact CG2-CB 4.4Å; I146-V177 HydrophobicContact CG2-CG1 4.28Å; I146-V177 HydrophobicContact CG2-CG2 4.42Å; L150-V177 HydrophobicContact CD2-CG2 3.51Å; L173-V177 WeakPolarHBondContact O-CG2 3.32Å; L173-V177 PolarHBondContact O-N 3.01Å; V177-V179 PolarHBondContact O-N 2.7Å; V177-I181 HydrophobicContact CG1-CB 4.46Å; V177-I181 HydrophobicContact CG1-CD1 4.35Å; V177-I181 WeakPolarHBondContact O-CA 3.36Å; V177-I181 WeakPolarHBondContact O-CB 3.17Å; V177-I181 PolarHBondContact O-N 3.33Å; V177-I182 HydrophobicContact CG1-CD1 4.18Å; V177-I182 HydrophobicContact CG1-CG1 4.28Å; V177-I182 PolarHBondContact O-N 3.12Å |
| 178 | S | 91.6 | Very high | 88.2 | Confident | 2 Ų | 2 | 47.9 Ų | 47.9 | 1% | 0.014 | 26% | 0.255 | C | S | . | . | I | π-helix | trans | -59.3 | -46.7 | 177.5 | -71.1 | 0 | 0 | 0 | 0 | 111.9 | I174 I175 I176 I182 L183 L384 N388 | I174-S178 WeakPolarHBondContact O-CB 3.36Å; I174-S178 PolarHBondContact O-N 3.26Å; I174-S178 PolarHBondContact O-OG 3.49Å; I175-S178 PolarHBondContact O-N 3.41Å; I176-S178 VanDerWaalsContact C-N 3.31Å; I176-S178 PolarHBondContact O-N 3.45Å; S178-I182 PolarHBondContact O-N 3.41Å; S178-L183 VanDerWaalsContact O-CB 3.31Å; S178-L183 WeakPolarHBondContact O-CB 3.46Å; S178-L183 PolarHBondContact O-N 2.96Å; S178-L384 WeakPolarHBondContact O-CD2 3.41Å; S178-N388 PolarHBondContact OG-ND2 3.37Å; S178-N388 PolarHBondContact OG-OD1 3.19Å |
| 179 | V | 91.8 | Very high | 87.6 | Confident | 77 Ų | 77 | 52.7 Ų | 52.7 | 47% | 0.467 | 28% | 0.275 | S | S | . | . | I | π-helix | trans | -77.2 | -41.3 | -177 | 174.4 | 0 | 0 | 0 | 0 | 112.3 | I175 I176 V177 P184 | I175-V179 HydrophobicContact CG2-CG2 4.45Å; I175-V179 WeakPolarHBondContact O-CG2 3.47Å; I175-V179 PolarHBondContact O-N 3.08Å; I176-V179 PolarHBondContact O-N 3.05Å; V177-V179 PolarHBondContact O-N 2.7Å; V179-P184 VanDerWaalsContact O-CD 3.31Å; V179-P184 WeakPolarHBondContact O-CD 3.43Å |
| 180 | L | 92.1 | Very high | 86.5 | Confident | 120 Ų | 120 | 52.6 Ų | 52.6 | 63% | 0.628 | 28% | 0.277 | S | S | * | . | I | π-helix | trans | -86.6 | -29.1 | -172.3 | -63.8 | -176.1 | 0 | 0 | 0 | 114 | I176 P184 | I176-L180 HydrophobicContact CG2-CD1 3.65Å; I176-L180 HydrophobicContact CG2-CG 4.31Å; I176-L180 VanDerWaalsContact O-CB 3.31Å; I176-L180 WeakPolarHBondContact O-CB 3.1Å; I176-L180 WeakPolarHBondContact O-CG 2.84Å; I176-L180 PolarHBondContact O-N 3.46Å; L180-P184 WeakPolarHBondContact O-CG 3.17Å |
| 181 | I | 90.9 | Very high | 85.5 | Confident | 78 Ų | 78 | 53.3 Ų | 53.3 | 40% | 0.4 | 28% | 0.277 | S | S | . | . | I | π-helix | trans | -116.1 | -58.7 | -174.1 | -54.1 | 179.3 | 0 | 0 | 0 | 109.9 | V177 L183 P184 L185 T347 | V177-I181 HydrophobicContact CG1-CB 4.46Å; V177-I181 HydrophobicContact CG1-CD1 4.35Å; V177-I181 WeakPolarHBondContact O-CA 3.36Å; V177-I181 WeakPolarHBondContact O-CB 3.17Å; V177-I181 PolarHBondContact O-N 3.33Å; I181-L183 PolarHBondContact O-N 3.08Å; I181-P184 WeakPolarHBondContact O-CD 3.3Å; I181-L185 HydrophobicContact CG2-CD1 4.46Å; I181-L185 WeakPolarHBondContact O-CD1 3.18Å; I181-L185 PolarHBondContact O-N 3.36Å; I181-T347 HydrophobicContact CG2-CG2 3.69Å |
| 182 | I | 91.1 | Very high | 84.1 | Confident | 0 Ų | 0 | 53 Ų | 53 | 0% | 0 | 29% | 0.29 | C | S | . | . | I | π-helix | trans | -67.9 | -44.4 | -170.6 | -59.7 | 177.4 | 0 | 0 | 0 | 111.4 | L143 I146 V177 S178 L185 A186 T347 V350 L384 | L143-I182 HydrophobicContact CD2-CD1 3.43Å; L143-I182 VanDerWaalsContact CD2-CD1 3.43Å; I146-I182 HydrophobicContact CD1-CD1 4.23Å; V177-I182 HydrophobicContact CG1-CD1 4.18Å; V177-I182 HydrophobicContact CG1-CG1 4.28Å; V177-I182 PolarHBondContact O-N 3.12Å; S178-I182 PolarHBondContact O-N 3.41Å; I182-L185 PolarHBondContact O-N 2.78Å; I182-A186 WeakPolarHBondContact O-CB 3.39Å; I182-A186 PolarHBondContact O-N 3.29Å; I182-T347 HydrophobicContact CG1-CG2 4.2Å; I182-V350 HydrophobicContact CD1-CB 4.45Å; I182-V350 HydrophobicContact CD1-CG1 4.3Å; I182-V350 HydrophobicContact CD1-CG2 4.48Å; I182-V350 HydrophobicContact CG2-CB 4.2Å; I182-V350 HydrophobicContact CG2-CG1 3.51Å; I182-L384 HydrophobicContact CG2-CD1 4.04Å |
| 183 | L | 90.6 | Very high | 82.9 | Confident | 27 Ų | 27 | 58.3 Ų | 58.3 | 14% | 0.141 | 31% | 0.308 | C | S | . | . | H | α-helix | trans | -62.2 | -51.2 | -178.1 | 177.4 | 67.2 | 0 | 0 | 0 | 112.1 | S178 I181 L185 A186 L187 L381 L384 | S178-L183 VanDerWaalsContact O-CB 3.31Å; S178-L183 WeakPolarHBondContact O-CB 3.46Å; S178-L183 PolarHBondContact O-N 2.96Å; I181-L183 PolarHBondContact O-N 3.08Å; L183-L185 VanDerWaalsContact C-N 3.29Å; L183-L185 PolarHBondContact O-N 3.29Å; L183-A186 PolarHBondContact O-N 3.22Å; L183-A186 VanDerWaalsContact O-N 3.17Å; L183-L187 HydrophobicContact CD1-CD1 4.16Å; L183-L187 HydrophobicContact CD1-CD2 4.39Å; L183-L187 HydrophobicContact CD1-CG 4.09Å; L183-L187 HydrophobicContact CG-CD1 4.17Å; L183-L187 HydrophobicContact CG-CG 4.46Å; L183-L187 VanDerWaalsContact O-CG 3.27Å; L183-L187 WeakPolarHBondContact O-CG 3.42Å; L183-L187 PolarHBondContact O-N 2.9Å; L183-L381 HydrophobicContact CD2-CD1 4.32Å; L183-L384 HydrophobicContact CB-CD2 3.82Å; L183-L384 HydrophobicContact CD1-CD2 4.26Å |
| 184 | P | 89.9 | Confident | 81.8 | Confident | 67 Ų | 67 | 58.6 Ų | 58.6 | 44% | 0.435 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -54.8 | -43.7 | 174.1 | -28.4 | 35.3 | 0 | 0 | 0 | 113.1 | V179 L180 I181 L187 | V179-P184 VanDerWaalsContact O-CD 3.31Å; V179-P184 WeakPolarHBondContact O-CD 3.43Å; L180-P184 WeakPolarHBondContact O-CG 3.17Å; I181-P184 WeakPolarHBondContact O-CD 3.3Å; P184-L187 PolarHBondContact O-N 2.84Å |
| 185 | L | 87.3 | Confident | 80.8 | Confident | 48 Ų | 48 | 58.8 Ų | 58.8 | 25% | 0.251 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -65.7 | -40.4 | 178.5 | -90.4 | 65.8 | 0 | 0 | 0 | 111.8 | I181 I182 L183 L187 M188 L348 P351 | I181-L185 HydrophobicContact CG2-CD1 4.46Å; I181-L185 WeakPolarHBondContact O-CD1 3.18Å; I181-L185 PolarHBondContact O-N 3.36Å; I182-L185 PolarHBondContact O-N 2.78Å; L183-L185 VanDerWaalsContact C-N 3.29Å; L183-L185 PolarHBondContact O-N 3.29Å; L185-L187 VanDerWaalsContact C-N 3.31Å; L185-L187 PolarHBondContact O-N 3.2Å; L185-M188 HydrophobicContact CB-CE 4.36Å; L185-M188 HydrophobicContact CG-CE 4.24Å; L185-M188 WeakPolarHBondContact O-CB 3.18Å; L185-M188 WeakPolarHBondContact O-CE 3.41Å; L185-M188 WeakPolarHBondContact O-CG 3.26Å; L185-M188 PolarHBondContact O-N 2.87Å; L185-L348 HydrophobicContact CD2-CD2 4.21Å; L185-P351 HydrophobicContact CB-CB 4.22Å; L185-P351 HydrophobicContact CB-CG 3.62Å; L185-P351 HydrophobicContact CD2-CG 4.17Å |
| 186 | A | 84.9 | Confident | 80.2 | Confident | 4 Ų | 4 | 62.9 Ų | 62.9 | 3% | 0.033 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -68.2 | -28.2 | 178.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | I182 L183 M188 L354 R358 | I182-A186 WeakPolarHBondContact O-CB 3.39Å; I182-A186 PolarHBondContact O-N 3.29Å; L183-A186 PolarHBondContact O-N 3.22Å; L183-A186 VanDerWaalsContact O-N 3.17Å; A186-M188 PolarHBondContact O-N 2.72Å; A186-L354 HydrophobicContact CB-CD1 3.93Å; A186-L354 HydrophobicContact CB-CD2 4.13Å; A186-R358 PolarHBondContact O-NH1 2.9Å |
| 187 | L | 86.4 | Confident | 79.9 | Confident | 38 Ų | 38 | 61.7 Ų | 61.7 | 20% | 0.199 | 32% | 0.319 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -77.9 | -5.4 | 177.5 | -67.9 | 180 | 0 | 0 | 0 | 113.7 | L183 P184 L185 K189 V377 A380 | L183-L187 HydrophobicContact CD1-CD1 4.16Å; L183-L187 HydrophobicContact CD1-CD2 4.39Å; L183-L187 HydrophobicContact CD1-CG 4.09Å; L183-L187 HydrophobicContact CG-CD1 4.17Å; L183-L187 HydrophobicContact CG-CG 4.46Å; L183-L187 VanDerWaalsContact O-CG 3.27Å; L183-L187 WeakPolarHBondContact O-CG 3.42Å; L183-L187 PolarHBondContact O-N 2.9Å; P184-L187 PolarHBondContact O-N 2.84Å; L185-L187 VanDerWaalsContact C-N 3.31Å; L185-L187 PolarHBondContact O-N 3.2Å; L187-K189 PolarHBondContact O-N 3.4Å; L187-V377 HydrophobicContact CD1-CG2 4.38Å; L187-V377 HydrophobicContact CD2-CB 4.14Å; L187-V377 HydrophobicContact CD2-CG1 4.29Å; L187-V377 HydrophobicContact CD2-CG2 3.82Å; L187-A380 HydrophobicContact CD2-CB 3.92Å |
| 188 | M | 80.5 | Confident | 79.7 | Confident | 88 Ų | 88 | 60.9 Ų | 60.9 | 43% | 0.433 | 31% | 0.314 | S | S | . | . | trans | -63 | 127 | 174.9 | -66.3 | -164.8 | -67.8 | 0 | 0 | 111 | L185 A186 L191 | L185-M188 HydrophobicContact CB-CE 4.36Å; L185-M188 HydrophobicContact CG-CE 4.24Å; L185-M188 WeakPolarHBondContact O-CB 3.18Å; L185-M188 WeakPolarHBondContact O-CE 3.41Å; L185-M188 WeakPolarHBondContact O-CG 3.26Å; L185-M188 PolarHBondContact O-N 2.87Å; A186-M188 PolarHBondContact O-N 2.72Å; M188-L191 HydrophobicContact CE-CD2 4.4Å | ||
| 189 | K | 65.6 | Low | 79.6 | Confident | 104 Ų | 104 | 61.5 Ų | 61.5 | 45% | 0.452 | 32% | 0.321 | S | S | . | . | S | Bend | trans | -72.5 | -34.4 | -174.9 | -172.4 | -177.9 | 176.4 | -170.7 | 0 | 112.9 | L187 F371 | L187-K189 PolarHBondContact O-N 3.4Å; K189-F371 HydrophobicContact CD-CZ 4.48Å |
| 190 | H | 61.1 | Low | 79.5 | Confident | 135 Ų | 135 | 61.8 Ų | 61.8 | 63% | 0.625 | 32% | 0.32 | S | S | * | . | trans | -126.5 | 111.3 | -177.8 | -60.9 | -70.2 | 0 | 0 | 0 | 108.3 | G192 | H190-G192 PolarHBondContact O-N 2.85Š| ||
| 191 | L | 60.1 | Low | 79.5 | Confident | 28 Ų | 28 | 56.1 Ų | 56.1 | 15% | 0.147 | 29% | 0.29 | C | S | . | . | trans | -78 | 40.3 | 169.3 | -70.5 | 166.1 | 0 | 0 | 0 | 110.2 | M188 Y193 L194 F355 | M188-L191 HydrophobicContact CE-CD2 4.4Å; L191-Y193 PolarHBondContact O-N 3.22Å; L191-L194 HydrophobicContact CB-CB 4.11Å; L191-L194 HydrophobicContact CB-CD1 4.16Å; L191-L194 HydrophobicContact CB-CD2 4.44Å; L191-L194 HydrophobicContact CD1-CD1 4.15Å; L191-L194 HydrophobicContact CD2-CD1 4.11Å; L191-L194 HydrophobicContact CG-CD1 4.37Å; L191-L194 WeakPolarHBondContact O-CB 3.44Å; L191-L194 PolarHBondContact O-N 3.22Å; L191-F355 HydrophobicContact CD1-CB 3.76Å; L191-F355 HydrophobicContact CD1-CD2 3.78Å; L191-F355 HydrophobicContact CD1-CG 3.89Å | ||
| 192 | G | 57.7 | Low | 79.5 | Confident | 64 Ų | 64 | 53 Ų | 53 | 66% | 0.66 | 27% | 0.274 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -60.3 | -9.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.7 | H190 | H190-G192 PolarHBondContact O-N 2.85Š|
| 193 | Y | 64.6 | Low | 79.6 | Confident | 169 Ų | 169 | 57.1 Ų | 57.1 | 66% | 0.663 | 30% | 0.299 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -103.3 | 5.7 | 175.3 | -59 | -78.6 | 0 | 0 | 0 | 113.9 | L191 G195 Y196 T197 | L191-Y193 PolarHBondContact O-N 3.22Å; Y193-G195 PolarHBondContact O-N 2.82Å; Y193-Y196 HydrophobicContact CD1-CD2 4.18Å; Y193-Y196 PolarHBondContact O-N 2.98Å; Y193-T197 PolarHBondContact O-N 2.78Å; Y193-T197 VanDerWaalsContact O-N 3.16Å |
| 194 | L | 64.2 | Low | 79.7 | Confident | 20 Ų | 20 | 56.5 Ų | 56.5 | 11% | 0.105 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -56.3 | -37.4 | -173.7 | -160.3 | 59.8 | 0 | 0 | 0 | 113.1 | N56 L191 Y196 T197 S198 V352 | N56-L194 VanDerWaalsContact OD1-C 3.25Å; N56-L194 PolarHBondContact OD1-O 3.01Å; L191-L194 HydrophobicContact CB-CB 4.11Å; L191-L194 HydrophobicContact CB-CD1 4.16Å; L191-L194 HydrophobicContact CB-CD2 4.44Å; L191-L194 HydrophobicContact CD1-CD1 4.15Å; L191-L194 HydrophobicContact CD2-CD1 4.11Å; L191-L194 HydrophobicContact CG-CD1 4.37Å; L191-L194 WeakPolarHBondContact O-CB 3.44Å; L191-L194 PolarHBondContact O-N 3.22Å; L194-Y196 VanDerWaalsContact C-N 3.31Å; L194-Y196 PolarHBondContact O-N 3.42Å; L194-T197 PolarHBondContact O-OG1 3.44Å; L194-T197 VanDerWaalsContact O-OG1 3.04Å; L194-S198 WeakPolarHBondContact O-CB 3.31Å; L194-S198 PolarHBondContact O-N 3.4Å; L194-S198 PolarHBondContact O-OG 2.89Å; L194-V352 HydrophobicContact CD1-CB 3.95Å; L194-V352 HydrophobicContact CD1-CG1 3.76Å; L194-V352 HydrophobicContact CD1-CG2 3.26Å; L194-V352 HydrophobicContact CD2-CG1 3.95Å; L194-V352 HydrophobicContact CG-CG1 4.21Å; L194-V352 HydrophobicContact CG-CG2 4.39Å |
| 195 | G | 71.1 | Confident | 79.8 | Confident | 4 Ų | 4 | 53.5 Ų | 53.5 | 4% | 0.041 | 28% | 0.277 | C | S | . | . | H | α-helix | trans | -66.7 | -32.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.1 | M52 N56 Y193 G199 | M52-G195 VanDerWaalsContact CE-C 3.45Å; M52-G195 VanDerWaalsContact CE-CA 3.41Å; N56-G195 WeakPolarHBondContact OD1-CA 3.15Å; N56-G195 PolarHBondContact OD1-N 2.91Å; Y193-G195 PolarHBondContact O-N 2.82Å; G195-G199 PolarHBondContact O-N 3.22Å |
| 196 | Y | 80.8 | Confident | 80.2 | Confident | 162 Ų | 162 | 55.2 Ų | 55.2 | 64% | 0.635 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -74.6 | -44.3 | 177.9 | -63.2 | -73.8 | 0 | 0 | 0 | 111 | M52 Y193 L194 S198 G199 L200 | M52-Y196 HydrophobicContact CE-CD1 4.07Å; M52-Y196 HydrophobicContact CE-CD2 3.78Å; M52-Y196 HydrophobicContact CE-CE1 4.04Å; M52-Y196 HydrophobicContact CE-CE2 3.74Å; M52-Y196 HydrophobicContact CE-CG 3.95Å; Y193-Y196 HydrophobicContact CD1-CD2 4.18Å; Y193-Y196 PolarHBondContact O-N 2.98Å; L194-Y196 VanDerWaalsContact C-N 3.31Å; L194-Y196 PolarHBondContact O-N 3.42Å; Y196-S198 VanDerWaalsContact C-N 3.33Å; Y196-S198 PolarHBondContact O-N 3.27Å; Y196-G199 PolarHBondContact O-N 3.34Å; Y196-L200 PolarHBondContact O-N 2.87Å |
| 197 | T | 84.4 | Confident | 80.7 | Confident | 43 Ų | 43 | 58.7 Ų | 58.7 | 26% | 0.264 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -66.4 | -36.8 | 176.1 | 57.8 | 0 | 0 | 0 | 0 | 111.6 | Y193 L194 L200 S201 | Y193-T197 PolarHBondContact O-N 2.78Å; Y193-T197 VanDerWaalsContact O-N 3.16Å; L194-T197 PolarHBondContact O-OG1 3.44Å; L194-T197 VanDerWaalsContact O-OG1 3.04Å; T197-L200 PolarHBondContact O-N 3Å; T197-S201 WeakPolarHBondContact O-CB 3.35Å; T197-S201 PolarHBondContact O-N 3.37Å |
| 198 | S | 86.5 | Confident | 81 | Confident | 0 Ų | 0 | 56.9 Ų | 56.9 | 0% | 0 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -67.2 | -39.9 | 174.4 | -61.5 | 0 | 0 | 0 | 0 | 112 | N56 L194 Y196 S201 L202 | N56-S198 PolarHBondContact OD1-OG 3.3Å; L194-S198 WeakPolarHBondContact O-CB 3.31Å; L194-S198 PolarHBondContact O-N 3.4Å; L194-S198 PolarHBondContact O-OG 2.89Å; Y196-S198 VanDerWaalsContact C-N 3.33Å; Y196-S198 PolarHBondContact O-N 3.27Å; S198-S201 PolarHBondContact O-N 3.31Å; S198-L202 WeakPolarHBondContact O-CB 3.26Å; S198-L202 WeakPolarHBondContact O-CG 3.29Å; S198-L202 PolarHBondContact O-N 2.91Å |
| 199 | G | 89.4 | Confident | 81.7 | Confident | 16 Ų | 16 | 53.3 Ų | 53.3 | 17% | 0.165 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -62.8 | -41.8 | 173.6 | 0 | 0 | 0 | 0 | 0 | 112.9 | G195 Y196 L202 T203 | G195-G199 PolarHBondContact O-N 3.22Å; Y196-G199 PolarHBondContact O-N 3.34Å; G199-L202 PolarHBondContact O-N 3.11Å; G199-T203 PolarHBondContact O-N 2.91Å; G199-T203 PolarHBondContact O-OG1 3.5Å |
| 200 | L | 91.1 | Very high | 83.1 | Confident | 83 Ų | 83 | 52.7 Ų | 52.7 | 44% | 0.435 | 28% | 0.279 | S | S | . | . | H | α-helix | trans | -62.6 | -48 | 173.8 | 179.1 | 59.9 | 0 | 0 | 0 | 111.5 | Y196 T197 L202 T203 C204 L344 L348 | Y196-L200 PolarHBondContact O-N 2.87Å; T197-L200 PolarHBondContact O-N 3Å; L200-L202 PolarHBondContact O-N 2.74Å; L200-T203 WeakPolarHBondContact O-CB 3.31Å; L200-T203 PolarHBondContact O-N 3.12Å; L200-T203 VanDerWaalsContact O-N 3.13Å; L200-C204 PolarHBondContact O-N 3.38Å; L200-C204 PolarHBondContact O-SG 3.32Å; L200-L344 HydrophobicContact CD2-CD2 4.44Å; L200-L348 HydrophobicContact CD2-CD1 3.73Å; L200-L348 HydrophobicContact CG-CD1 4.17Å |
| 201 | S | 90.9 | Very high | 84.6 | Confident | 0 Ų | 0 | 46.5 Ų | 46.5 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -54.7 | -49.3 | 175.2 | -179.4 | 0 | 0 | 0 | 0 | 111.6 | N59 T197 S198 T203 C204 M205 T349 | N59-S201 VanDerWaalsContact OD1-CB 3.23Å; N59-S201 WeakPolarHBondContact OD1-CB 3.32Å; N59-S201 PolarHBondContact OD1-OG 3.1Å; T197-S201 WeakPolarHBondContact O-CB 3.35Å; T197-S201 PolarHBondContact O-N 3.37Å; S198-S201 PolarHBondContact O-N 3.31Å; S201-T203 VanDerWaalsContact C-N 3.29Å; S201-T203 PolarHBondContact O-N 3.04Å; S201-C204 WeakPolarHBondContact O-CB 3.29Å; S201-C204 PolarHBondContact O-N 2.68Å; S201-C204 VanDerWaalsContact O-N 3.12Å; S201-M205 PolarHBondContact O-N 3.34Å; S201-T349 PolarHBondContact OG-OG1 3.13Å |
| 202 | L | 90.9 | Very high | 86 | Confident | 14 Ų | 14 | 45.4 Ų | 45.4 | 7% | 0.073 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -60.1 | -38 | 176.9 | -77.3 | 162.7 | 0 | 0 | 0 | 113 | F55 M62 S198 G199 L200 M205 L206 M301 | F55-L202 HydrophobicContact CB-CD1 3.85Å; F55-L202 HydrophobicContact CD1-CD1 3.53Å; F55-L202 HydrophobicContact CE1-CD1 4.46Å; F55-L202 HydrophobicContact CG-CD1 4.06Å; F55-L202 WeakPolarHBondContact O-CD1 3.4Å; M62-L202 HydrophobicContact CE-CB 4.49Å; M62-L202 HydrophobicContact CE-CD2 3.61Å; M62-L202 HydrophobicContact CE-CG 3.9Å; M62-L202 HydrophobicContact SD-CD2 3.55Å; M62-L202 VanDerWaalsContact SD-CD2 3.55Å; M62-L202 HydrophobicContact SD-CG 4.4Å; S198-L202 WeakPolarHBondContact O-CB 3.26Å; S198-L202 WeakPolarHBondContact O-CG 3.29Å; S198-L202 PolarHBondContact O-N 2.91Å; G199-L202 PolarHBondContact O-N 3.11Å; L200-L202 PolarHBondContact O-N 2.74Å; L202-M205 PolarHBondContact O-N 3.48Å; L202-L206 WeakPolarHBondContact O-CB 3.29Å; L202-L206 WeakPolarHBondContact O-CG 3.32Å; L202-L206 PolarHBondContact O-N 3.33Å; L202-M301 HydrophobicContact CD2-CE 3.93Å; L202-M301 HydrophobicContact CD2-SD 4.42Å |
| 203 | T | 93.1 | Very high | 87.7 | Confident | 86 Ų | 86 | 44.5 Ų | 44.5 | 53% | 0.528 | 23% | 0.225 | S | C | . | . | H | α-helix | trans | -66.8 | -39.5 | 177.1 | -57.8 | 0 | 0 | 0 | 0 | 111 | G199 L200 S201 L206 F207 | G199-T203 PolarHBondContact O-N 2.91Å; G199-T203 PolarHBondContact O-OG1 3.5Å; L200-T203 WeakPolarHBondContact O-CB 3.31Å; L200-T203 PolarHBondContact O-N 3.12Å; L200-T203 VanDerWaalsContact O-N 3.13Å; S201-T203 VanDerWaalsContact C-N 3.29Å; S201-T203 PolarHBondContact O-N 3.04Å; T203-L206 PolarHBondContact O-N 3.17Å; T203-F207 PolarHBondContact O-N 2.98Å |
| 204 | C | 93.8 | Very high | 89 | Confident | 14 Ų | 14 | 42.3 Ų | 42.3 | 10% | 0.095 | 22% | 0.216 | C | C | . | . | H | α-helix | trans | -61.7 | -42.9 | 173.1 | -70.6 | 0 | 0 | 0 | 0 | 112.4 | L200 S201 F207 F208 A341 A345 | L200-C204 PolarHBondContact O-N 3.38Å; L200-C204 PolarHBondContact O-SG 3.32Å; S201-C204 WeakPolarHBondContact O-CB 3.29Å; S201-C204 PolarHBondContact O-N 2.68Å; S201-C204 VanDerWaalsContact O-N 3.12Å; C204-F207 WeakPolarHBondContact O-CB 3.36Å; C204-F207 PolarHBondContact O-N 2.99Å; C204-F208 PolarHBondContact O-N 3.21Å; C204-A341 HydrophobicContact CB-CB 3.99Å; C204-A341 WeakPolarHBondContact CB-O 3.28Å; C204-A345 HydrophobicContact CB-CB 3.92Å |
| 205 | M | 92.3 | Very high | 90.1 | Very high | 4 Ų | 4 | 41.8 Ų | 41.8 | 2% | 0.02 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -71 | -31.2 | 174.9 | -83.3 | 92.8 | 155.6 | 0 | 0 | 113.5 | M62 S201 L202 F207 F208 L209 A345 | M62-M205 HydrophobicContact CE-CB 4.18Å; M62-M205 HydrophobicContact CE-CE 3.34Å; M62-M205 HydrophobicContact CE-CG 3.87Å; M62-M205 HydrophobicContact CE-SD 3.04Å; M62-M205 WeakPolarHBondContact CE-SD 3.33Å; M62-M205 HydrophobicContact CG-CB 4.33Å; M62-M205 HydrophobicContact CG-CE 3.93Å; M62-M205 HydrophobicContact CG-CG 3.89Å; M62-M205 HydrophobicContact CG-SD 4.17Å; M62-M205 HydrophobicContact SD-CB 3.23Å; M62-M205 WeakPolarHBondContact SD-CB 3.47Å; M62-M205 HydrophobicContact SD-CE 3.88Å; M62-M205 HydrophobicContact SD-CG 3.24Å; M62-M205 WeakPolarHBondContact SD-CG 3.22Å; M62-M205 HydrophobicContact SD-SD 3.36Å; S201-M205 PolarHBondContact O-N 3.34Å; L202-M205 PolarHBondContact O-N 3.48Å; M205-F207 VanDerWaalsContact C-N 3.33Å; M205-F208 WeakPolarHBondContact O-CB 3.38Å; M205-F208 PolarHBondContact O-N 3.03Å; M205-L209 PolarHBondContact O-N 3.43Å; M205-A345 HydrophobicContact CE-CB 3.85Å; M205-A345 HydrophobicContact SD-CB 3.48Å; M205-A345 WeakPolarHBondContact SD-CB 3.32Å |
| 206 | L | 94.4 | Very high | 90.8 | Very high | 83 Ų | 83 | 43 Ų | 43 | 44% | 0.435 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -63 | -42.4 | 170.4 | -79.2 | 165.9 | 0 | 0 | 0 | 111 | L202 T203 F208 L209 V210 M304 | L202-L206 WeakPolarHBondContact O-CB 3.29Å; L202-L206 WeakPolarHBondContact O-CG 3.32Å; L202-L206 PolarHBondContact O-N 3.33Å; T203-L206 PolarHBondContact O-N 3.17Å; L206-F208 VanDerWaalsContact C-N 3.33Å; L206-F208 PolarHBondContact O-N 3.36Å; L206-L209 PolarHBondContact O-N 2.97Å; L206-V210 WeakPolarHBondContact O-CG2 3.16Å; L206-V210 PolarHBondContact O-N 3.18Å; L206-M304 HydrophobicContact CD2-CE 3.72Å; L206-M304 HydrophobicContact CD2-SD 3.36Å; L206-M304 WeakPolarHBondContact CD2-SD 3.5Å; L206-M304 HydrophobicContact CG-CE 4.12Å; L206-M304 HydrophobicContact CG-SD 4.31Å |
| 207 | F | 95 | Very high | 91.1 | Very high | 77 Ų | 77 | 42.6 Ų | 42.6 | 34% | 0.338 | 22% | 0.219 | S | C | . | . | H | α-helix | trans | -61.6 | -41.1 | 173.3 | 173.3 | -111.2 | 0 | 0 | 0 | 112.2 | T203 C204 M205 V210 S211 L334 C337 V338 A341 | T203-F207 PolarHBondContact O-N 2.98Å; C204-F207 WeakPolarHBondContact O-CB 3.36Å; C204-F207 PolarHBondContact O-N 2.99Å; M205-F207 VanDerWaalsContact C-N 3.33Å; F207-V210 PolarHBondContact O-N 3.3Å; F207-S211 WeakPolarHBondContact O-CB 3.43Å; F207-S211 PolarHBondContact O-N 3.42Å; F207-S211 PolarHBondContact O-OG 3.06Å; F207-L334 HydrophobicContact CE2-CD1 4.42Å; F207-L334 HydrophobicContact CZ-CD1 4.1Å; F207-C337 HydrophobicContact CE1-CB 4.14Å; F207-C337 HydrophobicContact CZ-CB 4.16Å; F207-V338 HydrophobicContact CD1-CG2 4.26Å; F207-V338 HydrophobicContact CE1-CB 4.4Å; F207-V338 HydrophobicContact CE1-CG2 3.67Å; F207-V338 HydrophobicContact CZ-CG2 4.13Å; F207-A341 HydrophobicContact CD1-CB 3.87Å; F207-A341 HydrophobicContact CE1-CB 4.38Å |
| 208 | F | 93.6 | Very high | 91 | Very high | 1 Ų | 1 | 45.5 Ų | 45.5 | 0% | 0.004 | 23% | 0.229 | C | C | . | . | H | α-helix | trans | -57.6 | -50.7 | 171.5 | 164.7 | -120.8 | 0 | 0 | 0 | 111.9 | I66 L67 C204 M205 L206 V210 S211 V212 T308 M324 L325 V338 V342 | I66-F208 HydrophobicContact CD1-CD1 4.39Å; I66-F208 HydrophobicContact CD1-CE1 4.26Å; I66-F208 HydrophobicContact CG1-CE1 4.34Å; L67-F208 HydrophobicContact CD2-CE1 3.94Å; L67-F208 HydrophobicContact CD2-CE2 4.41Å; L67-F208 HydrophobicContact CD2-CZ 3.68Å; C204-F208 PolarHBondContact O-N 3.21Å; M205-F208 WeakPolarHBondContact O-CB 3.38Å; M205-F208 PolarHBondContact O-N 3.03Å; L206-F208 VanDerWaalsContact C-N 3.33Å; L206-F208 PolarHBondContact O-N 3.36Å; F208-V210 PolarHBondContact O-N 3.44Å; F208-S211 PolarHBondContact O-N 2.74Å; F208-S211 VanDerWaalsContact O-N 3.17Å; F208-V212 HydrophobicContact CD2-CG2 3.71Å; F208-V212 HydrophobicContact CE2-CG2 3.38Å; F208-V212 HydrophobicContact CZ-CG2 3.93Å; F208-V212 WeakPolarHBondContact O-CG2 3.37Å; F208-V212 PolarHBondContact O-N 3.31Å; F208-T308 HydrophobicContact CD1-CG2 4.29Å; F208-T308 HydrophobicContact CE1-CG2 3.51Å; F208-T308 HydrophobicContact CZ-CG2 3.97Å; F208-M324 HydrophobicContact CE2-CE 3.77Å; F208-M324 HydrophobicContact CZ-CE 3.47Å; F208-M324 VanDerWaalsContact CZ-CE 3.47Å; F208-L325 HydrophobicContact CD2-CD1 4.27Å; F208-L325 HydrophobicContact CE2-CD1 3.83Å; F208-V338 HydrophobicContact CB-CG1 4.19Å; F208-V338 HydrophobicContact CD2-CG1 3.51Å; F208-V338 HydrophobicContact CE2-CG1 4.35Å; F208-V338 HydrophobicContact CG-CG1 4.3Å; F208-V342 HydrophobicContact CB-CG2 4.25Å; F208-V342 HydrophobicContact CD2-CG2 4.4Å; F208-V342 HydrophobicContact CG-CG2 4.27Å |
| 209 | L | 94.5 | Very high | 90.4 | Very high | 12 Ų | 12 | 49.5 Ų | 49.5 | 6% | 0.063 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -55.2 | -51.1 | 177.1 | 167.9 | 62.8 | 0 | 0 | 0 | 111.8 | M205 L206 S211 V212 I213 M304 L307 T308 | M205-L209 PolarHBondContact O-N 3.43Å; L206-L209 PolarHBondContact O-N 2.97Å; L209-S211 VanDerWaalsContact C-N 3.26Å; L209-S211 PolarHBondContact O-N 2.93Å; L209-V212 PolarHBondContact O-N 3.42Å; L209-I213 HydrophobicContact CD1-CD1 3.76Å; L209-I213 HydrophobicContact CD1-CG1 4.06Å; L209-I213 HydrophobicContact CG-CD1 4Å; L209-I213 WeakPolarHBondContact O-CG1 3.38Å; L209-I213 PolarHBondContact O-N 3.3Å; L209-M304 HydrophobicContact CB-CE 3.84Å; L209-M304 HydrophobicContact CD2-CE 3.68Å; L209-M304 HydrophobicContact CD2-SD 3.37Å; L209-M304 WeakPolarHBondContact CD2-SD 3.05Å; L209-M304 HydrophobicContact CG-CE 4.39Å; L209-L307 HydrophobicContact CD1-CB 3.72Å; L209-L307 HydrophobicContact CD2-CB 4.4Å; L209-L307 HydrophobicContact CD2-CD1 4.31Å; L209-T308 WeakPolarHBondContact CD1-OG1 3.43Å |
| 210 | V | 94.9 | Very high | 89.1 | Confident | 92 Ų | 92 | 50.5 Ų | 50.5 | 56% | 0.558 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -59.8 | -40.4 | -179.8 | 172.4 | 0 | 0 | 0 | 0 | 110.9 | L206 F207 F208 I213 Y214 | L206-V210 WeakPolarHBondContact O-CG2 3.16Å; L206-V210 PolarHBondContact O-N 3.18Å; F207-V210 PolarHBondContact O-N 3.3Å; F208-V210 PolarHBondContact O-N 3.44Å; V210-I213 PolarHBondContact O-N 3Å; V210-Y214 WeakPolarHBondContact O-CB 3.35Å; V210-Y214 PolarHBondContact O-N 2.75Å |
| 211 | S | 92.6 | Very high | 87.8 | Confident | 5 Ų | 5 | 49.5 Ų | 49.5 | 4% | 0.035 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -67.8 | -39.3 | 178.9 | -59.1 | 0 | 0 | 0 | 0 | 112.6 | F207 F208 L209 Y214 K215 V338 | F207-S211 WeakPolarHBondContact O-CB 3.43Å; F207-S211 PolarHBondContact O-N 3.42Å; F207-S211 PolarHBondContact O-OG 3.06Å; F208-S211 PolarHBondContact O-N 2.74Å; F208-S211 VanDerWaalsContact O-N 3.17Å; L209-S211 VanDerWaalsContact C-N 3.26Å; L209-S211 PolarHBondContact O-N 2.93Å; S211-Y214 PolarHBondContact O-N 3.42Å; S211-K215 WeakPolarHBondContact O-CB 3.49Å; S211-K215 VanDerWaalsContact O-CG 3.29Å; S211-K215 WeakPolarHBondContact O-CG 3.27Å; S211-K215 PolarHBondContact O-N 3.28Å; S211-V338 VanDerWaalsContact OG-CG2 3.31Å; S211-V338 WeakPolarHBondContact OG-CG2 3.22Å |
| 212 | V | 91.2 | Very high | 85.9 | Confident | 4 Ų | 4 | 53.4 Ų | 53.4 | 2% | 0.024 | 29% | 0.292 | C | S | . | . | H | α-helix | trans | -63.2 | -45.4 | 174.7 | 170 | 0 | 0 | 0 | 0 | 110.7 | F208 L209 Y214 K215 K216 F311 M324 | F208-V212 HydrophobicContact CD2-CG2 3.71Å; F208-V212 HydrophobicContact CE2-CG2 3.38Å; F208-V212 HydrophobicContact CZ-CG2 3.93Å; F208-V212 WeakPolarHBondContact O-CG2 3.37Å; F208-V212 PolarHBondContact O-N 3.31Å; L209-V212 PolarHBondContact O-N 3.42Å; V212-Y214 PolarHBondContact O-N 3.22Å; V212-K215 PolarHBondContact O-N 3.4Å; V212-K216 PolarHBondContact O-N 3.28Å; V212-F311 HydrophobicContact CG1-CB 3.97Å; V212-M324 HydrophobicContact CG1-CE 4.13Å; V212-M324 HydrophobicContact CG2-CE 3.61Å |
| 213 | I | 92.6 | Very high | 83.8 | Confident | 46 Ų | 46 | 58.2 Ų | 58.2 | 24% | 0.236 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -58.8 | -49.9 | 174.9 | -65.9 | 170.9 | 0 | 0 | 0 | 110 | L209 V210 K215 K216 F217 F311 | L209-I213 HydrophobicContact CD1-CD1 3.76Å; L209-I213 HydrophobicContact CD1-CG1 4.06Å; L209-I213 HydrophobicContact CG-CD1 4Å; L209-I213 WeakPolarHBondContact O-CG1 3.38Å; L209-I213 PolarHBondContact O-N 3.3Å; V210-I213 PolarHBondContact O-N 3Å; I213-K215 VanDerWaalsContact C-N 3.34Å; I213-K215 PolarHBondContact O-N 3.42Å; I213-K216 WeakPolarHBondContact O-CB 3.35Å; I213-K216 PolarHBondContact O-N 3.2Å; I213-F217 HydrophobicContact CG2-CD2 4.05Å; I213-F217 HydrophobicContact CG2-CE2 3.71Å; I213-F217 WeakPolarHBondContact O-CD2 3.31Å; I213-F217 PolarHBondContact O-N 2.84Å; I213-F311 HydrophobicContact CB-CD1 4.5Å; I213-F311 HydrophobicContact CB-CG 4.42Å; I213-F311 HydrophobicContact CD1-CD2 4.16Å; I213-F311 HydrophobicContact CD1-CE2 4.22Å; I213-F311 HydrophobicContact CG1-CB 4.14Å; I213-F311 HydrophobicContact CG1-CD1 4.21Å; I213-F311 HydrophobicContact CG1-CD2 3.56Å; I213-F311 HydrophobicContact CG1-CE2 3.97Å; I213-F311 HydrophobicContact CG1-CG 3.71Å; I213-F311 HydrophobicContact CG1-CZ 4.46Å; I213-F311 HydrophobicContact CG2-CD1 4.34Å; I213-F311 HydrophobicContact CG2-CE1 4.22Å; I213-F311 HydrophobicContact CG2-CZ 4.42Å |
| 214 | Y | 91.7 | Very high | 81.3 | Confident | 122 Ų | 122 | 57.3 Ų | 57.3 | 48% | 0.478 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -58.4 | -46 | 179.4 | 179.6 | -102.5 | 0 | 0 | 0 | 111.9 | V210 S211 V212 K216 F217 Q218 L334 | V210-Y214 WeakPolarHBondContact O-CB 3.35Å; V210-Y214 PolarHBondContact O-N 2.75Å; S211-Y214 PolarHBondContact O-N 3.42Å; V212-Y214 PolarHBondContact O-N 3.22Å; Y214-K216 PolarHBondContact O-N 3.3Å; Y214-F217 PolarHBondContact O-N 3.47Å; Y214-Q218 HydrophobicContact CD1-CG 4.17Å; Y214-Q218 HydrophobicContact CE1-CG 3.78Å; Y214-Q218 HydrophobicContact CE2-CG 4.47Å; Y214-Q218 PolarHBondContact O-N 3.44Å; Y214-Q218 VanDerWaalsContact O-N 3.07Å; Y214-Q218 PolarHBondContact OH-NE2 3.45Å; Y214-L334 HydrophobicContact CD1-CD2 3.6Å; Y214-L334 HydrophobicContact CE1-CD2 4.04Å |
| 215 | K | 87.2 | Confident | 78.5 | Confident | 10 Ų | 10 | 68.3 Ų | 68.3 | 4% | 0.043 | 36% | 0.364 | C | S | . | . | H | α-helix | trans | -64.2 | -38.8 | 179.3 | -77 | -73.3 | 168.6 | -158.7 | 0 | 112.4 | S211 V212 I213 F217 Q218 L219 Y328 D332 L334 I335 | S211-K215 WeakPolarHBondContact O-CB 3.49Å; S211-K215 VanDerWaalsContact O-CG 3.29Å; S211-K215 WeakPolarHBondContact O-CG 3.27Å; S211-K215 PolarHBondContact O-N 3.28Å; V212-K215 PolarHBondContact O-N 3.4Å; I213-K215 VanDerWaalsContact C-N 3.34Å; I213-K215 PolarHBondContact O-N 3.42Å; K215-F217 PolarHBondContact O-N 3.38Å; K215-Q218 VanDerWaalsContact NZ-OE1 3.14Å; K215-Q218 PolarHBondContact O-N 3.04Å; K215-L219 HydrophobicContact CB-CD1 3.82Å; K215-L219 HydrophobicContact CD-CD1 3.84Å; K215-L219 HydrophobicContact CG-CD1 4.4Å; K215-L219 WeakPolarHBondContact O-CB 3.41Å; K215-L219 WeakPolarHBondContact O-CD1 3.16Å; K215-L219 PolarHBondContact O-N 3.13Å; K215-Y328 HydrophobicContact CB-CE1 3.89Å; K215-Y328 HydrophobicContact CG-CE1 4.31Å; K215-D332 VanDerWaalsContact CE-OD2 3.25Å; K215-D332 WeakPolarHBondContact CE-OD2 3.33Å; K215-D332 VanDerWaalsContact NZ-CG 3.27Å; K215-D332 IonicContact NZ-OD1 3.29Å; K215-D332 PolarHBondContact NZ-OD1 3.28Å; K215-D332 IonicContact NZ-OD2 2.53Å; K215-D332 PolarHBondContact NZ-OD2 3.47Å; K215-L334 HydrophobicContact CG-CD2 4.31Å; K215-I335 HydrophobicContact CD-CD1 4.2Å; K215-I335 HydrophobicContact CG-CD1 3.96Å |
| 216 | K | 85.9 | Confident | 75.8 | Confident | 30 Ų | 30 | 75.2 Ų | 75.2 | 13% | 0.13 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -53.9 | -41.5 | 173.5 | 171.5 | 65.9 | -158.7 | 112.1 | 0 | 112.5 | V212 I213 Y214 F311 L314 | V212-K216 PolarHBondContact O-N 3.28Å; I213-K216 WeakPolarHBondContact O-CB 3.35Å; I213-K216 PolarHBondContact O-N 3.2Å; Y214-K216 PolarHBondContact O-N 3.3Å; K216-F311 HydrophobicContact CB-CD1 4.16Å; K216-F311 HydrophobicContact CG-CD1 4.01Å; K216-L314 HydrophobicContact CD-CB 3.7Å; K216-L314 WeakPolarHBondContact CD-O 3.4Å; K216-L314 WeakPolarHBondContact CE-O 3.35Å; K216-L314 PolarHBondContact NZ-O 3.45Å |
| 217 | F | 87.1 | Confident | 73.1 | Confident | 152 Ų | 152 | 80.4 Ų | 80.4 | 67% | 0.667 | 42% | 0.423 | S | S | * | . | H | α-helix | trans | -77.3 | -26.7 | 179.4 | -70.5 | -68.9 | 0 | 0 | 0 | 113 | I213 Y214 K215 F311 | I213-F217 HydrophobicContact CG2-CD2 4.05Å; I213-F217 HydrophobicContact CG2-CE2 3.71Å; I213-F217 WeakPolarHBondContact O-CD2 3.31Å; I213-F217 PolarHBondContact O-N 2.84Å; Y214-F217 PolarHBondContact O-N 3.47Å; K215-F217 PolarHBondContact O-N 3.38Å; F217-F311 HydrophobicContact CE2-CE1 4.03Å; F217-F311 HydrophobicContact CZ-CE1 4.13Å |
| 218 | Q | 81.9 | Confident | 70.1 | Confident | 104 Ų | 104 | 82.9 Ų | 82.9 | 49% | 0.486 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -79.1 | -43.8 | 175.8 | -73.5 | -151.7 | -37.9 | 0 | 0 | 114.1 | Y214 K215 G220 | Y214-Q218 HydrophobicContact CD1-CG 4.17Å; Y214-Q218 HydrophobicContact CE1-CG 3.78Å; Y214-Q218 HydrophobicContact CE2-CG 4.47Å; Y214-Q218 PolarHBondContact O-N 3.44Å; Y214-Q218 VanDerWaalsContact O-N 3.07Å; Y214-Q218 PolarHBondContact OH-NE2 3.45Å; K215-Q218 VanDerWaalsContact NZ-OE1 3.14Å; K215-Q218 PolarHBondContact O-N 3.04Å; Q218-G220 PolarHBondContact O-N 3.36Å |
| 219 | L | 74 | Confident | 67.3 | Low | 84 Ų | 84 | 87.5 Ų | 87.5 | 44% | 0.44 | 48% | 0.483 | S | S | . | . | H | α-helix | trans | -74.2 | -12 | -171.2 | -83.4 | 128.6 | 0 | 0 | 0 | 113.6 | K215 T315 Y328 | K215-L219 HydrophobicContact CB-CD1 3.82Å; K215-L219 HydrophobicContact CD-CD1 3.84Å; K215-L219 HydrophobicContact CG-CD1 4.4Å; K215-L219 WeakPolarHBondContact O-CB 3.41Å; K215-L219 WeakPolarHBondContact O-CD1 3.16Å; K215-L219 PolarHBondContact O-N 3.13Å; L219-T315 HydrophobicContact CD1-CG2 4.38Å; L219-Y328 HydrophobicContact CD1-CD1 4.48Å; L219-Y328 HydrophobicContact CD1-CE1 4.22Å |
| 220 | G | 62.5 | Low | 64.2 | Low | 38 Ų | 38 | 95.1 Ų | 95.1 | 39% | 0.392 | 52% | 0.52 | S | S | . | . | trans | 54.9 | -169.1 | -176.1 | 0 | 0 | 0 | 0 | 0 | 112.3 | Q218 | Q218-G220 PolarHBondContact O-N 3.36Š| ||
| 221 | C | 63.3 | Low | 61.6 | Low | 61 Ų | 61 | 99.2 Ų | 99.2 | 41% | 0.412 | 53% | 0.533 | S | S | . | . | trans | -87.8 | 96.1 | 157.5 | 160.3 | 0 | 0 | 0 | 0 | 106.1 | I223 C247 | C221-I223 PolarHBondContact O-N 3.2Å; C221-I223 VanDerWaalsContact O-N 3.13Å; C221-C247 HydrophobicContact CB-CB 3.69Å; C221-C247 WeakPolarHBondContact CB-SG 3.34Å; C221-C247 WeakPolarHBondContact SG-CB 3.4Å; C221-C247 CovalentContact SG-SG 2.01Å; C221-C247 PolarHBondContact SG-SG 2.64Å | ||
| 222 | A | 51.6 | Low | 58.5 | Low | 83 Ų | 83 | 105 Ų | 105 | 69% | 0.686 | 57% | 0.574 | S | S | * | * | trans | -79.8 | 89.5 | 171.6 | 0 | 0 | 0 | 0 | 0 | 108.3 | G224 | A222-G224 PolarHBondContact O-N 2.83Š| ||
| 223 | I | 46.7 | Very low | 55.9 | Low | 115 Ų | 115 | 113.6 Ų | 113.6 | 59% | 0.59 | 61% | 0.614 | S | S | * | * | trans | -56.6 | 121.6 | 164.7 | -64.3 | 171.5 | 0 | 0 | 0 | 106.3 | C221 R225 | C221-I223 PolarHBondContact O-N 3.2Å; C221-I223 VanDerWaalsContact O-N 3.13Å; I223-R225 PolarHBondContact O-N 3.37Å | ||
| 224 | G | 41.4 | Very low | 52.9 | Low | 66 Ų | 66 | 116 Ų | 116 | 68% | 0.68 | 64% | 0.641 | S | S | * | * | trans | -39.5 | 106.6 | -171.5 | 0 | 0 | 0 | 0 | 0 | 113.1 | A222 N226 | A222-G224 PolarHBondContact O-N 2.83Å; G224-N226 PolarHBondContact O-N 3.48Å | ||
| 225 | R | 35 | Very low | 50.5 | Low | 246 Ų | 246 | 115.9 Ų | 115.9 | 93% | 0.928 | 66% | 0.655 | S | S | * | * | trans | -84.8 | 105.2 | 159.1 | -115.6 | 178.9 | 159.2 | 149.4 | -5.8 | 105.2 | I223 E227 | I223-R225 PolarHBondContact O-N 3.37Å; R225-E227 PolarHBondContact O-N 2.94Å | ||
| 226 | N | 34.9 | Very low | 48.6 | Very low | 148 Ų | 148 | 122.6 Ų | 122.6 | 79% | 0.791 | 70% | 0.696 | S | S | * | * | trans | -46.8 | 136.4 | 167.5 | -70.3 | -20.6 | 0 | 0 | 0 | 109 | G224 T228 | G224-N226 PolarHBondContact O-N 3.48Å; N226-T228 PolarHBondContact O-N 3.29Å | ||
| 227 | E | 37.2 | Very low | 45.8 | Very low | 192 Ų | 192 | 124.8 Ų | 124.8 | 90% | 0.897 | 73% | 0.727 | S | S | * | * | S | Bend | trans | -55.7 | 99.7 | 174.6 | -62.7 | -169.8 | 140.6 | 0 | 0 | 110.6 | R225 | R225-E227 PolarHBondContact O-N 2.94Š|
| 228 | T | 32.6 | Very low | 43.6 | Very low | 130 Ų | 130 | 125.4 Ų | 125.4 | 80% | 0.798 | 74% | 0.736 | S | S | * | * | trans | -153 | 119.7 | 145.9 | 42.4 | 0 | 0 | 0 | 0 | 107.8 | N226 | N226-T228 PolarHBondContact O-N 3.29Š| ||
| 229 | A | 34.3 | Very low | 41.2 | Very low | 98 Ų | 98 | 127.6 Ų | 127.6 | 81% | 0.81 | 75% | 0.746 | S | S | * | * | trans | -52 | 134.9 | 169.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | ||||
| 230 | M | 29.9 | Very low | 39.6 | Very low | 171 Ų | 171 | 130.9 Ų | 130.9 | 84% | 0.842 | 76% | 0.764 | S | S | * | * | 179.2 | 143.1 | 113.6 | -96.5 | -163.1 | 84.2 | 0 | 0 | 109.8 | |||||
| 231 | E | 40.1 | Very low | 38.3 | Very low | 178 Ų | 178 | 136.5 Ų | 136.5 | 83% | 0.832 | 78% | 0.781 | S | S | * | * | trans | -46.1 | 132.9 | 168.1 | -65.6 | 163.9 | 136.7 | 0 | 0 | 111.7 | ||||
| 232 | S | 27.4 | Very low | 36.9 | Very low | 126 Ų | 126 | 136.7 Ų | 136.7 | 88% | 0.881 | 79% | 0.793 | S | S | * | * | trans | -171.6 | 142.4 | 135.4 | -131.6 | 0 | 0 | 0 | 0 | 112.2 | ||||
| 233 | E | 37.1 | Very low | 36.2 | Very low | 186 Ų | 186 | 141 Ų | 141 | 87% | 0.869 | 80% | 0.804 | S | S | * | * | trans | -68 | 161.3 | 178.6 | -58.9 | 176.7 | 136.3 | 0 | 0 | 114.1 | ||||
| 234 | A | 28.7 | Very low | 36.1 | Very low | 97 Ų | 97 | 141.9 Ų | 141.9 | 80% | 0.802 | 81% | 0.809 | S | S | * | * | trans | 93.1 | 162.4 | 155.6 | 0 | 0 | 0 | 0 | 0 | 118.9 | ||||
| 235 | P | 41.8 | Very low | 36.5 | Very low | 119 Ų | 119 | 143.6 Ų | 143.6 | 77% | 0.773 | 81% | 0.811 | S | S | * | * | -120.4 | 157.9 | -119.9 | 24.3 | -1.1 | 0 | 0 | 0 | 116.7 | |||||
| 236 | V | 46.5 | Very low | 37.7 | Very low | 151 Ų | 151 | 133.8 Ų | 133.8 | 92% | 0.915 | 78% | 0.78 | S | S | * | * | trans | 33 | 107.3 | 153.7 | -168.7 | 0 | 0 | 0 | 0 | 118.5 | ||||
| 237 | G | 27.7 | Very low | 39.3 | Very low | 75 Ų | 75 | 128.4 Ų | 128.4 | 77% | 0.773 | 75% | 0.754 | S | S | * | * | trans | -146.2 | 120.2 | 161.3 | 0 | 0 | 0 | 0 | 0 | 110.8 | H239 | G237-H239 PolarHBondContact O-N 3.33Š| ||
| 238 | L | 41.2 | Very low | 41.2 | Very low | 166 Ų | 166 | 126.4 Ų | 126.4 | 87% | 0.869 | 74% | 0.744 | S | S | * | * | trans | -64.9 | 116.4 | -175.9 | -167.5 | 76.6 | 0 | 0 | 0 | 111.8 | ||||
| 239 | H | 31.3 | Very low | 43.4 | Very low | 149 Ų | 149 | 121.5 Ų | 121.5 | 69% | 0.69 | 72% | 0.717 | S | S | * | * | trans | -131 | 109.8 | 166.8 | -152.7 | 57.8 | 0 | 0 | 0 | 110.8 | G237 Q241 | G237-H239 PolarHBondContact O-N 3.33Å; H239-Q241 PolarHBondContact CD2-NE2 3.02Å; H239-Q241 VanDerWaalsContact CD2-NE2 3.27Å; H239-Q241 PolarHBondContact NE2-NE2 3.14Å; H239-Q241 VanDerWaalsContact NE2-NE2 3.14Å; H239-Q241 PolarHBondContact O-N 2.63Å; H239-Q241 VanDerWaalsContact O-N 3.11Å | ||
| 240 | N | 40.8 | Very low | 45.7 | Very low | 154 Ų | 154 | 121.8 Ų | 121.8 | 82% | 0.824 | 70% | 0.701 | S | S | * | * | trans | -68.1 | 97.5 | 170.5 | -80.9 | -17.7 | 0 | 0 | 0 | 109.4 | ||||
| 241 | Q | 34.1 | Very low | 48.3 | Very low | 156 Ų | 156 | 118.5 Ų | 118.5 | 73% | 0.729 | 69% | 0.685 | S | S | * | * | trans | -130.9 | 132.6 | 162.1 | -75.8 | -178.5 | -0 | 0 | 0 | 107.7 | H239 | H239-Q241 PolarHBondContact CD2-NE2 3.02Å; H239-Q241 VanDerWaalsContact CD2-NE2 3.27Å; H239-Q241 PolarHBondContact NE2-NE2 3.14Å; H239-Q241 VanDerWaalsContact NE2-NE2 3.14Å; H239-Q241 PolarHBondContact O-N 2.63Å; H239-Q241 VanDerWaalsContact O-N 3.11Å | ||
| 242 | G | 33.8 | Very low | 50.4 | Low | 65 Ų | 65 | 116.5 Ų | 116.5 | 67% | 0.67 | 67% | 0.674 | S | S | * | * | trans | 7.5 | 116.7 | 178.3 | 0 | 0 | 0 | 0 | 0 | 118.1 | N244 | G242-N244 VanDerWaalsContact C-N 3.26Å; G242-N244 PolarHBondContact O-N 3.35Å | ||
| 243 | L | 37.6 | Very low | 52.9 | Low | 174 Ų | 174 | 111.6 Ų | 111.6 | 91% | 0.911 | 64% | 0.639 | S | S | * | * | trans | -60.7 | 85.6 | 169.5 | -158.2 | 80.7 | 0 | 0 | 0 | 109.6 | S245 | L243-S245 PolarHBondContact O-N 2.99Š| ||
| 244 | N | 44.4 | Very low | 54.7 | Low | 133 Ų | 133 | 107.2 Ų | 107.2 | 71% | 0.711 | 63% | 0.625 | S | S | * | * | trans | -68 | 99 | 174.3 | -83.6 | -15.9 | 0 | 0 | 0 | 108.7 | G242 S246 | G242-N244 VanDerWaalsContact C-N 3.26Å; G242-N244 PolarHBondContact O-N 3.35Å; N244-S246 PolarHBondContact O-N 3.35Å; N244-S246 PolarHBondContact O-OG 3.43Å | ||
| 245 | S | 51.2 | Low | 57 | Low | 102 Ų | 102 | 105.5 Ų | 105.5 | 71% | 0.713 | 60% | 0.602 | S | S | * | * | trans | -64.3 | 56.2 | 180 | 58.7 | 0 | 0 | 0 | 0 | 113.9 | L243 | L243-S245 PolarHBondContact O-N 2.99Š| ||
| 246 | S | 60 | Low | 58.4 | Low | 39 Ų | 39 | 102.8 Ų | 102.8 | 27% | 0.273 | 59% | 0.585 | S | S | . | * | S | Bend | trans | -103 | -8.2 | -173.5 | 54.4 | 0 | 0 | 0 | 0 | 114.7 | N244 Y317 | N244-S246 PolarHBondContact O-N 3.35Å; N244-S246 PolarHBondContact O-OG 3.43Å; S246-Y317 WeakPolarHBondContact O-CB 3.49Å |
| 247 | C | 67.6 | Low | 59.7 | Low | 36 Ų | 36 | 97 Ų | 97 | 24% | 0.243 | 55% | 0.549 | C | S | . | . | S | Bend | trans | -134.1 | 22.1 | -177.6 | -65.6 | 0 | 0 | 0 | 0 | 114.3 | C221 Y317 | C221-C247 HydrophobicContact CB-CB 3.69Å; C221-C247 WeakPolarHBondContact CB-SG 3.34Å; C221-C247 WeakPolarHBondContact SG-CB 3.4Å; C221-C247 CovalentContact SG-SG 2.01Å; C221-C247 PolarHBondContact SG-SG 2.64Å; C247-Y317 HydrophobicContact CB-CD2 4.24Å; C247-Y317 HydrophobicContact CB-CE1 4.42Å; C247-Y317 HydrophobicContact CB-CE2 3.83Å; C247-Y317 WeakPolarHBondContact O-CE1 3.25Å; C247-Y317 VanDerWaalsContact O-CZ 3.28Å; C247-Y317 PolarHBondContact O-OH 3.11Å |
| 248 | E | 76.4 | Confident | 62.1 | Low | 149 Ų | 149 | 96.2 Ų | 96.2 | 70% | 0.696 | 53% | 0.526 | S | S | * | . | trans | -93.5 | 126.2 | 171.1 | -166.3 | 172.6 | 177.1 | 0 | 0 | 109.1 | Q250 | E248-Q250 PolarHBondContact O-N 3.34Š| ||
| 249 | A | 79.2 | Confident | 63.9 | Low | 27 Ų | 27 | 89 Ų | 89 | 22% | 0.223 | 49% | 0.489 | C | S | . | . | trans | -70.4 | 115.5 | 177.2 | 0 | 0 | 0 | 0 | 0 | 109.1 | M251 Y313 L314 Y317 | A249-M251 HydrophobicContact CB-CE 4.44Å; A249-M251 PolarHBondContact O-N 2.92Å; A249-Y313 HydrophobicContact CB-CE1 4.24Å; A249-L314 HydrophobicContact CB-CD2 3.85Å; A249-Y317 HydrophobicContact CB-CE1 4.42Å | ||
| 250 | Q | 82.9 | Confident | 66.4 | Low | 104 Ų | 104 | 82.2 Ų | 82.2 | 49% | 0.486 | 46% | 0.457 | S | S | . | . | trans | -76.2 | 121.3 | 174.5 | -62.4 | -155.5 | -25.1 | 0 | 0 | 109.6 | G77 V78 E248 T253 Y313 | G77-Q250 CarbonylContact C-O 3.58Å; G77-Q250 WeakPolarHBondContact CA-O 3.38Å; V78-Q250 PolarHBondContact N-O 2.93Å; E248-Q250 PolarHBondContact O-N 3.34Å; Q250-T253 VanDerWaalsContact CB-OG1 3.28Å; Q250-T253 WeakPolarHBondContact CB-OG1 3.36Å; Q250-T253 PolarHBondContact OE1-OG1 3.16Å; Q250-Y313 PolarHBondContact N-OH 3.44Å | ||
| 251 | M | 83.9 | Confident | 68.6 | Low | 102 Ų | 102 | 74.9 Ų | 74.9 | 50% | 0.502 | 42% | 0.418 | S | S | . | . | S | Bend | trans | -80.4 | -31.3 | -178.1 | -63.4 | -61 | 173.7 | 0 | 0 | 112 | V78 I79 A249 | V78-M251 HydrophobicContact CB-SD 4.38Å; V78-M251 PolarHBondContact N-O 3.46Å; I79-M251 HydrophobicContact CD1-CB 3.89Å; I79-M251 HydrophobicContact CD1-CG 4.26Å; I79-M251 HydrophobicContact CD1-SD 4.15Å; I79-M251 HydrophobicContact CG1-CB 4.14Å; I79-M251 HydrophobicContact CG1-SD 4.04Å; I79-M251 PolarHBondContact N-O 2.99Å; I79-M251 VanDerWaalsContact N-O 3.16Å; A249-M251 HydrophobicContact CB-CE 4.44Å; A249-M251 PolarHBondContact O-N 2.92Å |
| 252 | F | 84.5 | Confident | 71.2 | Confident | 136 Ų | 136 | 69.3 Ų | 69.3 | 60% | 0.596 | 40% | 0.395 | S | S | * | . | trans | -145.3 | 121 | 179.4 | -173.3 | -95.9 | 0 | 0 | 0 | 109.6 | F80 V254 | F80-F252 HydrophobicContact CB-CD2 3.95Å; F80-F252 HydrophobicContact CB-CE2 4.24Å; F80-F252 HydrophobicContact CD1-CE2 4.39Å; F80-F252 HydrophobicContact CD2-CE2 4.2Å; F80-F252 HydrophobicContact CG-CD2 4.27Å; F80-F252 HydrophobicContact CG-CE2 4.04Å; F252-V254 HydrophobicContact CD1-CG2 4.34Å; F252-V254 HydrophobicContact CE1-CG2 3.45Å; F252-V254 VanDerWaalsContact CE1-CG2 3.45Å; F252-V254 HydrophobicContact CZ-CG2 3.54Å | ||
| 253 | T | 79.9 | Confident | 74 | Confident | 24 Ų | 24 | 66.2 Ų | 66.2 | 15% | 0.147 | 36% | 0.363 | C | S | . | . | trans | -136.7 | 135.5 | 178.5 | -48.1 | 0 | 0 | 0 | 0 | 108.2 | T76 Q250 | T76-T253 CarbonylContact C-O 3.23Å; T76-T253 WeakPolarHBondContact CA-O 3.43Å; T76-T253 PolarHBondContact O-N 3.41Å; Q250-T253 VanDerWaalsContact CB-OG1 3.28Å; Q250-T253 WeakPolarHBondContact CB-OG1 3.36Å; Q250-T253 PolarHBondContact OE1-OG1 3.16Å | ||
| 254 | V | 76.1 | Confident | 76.6 | Confident | 94 Ų | 94 | 58 Ų | 58 | 57% | 0.57 | 32% | 0.32 | S | S | * | . | trans | -123.1 | 94.8 | 173.2 | -179.5 | 0 | 0 | 0 | 0 | 106.8 | F252 M258 | F252-V254 HydrophobicContact CD1-CG2 4.34Å; F252-V254 HydrophobicContact CE1-CG2 3.45Å; F252-V254 VanDerWaalsContact CE1-CG2 3.45Å; F252-V254 HydrophobicContact CZ-CG2 3.54Å; V254-M258 HydrophobicContact CG1-CE 4.03Å; V254-M258 HydrophobicContact CG1-SD 4.25Å | ||
| 255 | D | 75.7 | Confident | 78.9 | Confident | 61 Ų | 61 | 51.7 Ų | 51.7 | 33% | 0.326 | 29% | 0.286 | S | S | . | . | trans | -104.5 | 156.6 | 176.4 | -173 | 11.2 | 0 | 0 | 0 | 110.6 | H75 Q257 M258 | H75-D255 HydrophobicContact CB-CB 4.5Å; H75-D255 IonicContact CE1-OD2 3.76Å; H75-D255 PolarHBondContact CE1-OD2 2.99Å; H75-D255 IonicContact CG-OD2 2.85Å; H75-D255 IonicContact ND1-OD2 3.55Å; H75-D255 PolarHBondContact ND1-OD2 3.35Å; D255-Q257 PolarHBondContact O-N 3.24Å; D255-M258 WeakPolarHBondContact O-CB 3.27Å; D255-M258 PolarHBondContact O-N 3.43Å | ||
| 256 | S | 71.9 | Confident | 80.9 | Confident | 61 Ų | 61 | 46.9 Ų | 46.9 | 43% | 0.427 | 25% | 0.252 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -50.7 | -33.3 | 169.9 | 58.4 | 0 | 0 | 0 | 0 | 113.3 | M258 S259 | S256-M258 PolarHBondContact O-N 3.41Å; S256-S259 PolarHBondContact O-N 3.16Å; S256-S259 PolarHBondContact O-OG 3.34Å |
| 257 | Q | 74.4 | Confident | 82.4 | Confident | 31 Ų | 31 | 45.6 Ų | 45.6 | 15% | 0.145 | 24% | 0.242 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -72.5 | -10.8 | 177.1 | -59.1 | -56 | -31.4 | 0 | 0 | 114 | H75 D255 S259 Y260 | H75-Q257 HydrophobicContact CB-CB 4.27Å; D255-Q257 PolarHBondContact O-N 3.24Å; Q257-S259 PolarHBondContact O-N 3.42Å; Q257-Y260 PolarHBondContact O-N 3.24Å |
| 258 | M | 77.5 | Confident | 83.7 | Confident | 58 Ų | 58 | 43.9 Ų | 43.9 | 29% | 0.286 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -56.3 | -23.3 | 172.6 | -173.7 | -178.9 | 70.3 | 0 | 0 | 112.4 | T76 F80 V254 D255 S256 Y260 T261 | T76-M258 HydrophobicContact CG2-CG 3.99Å; F80-M258 HydrophobicContact CE1-SD 4.03Å; V254-M258 HydrophobicContact CG1-CE 4.03Å; V254-M258 HydrophobicContact CG1-SD 4.25Å; D255-M258 WeakPolarHBondContact O-CB 3.27Å; D255-M258 PolarHBondContact O-N 3.43Å; S256-M258 PolarHBondContact O-N 3.41Å; M258-Y260 PolarHBondContact O-N 2.84Å; M258-T261 PolarHBondContact O-N 3.29Å; M258-T261 VanDerWaalsContact O-N 3.12Å |
| 259 | S | 79.5 | Confident | 84.5 | Confident | 15 Ų | 15 | 36.8 Ų | 36.8 | 11% | 0.105 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -54.2 | -30.8 | 172.5 | 51.3 | 0 | 0 | 0 | 0 | 113.8 | S256 Q257 P263 N461 | S256-S259 PolarHBondContact O-N 3.16Å; S256-S259 PolarHBondContact O-OG 3.34Å; Q257-S259 PolarHBondContact O-N 3.42Å; S259-P263 VanDerWaalsContact O-CD 3.22Å; S259-P263 WeakPolarHBondContact O-CD 3.49Å; S259-P263 WeakPolarHBondContact O-CG 3.31Å; S259-N461 PolarHBondContact OG-ND2 3.24Å |
| 260 | Y | 83.2 | Confident | 85.1 | Confident | 6 Ų | 6 | 35.8 Ų | 35.8 | 2% | 0.024 | 19% | 0.188 | C | C | . | . | H | α-helix | trans | -92.3 | -24.3 | 176.7 | -65.6 | -84.6 | 0 | 0 | 0 | 113 | Q257 M258 P263 I264 Q398 M458 N461 | Q257-Y260 PolarHBondContact O-N 3.24Å; M258-Y260 PolarHBondContact O-N 2.84Å; Y260-P263 WeakPolarHBondContact O-CD 3.22Å; Y260-I264 WeakPolarHBondContact O-CB 3.26Å; Y260-I264 VanDerWaalsContact O-CD1 3.3Å; Y260-I264 WeakPolarHBondContact O-CD1 3.21Å; Y260-I264 WeakPolarHBondContact O-CG1 3.13Å; Y260-I264 PolarHBondContact O-N 3.41Å; Y260-Q398 HydrophobicContact CD1-CG 3.9Å; Y260-Q398 HydrophobicContact CE1-CG 4.47Å; Y260-Q398 HydrophobicContact CG-CG 4Å; Y260-M458 HydrophobicContact CD1-CG 4.47Å; Y260-M458 HydrophobicContact CD1-SD 4.14Å; Y260-M458 HydrophobicContact CE1-CG 3.99Å; Y260-M458 HydrophobicContact CE1-SD 3.71Å; Y260-N461 WeakPolarHBondContact CE2-ND2 3.46Å |
| 261 | T | 87.2 | Confident | 85.6 | Confident | 0 Ų | 0 | 30.9 Ų | 30.9 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -59.3 | -54.5 | -177.6 | -63 | 0 | 0 | 0 | 0 | 113 | A72 T76 M258 I264 M265 | A72-T261 HydrophobicContact CB-CG2 3.57Å; A72-T261 PolarHBondContact O-OG1 3.16Å; T76-T261 HydrophobicContact CG2-CG2 3.36Å; M258-T261 PolarHBondContact O-N 3.29Å; M258-T261 VanDerWaalsContact O-N 3.12Å; T261-I264 PolarHBondContact O-N 3.39Å; T261-M265 HydrophobicContact CG2-CG 4.42Å; T261-M265 HydrophobicContact CG2-SD 3.76Å; T261-M265 VanDerWaalsContact O-CG 3.3Å; T261-M265 WeakPolarHBondContact O-CG 3.1Å; T261-M265 PolarHBondContact O-N 3.44Å |
| 262 | V | 89.3 | Confident | 86 | Confident | 38 Ų | 38 | 26 Ų | 26 | 23% | 0.23 | 14% | 0.142 | C | C | . | . | H | α-helix | trans | -64.4 | -42.2 | -176.2 | -167.8 | 0 | 0 | 0 | 0 | 111.5 | L84 I88 M265 A266 F450 | L84-V262 HydrophobicContact CD1-CG2 4.4Å; I88-V262 HydrophobicContact CD1-CG1 4.35Å; V262-M265 PolarHBondContact O-N 2.9Å; V262-A266 WeakPolarHBondContact O-CB 3.4Å; V262-A266 PolarHBondContact O-N 3.47Å; V262-F450 HydrophobicContact CB-CE2 3.83Å; V262-F450 HydrophobicContact CB-CZ 4.32Å; V262-F450 HydrophobicContact CG1-CD2 4.14Å; V262-F450 HydrophobicContact CG1-CE2 3.25Å; V262-F450 HydrophobicContact CG1-CZ 3.7Å |
| 263 | P | 92.1 | Very high | 86.3 | Confident | 0 Ų | 0 | 19.8 Ų | 19.8 | 0% | 0 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -55.1 | -45.8 | 168.2 | -31.6 | 38.9 | 0 | 0 | 0 | 114.8 | S259 Y260 M265 A266 F267 G405 | S259-P263 VanDerWaalsContact O-CD 3.22Å; S259-P263 WeakPolarHBondContact O-CD 3.49Å; S259-P263 WeakPolarHBondContact O-CG 3.31Å; Y260-P263 WeakPolarHBondContact O-CD 3.22Å; P263-M265 VanDerWaalsContact C-N 3.32Å; P263-M265 PolarHBondContact O-N 3.37Å; P263-A266 PolarHBondContact O-N 3.42Å; P263-F267 WeakPolarHBondContact O-CB 3.41Å; P263-F267 PolarHBondContact O-N 3.38Å; P263-G405 VanDerWaalsContact O-CA 3.29Å; P263-G405 WeakPolarHBondContact O-CA 3.48Å |
| 264 | I | 92.1 | Very high | 86.7 | Confident | 2 Ų | 2 | 19.4 Ų | 19.4 | 1% | 0.01 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -58.7 | -45.9 | 177.8 | -69.7 | 160.5 | 0 | 0 | 0 | 110.2 | L69 Y71 Y260 T261 F267 A268 F401 | L69-I264 HydrophobicContact CD2-CG2 4.25Å; Y71-I264 HydrophobicContact CD1-CD1 3.94Å; Y71-I264 HydrophobicContact CE1-CD1 4.26Å; Y260-I264 WeakPolarHBondContact O-CB 3.26Å; Y260-I264 VanDerWaalsContact O-CD1 3.3Å; Y260-I264 WeakPolarHBondContact O-CD1 3.21Å; Y260-I264 WeakPolarHBondContact O-CG1 3.13Å; Y260-I264 PolarHBondContact O-N 3.41Å; T261-I264 PolarHBondContact O-N 3.39Å; I264-F267 PolarHBondContact O-N 3.21Å; I264-A268 WeakPolarHBondContact O-CB 3.36Å; I264-A268 PolarHBondContact O-N 2.95Å; I264-F401 HydrophobicContact CB-CB 4.49Å; I264-F401 HydrophobicContact CG1-CB 3.6Å; I264-F401 HydrophobicContact CG1-CD2 4.26Å; I264-F401 HydrophobicContact CG1-CG 4.34Å |
| 265 | M | 92.8 | Very high | 87.4 | Confident | 0 Ų | 0 | 15 Ų | 15 | 0% | 0 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -67.1 | -40.2 | 179.1 | -62.5 | 172.5 | 81.4 | 0 | 0 | 112 | L69 F81 L84 L85 I88 T261 V262 P263 A268 F269 | L69-M265 HydrophobicContact CD2-CG 4.13Å; F81-M265 HydrophobicContact CD2-CE 3.89Å; F81-M265 HydrophobicContact CD2-SD 4Å; F81-M265 HydrophobicContact CE2-CE 3.78Å; F81-M265 HydrophobicContact CE2-CG 4.14Å; F81-M265 HydrophobicContact CE2-SD 3.95Å; F81-M265 HydrophobicContact CG-CE 4.39Å; F81-M265 HydrophobicContact CZ-CE 4.2Å; F81-M265 WeakPolarHBondContact O-CE 3.21Å; L84-M265 HydrophobicContact CB-CE 3.67Å; L84-M265 HydrophobicContact CB-SD 4.08Å; L84-M265 HydrophobicContact CD1-SD 4.46Å; L85-M265 HydrophobicContact CB-CE 3.55Å; L85-M265 HydrophobicContact CD1-CE 3.68Å; L85-M265 HydrophobicContact CG-CE 4.26Å; I88-M265 HydrophobicContact CD1-CB 3.54Å; T261-M265 HydrophobicContact CG2-CG 4.42Å; T261-M265 HydrophobicContact CG2-SD 3.76Å; T261-M265 VanDerWaalsContact O-CG 3.3Å; T261-M265 WeakPolarHBondContact O-CG 3.1Å; T261-M265 PolarHBondContact O-N 3.44Å; V262-M265 PolarHBondContact O-N 2.9Å; P263-M265 VanDerWaalsContact C-N 3.32Å; P263-M265 PolarHBondContact O-N 3.37Å; M265-A268 PolarHBondContact O-N 3.35Å; M265-F269 PolarHBondContact O-N 3.45Å |
| 266 | A | 92.8 | Very high | 88.1 | Confident | 1 Ų | 1 | 12 Ų | 12 | 1% | 0.008 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -62.6 | -46.3 | 175.6 | 0 | 0 | 0 | 0 | 0 | 110.8 | V262 P263 A268 F269 V270 A409 I413 F450 | V262-A266 WeakPolarHBondContact O-CB 3.4Å; V262-A266 PolarHBondContact O-N 3.47Å; P263-A266 PolarHBondContact O-N 3.42Å; A266-A268 VanDerWaalsContact C-N 3.33Å; A266-A268 PolarHBondContact O-N 2.96Å; A266-F269 PolarHBondContact O-N 3.12Å; A266-V270 VanDerWaalsContact O-CG2 3.31Å; A266-V270 WeakPolarHBondContact O-CG2 3.28Å; A266-V270 PolarHBondContact O-N 3.11Å; A266-A409 HydrophobicContact CB-CB 3.88Å; A266-I413 WeakPolarHBondContact O-CD1 3.41Å; A266-F450 HydrophobicContact CB-CE1 3.79Å; A266-F450 HydrophobicContact CB-CZ 3.9Å |
| 267 | F | 92.6 | Very high | 88.7 | Confident | 12 Ų | 12 | 9.8 Ų | 9.8 | 5% | 0.053 | 5% | 0.052 | C | C | . | . | H | α-helix | trans | -55.9 | -45.1 | 174.5 | 171.2 | -102.7 | 0 | 0 | 0 | 111.9 | H134 A138 P263 I264 F269 V270 F401 I404 | H134-F267 AromaticContact CE1-CD2 3.85Å; H134-F267 AromaticContact CE1-CE2 3.98Å; A138-F267 HydrophobicContact CB-CE2 4.06Å; A138-F267 HydrophobicContact CB-CZ 4.06Å; P263-F267 WeakPolarHBondContact O-CB 3.41Å; P263-F267 PolarHBondContact O-N 3.38Å; I264-F267 PolarHBondContact O-N 3.21Å; F267-F269 PolarHBondContact O-N 2.98Å; F267-F269 VanDerWaalsContact O-N 3.16Å; F267-V270 PolarHBondContact O-N 3.17Å; F267-F401 AromaticContact CD1-CD1 3.62Å; F267-F401 HydrophobicContact CD1-CD1 3.62Å; F267-F401 AromaticContact CD1-CE1 3.97Å; F267-F401 HydrophobicContact CD1-CE1 3.97Å; F267-F401 HydrophobicContact CD1-CG 4.39Å; F267-F401 AromaticContact CE1-CD1 3.48Å; F267-F401 HydrophobicContact CE1-CD1 3.48Å; F267-F401 VanDerWaalsContact CE1-CD1 3.48Å; F267-F401 AromaticContact CE1-CE1 3.41Å; F267-F401 HydrophobicContact CE1-CE1 3.41Å; F267-F401 VanDerWaalsContact CE1-CE1 3.41Å; F267-F401 HydrophobicContact CE1-CZ 4.48Å; F267-F401 HydrophobicContact CG-CD1 4.41Å; F267-F401 HydrophobicContact CZ-CD1 4.16Å; F267-F401 HydrophobicContact CZ-CE1 4.11Å; F267-I404 HydrophobicContact CD2-CB 4.29Å; F267-I404 HydrophobicContact CD2-CG2 3.67Å; F267-I404 HydrophobicContact CE2-CG2 3.84Å |
| 268 | A | 93.2 | Very high | 89.3 | Confident | 1 Ų | 1 | 8.8 Ų | 8.8 | 1% | 0.008 | 5% | 0.048 | C | C | . | . | H | α-helix | trans | -63.5 | -19.2 | -178.7 | 0 | 0 | 0 | 0 | 0 | 114.8 | I61 L69 I264 M265 A266 Y305 | I61-A268 WeakPolarHBondContact CG2-O 3.45Å; I61-A268 VanDerWaalsContact O-O 3.04Å; L69-A268 HydrophobicContact CD2-CB 4.26Å; I264-A268 WeakPolarHBondContact O-CB 3.36Å; I264-A268 PolarHBondContact O-N 2.95Å; M265-A268 PolarHBondContact O-N 3.35Å; A266-A268 VanDerWaalsContact C-N 3.33Å; A266-A268 PolarHBondContact O-N 2.96Å; A268-Y305 HydrophobicContact CB-CE2 3.89Å; A268-Y305 WeakPolarHBondContact O-CE2 3.45Å; A268-Y305 PolarHBondContact O-OH 3.31Å |
| 269 | F | 93.5 | Very high | 89.8 | Confident | 0 Ų | 0 | 6.8 Ų | 6.8 | 0% | 0 | 4% | 0.038 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -109.5 | 7.6 | 179.6 | -81.8 | -71.5 | 0 | 0 | 0 | 114.4 | I61 L85 I88 A89 S92 M265 A266 F267 C271 I298 F302 Y305 | I61-F269 HydrophobicContact CG2-CD1 4.15Å; L85-F269 HydrophobicContact CD1-CE2 3.55Å; L85-F269 HydrophobicContact CD1-CZ 4.25Å; L85-F269 HydrophobicContact CG-CE2 3.9Å; L85-F269 HydrophobicContact CG-CZ 4.27Å; I88-F269 HydrophobicContact CB-CD2 4.41Å; I88-F269 HydrophobicContact CG2-CB 3.88Å; I88-F269 HydrophobicContact CG2-CD2 3.73Å; I88-F269 HydrophobicContact CG2-CG 4.12Å; A89-F269 HydrophobicContact CB-CD1 4.5Å; A89-F269 HydrophobicContact CB-CE1 3.93Å; A89-F269 HydrophobicContact CB-CE2 4.36Å; A89-F269 HydrophobicContact CB-CZ 3.85Å; S92-F269 PolarHBondContact OG-O 2.99Å; M265-F269 PolarHBondContact O-N 3.45Å; A266-F269 PolarHBondContact O-N 3.12Å; F267-F269 PolarHBondContact O-N 2.98Å; F267-F269 VanDerWaalsContact O-N 3.16Å; F269-C271 PolarHBondContact O-N 3.17Å; F269-I298 HydrophobicContact CD1-CG2 4.47Å; F269-I298 HydrophobicContact CE1-CG2 4.2Å; F269-F302 HydrophobicContact CZ-CB 4.35Å; F269-Y305 HydrophobicContact CD1-CE2 4.5Å; F269-Y305 HydrophobicContact CE1-CD2 4.18Å; F269-Y305 HydrophobicContact CE1-CE2 4.21Å; F269-Y305 AromaticContact CE2-CD2 3.92Å; F269-Y305 HydrophobicContact CE2-CD2 3.92Å; F269-Y305 HydrophobicContact CE2-CE2 4.27Å; F269-Y305 AromaticContact CZ-CD2 3.67Å; F269-Y305 HydrophobicContact CZ-CD2 3.67Å; F269-Y305 HydrophobicContact CZ-CE2 4.09Å |
| 270 | V | 93.3 | Very high | 90.1 | Very high | 5 Ų | 5 | 8 Ų | 8 | 3% | 0.03 | 4% | 0.044 | C | C | . | . | trans | -77.1 | 113 | 172.7 | -173 | 0 | 0 | 0 | 0 | 109.7 | H134 A266 F267 A409 L412 I413 | H134-V270 WeakPolarHBondContact CE1-CB 3.42Å; H134-V270 VanDerWaalsContact CE1-CG1 3.44Å; H134-V270 WeakPolarHBondContact CE1-CG1 3.27Å; H134-V270 WeakPolarHBondContact NE2-CB 3.45Å; H134-V270 VanDerWaalsContact NE2-CG1 3.26Å; H134-V270 WeakPolarHBondContact NE2-CG1 3.46Å; A266-V270 VanDerWaalsContact O-CG2 3.31Å; A266-V270 WeakPolarHBondContact O-CG2 3.28Å; A266-V270 PolarHBondContact O-N 3.11Å; F267-V270 PolarHBondContact O-N 3.17Å; V270-A409 HydrophobicContact CG2-CB 3.37Å; V270-L412 HydrophobicContact CG1-CB 4.11Å; V270-L412 HydrophobicContact CG1-CD1 3.73Å; V270-I413 HydrophobicContact CG2-CD1 3.79Å; V270-I413 HydrophobicContact CG2-CG1 4.1Å | ||
| 271 | C | 92.9 | Very high | 90.2 | Very high | 1 Ų | 1 | 10.4 Ų | 10.4 | 1% | 0.007 | 6% | 0.056 | C | C | . | . | trans | -130.4 | 2.3 | 167.8 | 62 | 0 | 0 | 0 | 0 | 113.2 | L57 I61 F269 P273 E274 V275 | L57-C271 HydrophobicContact CD1-CB 3.79Å; I61-C271 HydrophobicContact CD1-CB 4.37Å; I61-C271 HydrophobicContact CG1-CB 3.49Å; I61-C271 VanDerWaalsContact CG1-CB 3.49Å; F269-C271 PolarHBondContact O-N 3.17Å; C271-P273 VanDerWaalsContact C-N 3.34Å; C271-E274 PolarHBondContact O-N 2.84Å; C271-V275 PolarHBondContact O-N 3.37Å | ||
| 272 | H | 92.8 | Very high | 90.2 | Very high | 0 Ų | 0 | 10.4 Ų | 10.4 | 0% | 0 | 6% | 0.056 | C | C | . | . | H | α-helix | trans | -50.6 | -40.3 | -174.5 | -64.6 | 76.9 | 0 | 0 | 0 | 114.7 | S92 S95 Y111 E274 V275 L412 | S92-H272 PolarHBondContact OG-CE1 3.49Å; S95-H272 VanDerWaalsContact CB-NE2 3.29Å; S95-H272 WeakPolarHBondContact CB-NE2 3.37Å; S95-H272 PolarHBondContact OG-CD2 3.46Å; S95-H272 PolarHBondContact OG-NE2 3.42Å; Y111-H272 WeakPolarHBondContact CD2-O 3.07Å; Y111-H272 HydrophobicContact CE2-CB 3.98Å; H272-E274 VanDerWaalsContact C-N 3.25Å; H272-E274 PolarHBondContact O-N 3.3Å; H272-V275 PolarHBondContact O-N 3Å; H272-L412 HydrophobicContact CB-CB 4.31Å; H272-L412 PolarHBondContact CD2-O 3.47Å |
| 273 | P | 89.4 | Confident | 90 | Very high | 5 Ų | 5 | 10.6 Ų | 10.6 | 3% | 0.032 | 6% | 0.058 | C | C | . | . | H | α-helix | trans | -62.2 | -29.7 | 176.2 | -24.2 | 36.3 | 0 | 0 | 0 | 114.1 | I131 C271 P277 L412 | I131-P273 HydrophobicContact CG1-CB 4.43Å; I131-P273 HydrophobicContact CG1-CG 4.34Å; I131-P273 HydrophobicContact CG2-CB 4.06Å; I131-P273 HydrophobicContact CG2-CG 4.42Å; C271-P273 VanDerWaalsContact C-N 3.34Å; P273-P277 WeakPolarHBondContact O-CD 3.37Å; P273-P277 WeakPolarHBondContact O-CG 3.39Å; P273-L412 HydrophobicContact CG-CD1 3.84Å; P273-L412 HydrophobicContact CG-CD2 4.31Å |
| 274 | E | 88.7 | Confident | 89.7 | Confident | 17 Ų | 17 | 19.5 Ų | 19.5 | 8% | 0.079 | 9% | 0.092 | C | C | . | . | H | α-helix | trans | -88.2 | -21.6 | -176.2 | -56.6 | -54.6 | 148.2 | 0 | 0 | 113.4 | A60 C271 H272 L276 P277 I278 P356 | A60-E274 HydrophobicContact CB-CB 4.15Å; A60-E274 HydrophobicContact CB-CG 3.71Å; C271-E274 PolarHBondContact O-N 2.84Å; H272-E274 VanDerWaalsContact C-N 3.25Å; H272-E274 PolarHBondContact O-N 3.3Å; E274-L276 PolarHBondContact O-N 2.95Å; E274-P277 WeakPolarHBondContact O-CD 3.32Å; E274-I278 HydrophobicContact CB-CD1 4Å; E274-I278 WeakPolarHBondContact O-CB 2.97Å; E274-I278 VanDerWaalsContact O-CG1 3.24Å; E274-I278 WeakPolarHBondContact O-CG1 3.24Å; E274-I278 PolarHBondContact O-N 2.95Å; E274-P356 WeakPolarHBondContact OE1-CG 3.33Å; E274-P356 WeakPolarHBondContact OE2-CG 3.42Å |
| 275 | V | 91.4 | Very high | 89.3 | Confident | 0 Ų | 0 | 20.5 Ų | 20.5 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -56.9 | -48.8 | -175.5 | 171.7 | 0 | 0 | 0 | 0 | 111.9 | L57 I96 L99 L100 C271 H272 Y279 M290 | L57-V275 HydrophobicContact CD1-CG2 4.09Å; I96-V275 HydrophobicContact CD1-CG2 4.01Å; I96-V275 HydrophobicContact CG1-CG2 4.15Å; I96-V275 HydrophobicContact CG2-CG1 4.1Å; I96-V275 HydrophobicContact CG2-CG2 4.49Å; L99-V275 HydrophobicContact CD2-CB 4.46Å; L99-V275 HydrophobicContact CD2-CG1 4.49Å; L100-V275 HydrophobicContact CD2-CG1 3.9Å; L100-V275 HydrophobicContact CG-CG1 4.35Å; C271-V275 PolarHBondContact O-N 3.37Å; H272-V275 PolarHBondContact O-N 3Å; V275-Y279 VanDerWaalsContact O-CB 3.3Å; V275-Y279 WeakPolarHBondContact O-CB 3.42Å; V275-Y279 PolarHBondContact O-N 3.45Å; V275-M290 HydrophobicContact CG1-CE 4.05Å |
| 276 | L | 88.9 | Confident | 89.2 | Confident | 0 Ų | 0 | 22.4 Ų | 22.4 | 0% | 0 | 11% | 0.112 | C | C | . | . | H | α-helix | trans | -72.4 | -43.6 | -176.8 | -63.3 | 179 | 0 | 0 | 0 | 113.1 | L99 L100 A103 Y111 E274 Y279 T280 | L99-L276 HydrophobicContact CD1-CD1 4.46Å; L99-L276 HydrophobicContact CD2-CG 4.38Å; L100-L276 HydrophobicContact CD2-CD2 4.3Å; A103-L276 HydrophobicContact CB-CD2 3.73Å; Y111-L276 HydrophobicContact CD2-CD1 4.32Å; Y111-L276 HydrophobicContact CG-CD1 4.39Å; E274-L276 PolarHBondContact O-N 2.95Å; L276-Y279 WeakPolarHBondContact O-CB 3.2Å; L276-Y279 PolarHBondContact O-N 2.75Å; L276-T280 PolarHBondContact O-N 3.37Å; L276-T280 VanDerWaalsContact O-N 3.07Å |
| 277 | P | 85.5 | Confident | 89.1 | Confident | 13 Ų | 13 | 25.6 Ų | 25.6 | 8% | 0.084 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -53.5 | -50 | 167.9 | -28.3 | 35 | 0 | 0 | 0 | 113.3 | P273 E274 Y279 T280 E281 | P273-P277 WeakPolarHBondContact O-CD 3.37Å; P273-P277 WeakPolarHBondContact O-CG 3.39Å; E274-P277 WeakPolarHBondContact O-CD 3.32Å; P277-Y279 PolarHBondContact O-N 2.76Å; P277-T280 PolarHBondContact O-N 3.22Å; P277-T280 PolarHBondContact O-OG1 3.45Å; P277-E281 PolarHBondContact O-N 2.85Å |
| 278 | I | 87.8 | Confident | 89 | Confident | 10 Ų | 10 | 33.4 Ų | 33.4 | 5% | 0.051 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -61.1 | -37.2 | 178 | -67.3 | 169.3 | 0 | 0 | 0 | 110.6 | N56 L57 E274 T280 E281 L282 M290 | N56-I278 HydrophobicContact CB-CD1 3.94Å; N56-I278 HydrophobicContact CB-CG1 4.35Å; L57-I278 HydrophobicContact CB-CD1 3.89Å; L57-I278 HydrophobicContact CD1-CD1 3.99Å; E274-I278 HydrophobicContact CB-CD1 4Å; E274-I278 WeakPolarHBondContact O-CB 2.97Å; E274-I278 VanDerWaalsContact O-CG1 3.24Å; E274-I278 WeakPolarHBondContact O-CG1 3.24Å; E274-I278 PolarHBondContact O-N 2.95Å; I278-T280 VanDerWaalsContact C-N 3.29Å; I278-T280 PolarHBondContact O-N 3.29Å; I278-E281 PolarHBondContact O-N 2.95Å; I278-E281 VanDerWaalsContact O-N 3.14Å; I278-L282 PolarHBondContact O-N 3.19Å; I278-M290 HydrophobicContact CB-CE 4.16Å; I278-M290 HydrophobicContact CG2-CE 3.85Å; I278-M290 HydrophobicContact CG2-SD 4.24Å |
| 279 | Y | 88.1 | Confident | 89 | Confident | 17 Ų | 17 | 37.2 Ų | 37.2 | 7% | 0.067 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -64.1 | -31 | 176.3 | -171.2 | -159.9 | 0 | 0 | 0 | 113.3 | L100 R109 V275 L276 P277 E281 L282 P285 S286 K287 M290 | L100-Y279 HydrophobicContact CD2-CD1 3.86Å; L100-Y279 HydrophobicContact CD2-CE1 4.17Å; R109-Y279 PolarHBondContact NH1-O 3.26Å; V275-Y279 VanDerWaalsContact O-CB 3.3Å; V275-Y279 WeakPolarHBondContact O-CB 3.42Å; V275-Y279 PolarHBondContact O-N 3.45Å; L276-Y279 WeakPolarHBondContact O-CB 3.2Å; L276-Y279 PolarHBondContact O-N 2.75Å; P277-Y279 PolarHBondContact O-N 2.76Å; Y279-E281 VanDerWaalsContact C-N 3.33Å; Y279-L282 HydrophobicContact CD2-CD2 4.49Å; Y279-P285 HydrophobicContact CD2-CB 3.88Å; Y279-P285 HydrophobicContact CE2-CB 3.56Å; Y279-S286 VanDerWaalsContact OH-C 3.26Å; Y279-K287 PolarHBondContact OH-N 2.91Å; Y279-K287 VanDerWaalsContact OH-N 3.16Å; Y279-M290 HydrophobicContact CD1-CG 4.41Å; Y279-M290 HydrophobicContact CD2-CB 3.7Å; Y279-M290 HydrophobicContact CD2-CG 3.87Å; Y279-M290 HydrophobicContact CD2-SD 4.24Å; Y279-M290 HydrophobicContact CE2-CB 3.94Å; Y279-M290 HydrophobicContact CG-CB 4.09Å; Y279-M290 HydrophobicContact CG-CG 3.8Å; Y279-M290 HydrophobicContact CG-SD 4.28Å |
| 280 | T | 84.9 | Confident | 89 | Confident | 39 Ų | 39 | 37.2 Ų | 37.2 | 24% | 0.239 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -71.2 | -28.6 | 174 | 57.9 | 0 | 0 | 0 | 0 | 113.4 | R109 L276 P277 I278 | R109-T280 HydrophobicContact CB-CG2 3.36Å; R109-T280 HydrophobicContact CG-CG2 4.15Å; L276-T280 PolarHBondContact O-N 3.37Å; L276-T280 VanDerWaalsContact O-N 3.07Å; P277-T280 PolarHBondContact O-N 3.22Å; P277-T280 PolarHBondContact O-OG1 3.45Å; I278-T280 VanDerWaalsContact C-N 3.29Å; I278-T280 PolarHBondContact O-N 3.29Å |
| 281 | E | 84.3 | Confident | 89.1 | Confident | 58 Ų | 58 | 38 Ų | 38 | 27% | 0.271 | 17% | 0.172 | S | C | . | . | H | α-helix | trans | -91.9 | -17.9 | -177.7 | -59.1 | -172.2 | 164.1 | 0 | 0 | 113 | G46 K47 T48 P277 I278 Y279 C283 | G46-E281 CarbonylContact C-O 3.42Å; G46-E281 WeakPolarHBondContact CA-O 3.2Å; K47-E281 PolarHBondContact N-O 3.1Å; K47-E281 VanDerWaalsContact N-O 3.17Å; T48-E281 WeakPolarHBondContact CB-O 3.38Å; T48-E281 PolarHBondContact N-O 3.41Å; T48-E281 WeakPolarHBondContact OG1-CB 3.48Å; T48-E281 PolarHBondContact OG1-O 3.33Å; P277-E281 PolarHBondContact O-N 2.85Å; I278-E281 PolarHBondContact O-N 2.95Å; I278-E281 VanDerWaalsContact O-N 3.14Å; Y279-E281 VanDerWaalsContact C-N 3.33Å; E281-C283 PolarHBondContact O-N 2.98Å |
| 282 | L | 87.1 | Confident | 89.3 | Confident | 0 Ų | 0 | 39.8 Ų | 39.8 | 0% | 0 | 19% | 0.187 | C | C | . | . | B | Isolated β-bridge | trans | -60.2 | 126 | 179.9 | -178 | 65 | 0 | 0 | 0 | 112.2 | S53 I278 Y279 R284 P285 R289 M290 | S53-L282 VanDerWaalsContact OG-CD1 3.28Å; S53-L282 WeakPolarHBondContact OG-CD1 3.13Å; I278-L282 PolarHBondContact O-N 3.19Å; Y279-L282 HydrophobicContact CD2-CD2 4.49Å; L282-R284 PolarHBondContact O-N 2.94Å; L282-P285 VanDerWaalsContact O-CD 3.32Å; L282-P285 WeakPolarHBondContact O-CD 3.3Å; L282-R289 HydrophobicContact CD2-CB 4.28Å; L282-M290 HydrophobicContact CD2-CB 4.36Å; L282-M290 HydrophobicContact CD2-SD 4.21Å |
| 283 | C | 86.4 | Confident | 89.5 | Confident | 42 Ų | 42 | 39.8 Ų | 39.8 | 28% | 0.284 | 19% | 0.187 | S | C | . | . | S | Bend | trans | -63.6 | 129.4 | 174.6 | 177.2 | 0 | 0 | 0 | 0 | 111.4 | G46 T48 E281 R289 | G46-C283 WeakPolarHBondContact O-CA 3.34Å; G46-C283 WeakPolarHBondContact O-CB 3.38Å; T48-C283 WeakPolarHBondContact O-CB 3.39Å; T48-C283 PolarHBondContact O-N 3.41Å; E281-C283 PolarHBondContact O-N 2.98Å; C283-R289 PolarHBondContact O-NH1 3.32Å |
| 284 | R | 85.8 | Confident | 89.8 | Confident | 187 Ų | 187 | 39.6 Ų | 39.6 | 71% | 0.706 | 19% | 0.185 | S | C | * | . | S | Bend | trans | 48.1 | 68.5 | -171.7 | -58.9 | 174.7 | -175.6 | 175.9 | 0.5 | 111.3 | L282 S286 R289 | L282-R284 PolarHBondContact O-N 2.94Å; R284-S286 PolarHBondContact O-N 2.97Å; R284-R289 PolarHBondContact O-NH1 3.46Å |
| 285 | P | 84.3 | Confident | 90.2 | Very high | 23 Ų | 23 | 42.2 Ų | 42.2 | 15% | 0.149 | 20% | 0.2 | C | C | . | . | trans | -71.1 | 125.4 | -170.3 | 28.3 | -32.8 | 0 | 0 | 0 | 110.9 | M42 Y279 L282 | M42-P285 HydrophobicContact CE-CG 4.37Å; Y279-P285 HydrophobicContact CD2-CB 3.88Å; Y279-P285 HydrophobicContact CE2-CB 3.56Å; L282-P285 VanDerWaalsContact O-CD 3.32Å; L282-P285 WeakPolarHBondContact O-CD 3.3Å | ||
| 286 | S | 90.3 | Very high | 90.5 | Very high | 40 Ų | 40 | 45.9 Ų | 45.9 | 28% | 0.28 | 22% | 0.222 | S | C | . | . | trans | -137 | 156 | 168.7 | 75.4 | 0 | 0 | 0 | 0 | 111 | Y279 R284 R288 R289 M290 | Y279-S286 VanDerWaalsContact OH-C 3.26Å; R284-S286 PolarHBondContact O-N 2.97Å; S286-R288 VanDerWaalsContact C-N 3.33Å; S286-R288 PolarHBondContact O-N 3.31Å; S286-R289 PolarHBondContact O-N 2.93Å; S286-R289 WeakPolarHBondContact OG-CB 3.38Å; S286-R289 VanDerWaalsContact OG-CG 3.3Å; S286-R289 WeakPolarHBondContact OG-CG 3.3Å; S286-R289 PolarHBondContact OG-N 2.95Å; S286-M290 PolarHBondContact O-N 3.06Å | ||
| 287 | K | 89.7 | Confident | 90.8 | Very high | 67 Ų | 67 | 45.9 Ų | 45.9 | 29% | 0.291 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -56.6 | -47.2 | 179.5 | -177.3 | -174.2 | 177.2 | -167.3 | 0 | 111.2 | H97 L100 T101 Y279 R289 M290 Q291 | H97-K287 PolarHBondContact NE2-NZ 2.89Å; L100-K287 HydrophobicContact CB-CG 4.22Å; T101-K287 VanDerWaalsContact OG1-CE 3.27Å; T101-K287 WeakPolarHBondContact OG1-CE 3.46Å; T101-K287 PolarHBondContact OG1-NZ 3.22Å; Y279-K287 PolarHBondContact OH-N 2.91Å; Y279-K287 VanDerWaalsContact OH-N 3.16Å; K287-R289 VanDerWaalsContact C-N 3.34Å; K287-R289 PolarHBondContact O-N 3.36Å; K287-M290 PolarHBondContact O-N 3.04Å; K287-Q291 WeakPolarHBondContact O-CB 3.48Å; K287-Q291 PolarHBondContact O-N 2.82Å |
| 288 | R | 91.4 | Very high | 91.4 | Very high | 177 Ų | 177 | 45.7 Ų | 45.7 | 67% | 0.668 | 22% | 0.22 | S | C | * | . | H | α-helix | trans | -59 | -44.1 | 178.9 | -68.5 | -174.4 | -175 | 152.9 | 8.6 | 111.7 | D18 S286 Q291 A292 | D18-R288 IonicContact OD2-CZ 3.46Å; D18-R288 IonicContact OD2-NH1 3Å; D18-R288 PolarHBondContact OD2-NH1 3.47Å; D18-R288 IonicContact OD2-NH2 3.37Å; D18-R288 PolarHBondContact OD2-NH2 2.93Å; S286-R288 VanDerWaalsContact C-N 3.33Å; S286-R288 PolarHBondContact O-N 3.31Å; R288-Q291 PolarHBondContact O-N 3.43Å; R288-A292 WeakPolarHBondContact O-CB 3.49Å; R288-A292 PolarHBondContact O-N 3.31Å |
| 289 | R | 93.3 | Very high | 91.8 | Very high | 81 Ų | 81 | 46.9 Ų | 46.9 | 31% | 0.306 | 24% | 0.235 | S | C | . | . | H | α-helix | trans | -69.1 | -42.1 | -179.8 | -70.7 | -176.1 | 73.6 | -155.4 | 0.3 | 112.2 | L282 C283 R284 S286 K287 A292 V293 | L282-R289 HydrophobicContact CD2-CB 4.28Å; C283-R289 PolarHBondContact O-NH1 3.32Å; R284-R289 PolarHBondContact O-NH1 3.46Å; S286-R289 PolarHBondContact O-N 2.93Å; S286-R289 WeakPolarHBondContact OG-CB 3.38Å; S286-R289 VanDerWaalsContact OG-CG 3.3Å; S286-R289 WeakPolarHBondContact OG-CG 3.3Å; S286-R289 PolarHBondContact OG-N 2.95Å; K287-R289 VanDerWaalsContact C-N 3.34Å; K287-R289 PolarHBondContact O-N 3.36Å; R289-A292 WeakPolarHBondContact O-CB 3.39Å; R289-A292 PolarHBondContact O-N 2.88Å; R289-V293 WeakPolarHBondContact O-CG2 3.43Å; R289-V293 PolarHBondContact O-N 3.4Å |
| 290 | M | 94.1 | Very high | 92.1 | Very high | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -66.7 | -37.5 | 176.6 | -169.6 | 62.7 | -148.2 | 0 | 0 | 112 | L57 L100 V275 I278 Y279 L282 S286 K287 A292 V293 A294 | L57-M290 HydrophobicContact CD2-CE 4.28Å; L100-M290 HydrophobicContact CD1-CB 4.09Å; L100-M290 HydrophobicContact CD1-CG 4Å; L100-M290 HydrophobicContact CD2-CB 4.37Å; L100-M290 HydrophobicContact CD2-CG 3.87Å; V275-M290 HydrophobicContact CG1-CE 4.05Å; I278-M290 HydrophobicContact CB-CE 4.16Å; I278-M290 HydrophobicContact CG2-CE 3.85Å; I278-M290 HydrophobicContact CG2-SD 4.24Å; Y279-M290 HydrophobicContact CD1-CG 4.41Å; Y279-M290 HydrophobicContact CD2-CB 3.7Å; Y279-M290 HydrophobicContact CD2-CG 3.87Å; Y279-M290 HydrophobicContact CD2-SD 4.24Å; Y279-M290 HydrophobicContact CE2-CB 3.94Å; Y279-M290 HydrophobicContact CG-CB 4.09Å; Y279-M290 HydrophobicContact CG-CG 3.8Å; Y279-M290 HydrophobicContact CG-SD 4.28Å; L282-M290 HydrophobicContact CD2-CB 4.36Å; L282-M290 HydrophobicContact CD2-SD 4.21Å; S286-M290 PolarHBondContact O-N 3.06Å; K287-M290 PolarHBondContact O-N 3.04Å; M290-A292 VanDerWaalsContact C-N 3.33Å; M290-A292 PolarHBondContact O-N 3.48Å; M290-V293 HydrophobicContact CE-CB 4.41Å; M290-V293 HydrophobicContact CE-CG1 4.16Å; M290-V293 WeakPolarHBondContact O-CB 3.02Å; M290-V293 PolarHBondContact O-N 3.09Å; M290-V293 HydrophobicContact SD-CB 4.4Å; M290-A294 PolarHBondContact O-N 2.87Å |
| 291 | Q | 95.4 | Very high | 92.6 | Very high | 22 Ų | 22 | 46.5 Ų | 46.5 | 10% | 0.103 | 24% | 0.239 | C | C | . | . | H | α-helix | trans | -63 | -40 | 172 | -171.9 | 68.4 | 47.8 | 0 | 0 | 111.6 | S93 L100 K287 R288 A294 N295 | S93-Q291 PolarHBondContact O-NE2 3.49Å; L100-Q291 HydrophobicContact CD1-CB 4.22Å; K287-Q291 WeakPolarHBondContact O-CB 3.48Å; K287-Q291 PolarHBondContact O-N 2.82Å; R288-Q291 PolarHBondContact O-N 3.43Å; Q291-A294 PolarHBondContact O-N 3.11Å; Q291-N295 PolarHBondContact NE2-OD1 3.25Å; Q291-N295 WeakPolarHBondContact O-CB 3.42Å; Q291-N295 VanDerWaalsContact O-CG 3.28Å; Q291-N295 PolarHBondContact O-N 2.89Å; Q291-N295 PolarHBondContact O-OD1 2.96Å |
| 292 | A | 96.3 | Very high | 93.2 | Very high | 38 Ų | 38 | 46.3 Ų | 46.3 | 31% | 0.314 | 24% | 0.237 | S | C | . | . | H | α-helix | trans | -63.6 | -41.1 | 174.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | F50 R288 R289 M290 A294 N295 V296 | F50-A292 HydrophobicContact CE2-CB 4Å; F50-A292 HydrophobicContact CZ-CB 4.21Å; R288-A292 WeakPolarHBondContact O-CB 3.49Å; R288-A292 PolarHBondContact O-N 3.31Å; R289-A292 WeakPolarHBondContact O-CB 3.39Å; R289-A292 PolarHBondContact O-N 2.88Å; M290-A292 VanDerWaalsContact C-N 3.33Å; M290-A292 PolarHBondContact O-N 3.48Å; A292-A294 VanDerWaalsContact C-N 3.3Å; A292-A294 PolarHBondContact O-N 3Å; A292-N295 PolarHBondContact O-N 3.06Å; A292-V296 WeakPolarHBondContact O-CB 3.3Å; A292-V296 VanDerWaalsContact O-CG2 3.26Å; A292-V296 WeakPolarHBondContact O-CG2 3.28Å; A292-V296 PolarHBondContact O-N 3.08Å |
| 293 | V | 96.1 | Very high | 93.7 | Very high | 0 Ų | 0 | 49.7 Ų | 49.7 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -56.7 | -46.6 | 172.1 | 172.4 | 0 | 0 | 0 | 0 | 110.4 | F50 V54 L57 R289 M290 S297 | F50-V293 HydrophobicContact CD2-CG2 3.49Å; F50-V293 VanDerWaalsContact CD2-CG2 3.49Å; F50-V293 HydrophobicContact CE2-CB 4.34Å; F50-V293 HydrophobicContact CE2-CG2 3.38Å; F50-V293 HydrophobicContact CG-CG2 4.34Å; F50-V293 HydrophobicContact CZ-CG2 4.15Å; V54-V293 HydrophobicContact CG2-CB 4.33Å; V54-V293 HydrophobicContact CG2-CG1 4.02Å; V54-V293 HydrophobicContact CG2-CG2 4.3Å; L57-V293 HydrophobicContact CB-CG1 4.35Å; L57-V293 HydrophobicContact CD2-CG1 3.98Å; R289-V293 WeakPolarHBondContact O-CG2 3.43Å; R289-V293 PolarHBondContact O-N 3.4Å; M290-V293 HydrophobicContact CE-CB 4.41Å; M290-V293 HydrophobicContact CE-CG1 4.16Å; M290-V293 WeakPolarHBondContact O-CB 3.02Å; M290-V293 PolarHBondContact O-N 3.09Å; M290-V293 HydrophobicContact SD-CB 4.4Å; V293-S297 VanDerWaalsContact O-CB 3.32Å; V293-S297 WeakPolarHBondContact O-CB 3.36Å; V293-S297 PolarHBondContact O-N 3.32Å; V293-S297 PolarHBondContact O-OG 3.36Å |
| 294 | A | 96.3 | Very high | 94.1 | Very high | 0 Ų | 0 | 48.6 Ų | 48.6 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -62.6 | -48.9 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.1 | L57 I96 M290 Q291 A292 V296 S297 I298 | L57-A294 HydrophobicContact CD2-CB 4.05Å; I96-A294 HydrophobicContact CD1-CB 3.87Å; I96-A294 HydrophobicContact CG2-CB 3.78Å; M290-A294 PolarHBondContact O-N 2.87Å; Q291-A294 PolarHBondContact O-N 3.11Å; A292-A294 VanDerWaalsContact C-N 3.3Å; A292-A294 PolarHBondContact O-N 3Å; A294-V296 PolarHBondContact O-N 3.36Å; A294-S297 PolarHBondContact O-N 2.93Å; A294-I298 WeakPolarHBondContact O-CB 3.36Å; A294-I298 WeakPolarHBondContact O-CG1 3.37Å; A294-I298 PolarHBondContact O-N 3.14Å |
| 295 | N | 96.9 | Very high | 94.6 | Very high | 73 Ų | 73 | 39.7 Ų | 39.7 | 39% | 0.39 | 22% | 0.217 | S | C | . | . | H | α-helix | trans | -65.4 | -41.6 | -177.9 | -69.4 | -2.3 | 0 | 0 | 0 | 112.1 | S93 Q291 A292 G299 | S93-N295 PolarHBondContact OG-OD1 3.33Å; Q291-N295 PolarHBondContact NE2-OD1 3.25Å; Q291-N295 WeakPolarHBondContact O-CB 3.42Å; Q291-N295 VanDerWaalsContact O-CG 3.28Å; Q291-N295 PolarHBondContact O-N 2.89Å; Q291-N295 PolarHBondContact O-OD1 2.96Å; A292-N295 PolarHBondContact O-N 3.06Å; N295-G299 PolarHBondContact O-N 2.8Å |
| 296 | V | 97.1 | Very high | 95.1 | Very high | 76 Ų | 76 | 38.9 Ų | 38.9 | 46% | 0.461 | 21% | 0.213 | S | C | . | . | H | α-helix | trans | -65 | -43.5 | 175.9 | 173.2 | 0 | 0 | 0 | 0 | 110.6 | V54 A292 A294 G299 A300 | V54-V296 HydrophobicContact CG1-CG1 3.94Å; V54-V296 HydrophobicContact CG2-CB 4.41Å; V54-V296 HydrophobicContact CG2-CG1 4.25Å; A292-V296 WeakPolarHBondContact O-CB 3.3Å; A292-V296 VanDerWaalsContact O-CG2 3.26Å; A292-V296 WeakPolarHBondContact O-CG2 3.28Å; A292-V296 PolarHBondContact O-N 3.08Å; A294-V296 PolarHBondContact O-N 3.36Å; V296-G299 PolarHBondContact O-N 3.1Å; V296-A300 WeakPolarHBondContact O-CB 3.45Å; V296-A300 PolarHBondContact O-N 3.06Å |
| 297 | S | 96.7 | Very high | 95.4 | Very high | 0 Ų | 0 | 40.7 Ų | 40.7 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -65.3 | -47.6 | 179.5 | -53.2 | 0 | 0 | 0 | 0 | 111.7 | V54 S58 V293 A294 G299 A300 M301 | V54-S297 PolarHBondContact O-OG 3.44Å; S58-S297 WeakPolarHBondContact OG-CB 3.45Å; V293-S297 VanDerWaalsContact O-CB 3.32Å; V293-S297 WeakPolarHBondContact O-CB 3.36Å; V293-S297 PolarHBondContact O-N 3.32Å; V293-S297 PolarHBondContact O-OG 3.36Å; A294-S297 PolarHBondContact O-N 2.93Å; S297-G299 PolarHBondContact O-N 3.46Å; S297-A300 PolarHBondContact O-N 3.01Å; S297-M301 WeakPolarHBondContact O-CB 3.46Å; S297-M301 VanDerWaalsContact O-CG 3.25Å; S297-M301 WeakPolarHBondContact O-CG 3.48Å; S297-M301 PolarHBondContact O-N 3.25Å |
| 298 | I | 96.6 | Very high | 95.6 | Very high | 9 Ų | 9 | 37.6 Ų | 37.6 | 5% | 0.046 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -62.5 | -43.5 | 177.5 | -70 | 171.5 | 0 | 0 | 0 | 111 | I61 A89 I96 F269 A294 M301 F302 | I61-I298 HydrophobicContact CD1-CG1 3.83Å; A89-I298 HydrophobicContact CB-CG2 3.85Å; I96-I298 HydrophobicContact CD1-CD1 3.76Å; F269-I298 HydrophobicContact CD1-CG2 4.47Å; F269-I298 HydrophobicContact CE1-CG2 4.2Å; A294-I298 WeakPolarHBondContact O-CB 3.36Å; A294-I298 WeakPolarHBondContact O-CG1 3.37Å; A294-I298 PolarHBondContact O-N 3.14Å; I298-M301 PolarHBondContact O-N 3Å; I298-F302 WeakPolarHBondContact O-CB 3.33Å; I298-F302 PolarHBondContact O-N 3.39Å |
| 299 | G | 96.8 | Very high | 95.8 | Very high | 35 Ų | 35 | 29.2 Ų | 29.2 | 36% | 0.361 | 17% | 0.174 | S | C | . | . | H | α-helix | trans | -62.8 | -44.4 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.7 | N295 V296 S297 M301 F302 C303 | N295-G299 PolarHBondContact O-N 2.8Å; V296-G299 PolarHBondContact O-N 3.1Å; S297-G299 PolarHBondContact O-N 3.46Å; G299-M301 VanDerWaalsContact C-N 3.35Å; G299-M301 PolarHBondContact O-N 3.41Å; G299-F302 PolarHBondContact O-N 2.86Å; G299-C303 PolarHBondContact O-N 3.44Å; G299-C303 PolarHBondContact O-SG 3.45Å |
| 300 | A | 95.4 | Very high | 95.8 | Very high | 42 Ų | 42 | 26.7 Ų | 26.7 | 35% | 0.347 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -61.1 | -44 | 175.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | V296 S297 C303 M304 | V296-A300 WeakPolarHBondContact O-CB 3.45Å; V296-A300 PolarHBondContact O-N 3.06Å; S297-A300 PolarHBondContact O-N 3.01Å; A300-C303 PolarHBondContact O-N 3.17Å; A300-M304 WeakPolarHBondContact O-CG 3.31Å; A300-M304 PolarHBondContact O-N 3.08Å |
| 301 | M | 95.6 | Very high | 95.7 | Very high | 7 Ų | 7 | 28.8 Ų | 28.8 | 3% | 0.034 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -71 | -35.7 | 179.7 | -65.1 | -59 | 99.4 | 0 | 0 | 112.7 | I61 M62 L202 S297 I298 G299 C303 M304 Y305 | I61-M301 HydrophobicContact CB-CB 4.41Å; I61-M301 HydrophobicContact CB-CG 3.84Å; I61-M301 HydrophobicContact CD1-CG 4.29Å; I61-M301 HydrophobicContact CG2-CB 3.61Å; I61-M301 HydrophobicContact CG2-CG 3.59Å; M62-M301 HydrophobicContact CB-SD 3.71Å; M62-M301 HydrophobicContact CG-SD 4.21Å; L202-M301 HydrophobicContact CD2-CE 3.93Å; L202-M301 HydrophobicContact CD2-SD 4.42Å; S297-M301 WeakPolarHBondContact O-CB 3.46Å; S297-M301 VanDerWaalsContact O-CG 3.25Å; S297-M301 WeakPolarHBondContact O-CG 3.48Å; S297-M301 PolarHBondContact O-N 3.25Å; I298-M301 PolarHBondContact O-N 3Å; G299-M301 VanDerWaalsContact C-N 3.35Å; G299-M301 PolarHBondContact O-N 3.41Å; M301-C303 VanDerWaalsContact C-N 3.32Å; M301-C303 PolarHBondContact O-N 2.87Å; M301-M304 HydrophobicContact CE-CB 4.47Å; M301-M304 HydrophobicContact CE-CG 3.95Å; M301-M304 PolarHBondContact O-N 3.04Å; M301-Y305 HydrophobicContact CB-CE2 4.34Å; M301-Y305 WeakPolarHBondContact O-CB 3.31Å; M301-Y305 WeakPolarHBondContact O-CD2 3.41Å; M301-Y305 PolarHBondContact O-N 3.23Å |
| 302 | F | 96.4 | Very high | 95.5 | Very high | 54 Ų | 54 | 27.7 Ų | 27.7 | 24% | 0.237 | 17% | 0.172 | C | C | . | . | H | α-helix | trans | -55.9 | -46.5 | 171 | 169.4 | -97.7 | 0 | 0 | 0 | 111.6 | L85 L86 A89 F269 I298 G299 G306 | L85-F302 HydrophobicContact CB-CD2 4.45Å; L85-F302 HydrophobicContact CB-CE2 4.18Å; L85-F302 HydrophobicContact CD2-CD2 3.76Å; L85-F302 HydrophobicContact CD2-CE2 3.87Å; L85-F302 HydrophobicContact CG-CD2 3.93Å; L85-F302 HydrophobicContact CG-CE2 4.11Å; L86-F302 HydrophobicContact CB-CE2 3.76Å; L86-F302 HydrophobicContact CB-CZ 4.14Å; L86-F302 HydrophobicContact CD1-CE2 4.15Å; L86-F302 HydrophobicContact CD1-CZ 4.1Å; A89-F302 HydrophobicContact CB-CD2 4.33Å; F269-F302 HydrophobicContact CZ-CB 4.35Å; I298-F302 WeakPolarHBondContact O-CB 3.33Å; I298-F302 PolarHBondContact O-N 3.39Å; G299-F302 PolarHBondContact O-N 2.86Å; F302-G306 PolarHBondContact O-N 3.12Å |
| 303 | C | 96.1 | Very high | 95.2 | Very high | 71 Ų | 71 | 26.1 Ų | 26.1 | 48% | 0.48 | 16% | 0.158 | S | C | . | . | H | α-helix | trans | -63.7 | -48 | 176.2 | -67.1 | 0 | 0 | 0 | 0 | 111.9 | G299 A300 M301 Y305 G306 L307 | G299-C303 PolarHBondContact O-N 3.44Å; G299-C303 PolarHBondContact O-SG 3.45Å; A300-C303 PolarHBondContact O-N 3.17Å; M301-C303 VanDerWaalsContact C-N 3.32Å; M301-C303 PolarHBondContact O-N 2.87Å; C303-Y305 PolarHBondContact O-N 3.38Å; C303-G306 PolarHBondContact O-N 2.88Å; C303-L307 WeakPolarHBondContact O-CB 3.21Å; C303-L307 VanDerWaalsContact O-CG 3.25Å; C303-L307 WeakPolarHBondContact O-CG 3.44Å; C303-L307 PolarHBondContact O-N 3.04Å |
| 304 | M | 95.1 | Very high | 94.9 | Very high | 18 Ų | 18 | 28 Ų | 28 | 9% | 0.089 | 17% | 0.168 | C | C | . | . | H | α-helix | trans | -58 | -48.2 | 178.4 | -75.8 | -64.4 | -63.2 | 0 | 0 | 112.1 | L206 L209 A300 M301 T308 | L206-M304 HydrophobicContact CD2-CE 3.72Å; L206-M304 HydrophobicContact CD2-SD 3.36Å; L206-M304 WeakPolarHBondContact CD2-SD 3.5Å; L206-M304 HydrophobicContact CG-CE 4.12Å; L206-M304 HydrophobicContact CG-SD 4.31Å; L209-M304 HydrophobicContact CB-CE 3.84Å; L209-M304 HydrophobicContact CD2-CE 3.68Å; L209-M304 HydrophobicContact CD2-SD 3.37Å; L209-M304 WeakPolarHBondContact CD2-SD 3.05Å; L209-M304 HydrophobicContact CG-CE 4.39Å; A300-M304 WeakPolarHBondContact O-CG 3.31Å; A300-M304 PolarHBondContact O-N 3.08Å; M301-M304 HydrophobicContact CE-CB 4.47Å; M301-M304 HydrophobicContact CE-CG 3.95Å; M301-M304 PolarHBondContact O-N 3.04Å; M304-T308 VanDerWaalsContact O-CB 3.26Å; M304-T308 WeakPolarHBondContact O-CB 3.41Å; M304-T308 PolarHBondContact O-N 3.46Å; M304-T308 PolarHBondContact O-OG1 2.84Å |
| 305 | Y | 95.9 | Very high | 94.3 | Very high | 0 Ų | 0 | 28.8 Ų | 28.8 | 0% | 0 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -65.4 | -47.3 | 178.9 | -73.4 | -7.5 | 0 | 0 | 0 | 112.5 | I61 M62 I66 L69 A268 F269 M301 C303 L307 T308 A309 | I61-Y305 HydrophobicContact CG2-CE2 4.06Å; I61-Y305 PolarHBondContact O-OH 2.92Å; M62-Y305 WeakPolarHBondContact CA-OH 3.45Å; M62-Y305 PolarHBondContact N-OH 2.95Å; M62-Y305 PolarHBondContact O-OH 3.35Å; I66-Y305 HydrophobicContact CB-CD1 4.16Å; I66-Y305 HydrophobicContact CB-CE1 3.84Å; I66-Y305 HydrophobicContact CD1-CD1 4.09Å; I66-Y305 HydrophobicContact CD1-CE1 4.23Å; I66-Y305 HydrophobicContact CG1-CD1 3.89Å; I66-Y305 HydrophobicContact CG1-CE1 4.06Å; L69-Y305 VanDerWaalsContact CD1-CB 3.45Å; L69-Y305 HydrophobicContact CD1-CD1 3.67Å; L69-Y305 HydrophobicContact CD1-CD2 3.77Å; L69-Y305 HydrophobicContact CD1-CE1 4.28Å; L69-Y305 HydrophobicContact CD1-CE2 4.38Å; L69-Y305 HydrophobicContact CD1-CG 3.35Å; A268-Y305 HydrophobicContact CB-CE2 3.89Å; A268-Y305 WeakPolarHBondContact O-CE2 3.45Å; A268-Y305 PolarHBondContact O-OH 3.31Å; F269-Y305 HydrophobicContact CD1-CE2 4.5Å; F269-Y305 HydrophobicContact CE1-CD2 4.18Å; F269-Y305 HydrophobicContact CE1-CE2 4.21Å; F269-Y305 AromaticContact CE2-CD2 3.92Å; F269-Y305 HydrophobicContact CE2-CD2 3.92Å; F269-Y305 HydrophobicContact CE2-CE2 4.27Å; F269-Y305 AromaticContact CZ-CD2 3.67Å; F269-Y305 HydrophobicContact CZ-CD2 3.67Å; F269-Y305 HydrophobicContact CZ-CE2 4.09Å; M301-Y305 HydrophobicContact CB-CE2 4.34Å; M301-Y305 WeakPolarHBondContact O-CB 3.31Å; M301-Y305 WeakPolarHBondContact O-CD2 3.41Å; M301-Y305 PolarHBondContact O-N 3.23Å; C303-Y305 PolarHBondContact O-N 3.38Å; Y305-L307 PolarHBondContact O-N 3.17Å; Y305-T308 PolarHBondContact O-N 3.42Å; Y305-A309 WeakPolarHBondContact O-CB 3.42Å; Y305-A309 PolarHBondContact O-N 3.24Å |
| 306 | G | 96 | Very high | 93.7 | Very high | 7 Ų | 7 | 27.2 Ų | 27.2 | 7% | 0.072 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -59.6 | -46.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 111.6 | F302 C303 T310 | F302-G306 PolarHBondContact O-N 3.12Å; C303-G306 PolarHBondContact O-N 2.88Å; G306-T310 VanDerWaalsContact O-CB 3.25Å; G306-T310 WeakPolarHBondContact O-CB 3.47Å; G306-T310 PolarHBondContact O-N 2.93Å; G306-T310 PolarHBondContact O-OG1 2.82Å |
| 307 | L | 95.9 | Very high | 93.2 | Very high | 78 Ų | 78 | 25 Ų | 25 | 41% | 0.408 | 15% | 0.146 | S | C | . | . | H | α-helix | trans | -66.6 | -49.6 | 178 | -66.2 | 170 | 0 | 0 | 0 | 111.4 | L209 C303 Y305 A309 T310 F311 | L209-L307 HydrophobicContact CD1-CB 3.72Å; L209-L307 HydrophobicContact CD2-CB 4.4Å; L209-L307 HydrophobicContact CD2-CD1 4.31Å; C303-L307 WeakPolarHBondContact O-CB 3.21Å; C303-L307 VanDerWaalsContact O-CG 3.25Å; C303-L307 WeakPolarHBondContact O-CG 3.44Å; C303-L307 PolarHBondContact O-N 3.04Å; Y305-L307 PolarHBondContact O-N 3.17Å; L307-A309 VanDerWaalsContact C-N 3.34Å; L307-A309 PolarHBondContact O-N 3.24Å; L307-T310 PolarHBondContact O-N 3.36Å; L307-F311 HydrophobicContact CB-CD2 4.46Å; L307-F311 HydrophobicContact CD2-CE2 3.98Å; L307-F311 VanDerWaalsContact O-CD2 3.25Å; L307-F311 WeakPolarHBondContact O-CD2 3.49Å; L307-F311 PolarHBondContact O-N 3.35Å |
| 308 | T | 94.5 | Very high | 92.3 | Very high | 2 Ų | 2 | 28.4 Ų | 28.4 | 1% | 0.012 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -59.8 | -45.5 | -178.9 | -54.3 | 0 | 0 | 0 | 0 | 111.3 | I66 F208 L209 M304 Y305 G312 | I66-T308 HydrophobicContact CD1-CG2 4.18Å; I66-T308 HydrophobicContact CG1-CG2 3.96Å; F208-T308 HydrophobicContact CD1-CG2 4.29Å; F208-T308 HydrophobicContact CE1-CG2 3.51Å; F208-T308 HydrophobicContact CZ-CG2 3.97Å; L209-T308 WeakPolarHBondContact CD1-OG1 3.43Å; M304-T308 VanDerWaalsContact O-CB 3.26Å; M304-T308 WeakPolarHBondContact O-CB 3.41Å; M304-T308 PolarHBondContact O-N 3.46Å; M304-T308 PolarHBondContact O-OG1 2.84Å; Y305-T308 PolarHBondContact O-N 3.42Å; T308-G312 WeakPolarHBondContact O-CA 3.47Å; T308-G312 PolarHBondContact O-N 3.01Å |
| 309 | A | 94.6 | Very high | 91.5 | Very high | 0 Ų | 0 | 33.3 Ų | 33.3 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -65.2 | -42.2 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | L69 M73 F81 Y305 L307 Y313 | L69-A309 HydrophobicContact CB-CB 3.89Å; M73-A309 HydrophobicContact CE-CB 3.72Å; F81-A309 HydrophobicContact CE1-CB 3.6Å; F81-A309 HydrophobicContact CZ-CB 3.66Å; Y305-A309 WeakPolarHBondContact O-CB 3.42Å; Y305-A309 PolarHBondContact O-N 3.24Å; L307-A309 VanDerWaalsContact C-N 3.34Å; L307-A309 PolarHBondContact O-N 3.24Å; A309-Y313 WeakPolarHBondContact O-CB 3.41Å; A309-Y313 PolarHBondContact O-N 3.18Å |
| 310 | T | 93.4 | Very high | 90.8 | Very high | 29 Ų | 29 | 32 Ų | 32 | 18% | 0.178 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -63.9 | -53.9 | 179.4 | -56.5 | 0 | 0 | 0 | 0 | 111.3 | G306 L307 G312 Y313 L314 | G306-T310 VanDerWaalsContact O-CB 3.25Å; G306-T310 WeakPolarHBondContact O-CB 3.47Å; G306-T310 PolarHBondContact O-N 2.93Å; G306-T310 PolarHBondContact O-OG1 2.82Å; L307-T310 PolarHBondContact O-N 3.36Å; T310-G312 VanDerWaalsContact C-N 3.33Å; T310-G312 PolarHBondContact O-N 3.44Å; T310-Y313 PolarHBondContact O-N 3.06Å; T310-L314 HydrophobicContact CG2-CD1 3.83Å; T310-L314 HydrophobicContact CG2-CG 4.4Å; T310-L314 VanDerWaalsContact O-CB 3.31Å; T310-L314 WeakPolarHBondContact O-CB 3.36Å; T310-L314 WeakPolarHBondContact O-CG 3.44Å; T310-L314 PolarHBondContact O-N 2.79Å |
| 311 | F | 92.4 | Very high | 90.3 | Very high | 43 Ų | 43 | 33.9 Ų | 33.9 | 19% | 0.189 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -71 | -31.7 | -178.4 | -73.2 | -79.5 | 0 | 0 | 0 | 112.2 | V212 I213 K216 F217 L307 T315 | V212-F311 HydrophobicContact CG1-CB 3.97Å; I213-F311 HydrophobicContact CB-CD1 4.5Å; I213-F311 HydrophobicContact CB-CG 4.42Å; I213-F311 HydrophobicContact CD1-CD2 4.16Å; I213-F311 HydrophobicContact CD1-CE2 4.22Å; I213-F311 HydrophobicContact CG1-CB 4.14Å; I213-F311 HydrophobicContact CG1-CD1 4.21Å; I213-F311 HydrophobicContact CG1-CD2 3.56Å; I213-F311 HydrophobicContact CG1-CE2 3.97Å; I213-F311 HydrophobicContact CG1-CG 3.71Å; I213-F311 HydrophobicContact CG1-CZ 4.46Å; I213-F311 HydrophobicContact CG2-CD1 4.34Å; I213-F311 HydrophobicContact CG2-CE1 4.22Å; I213-F311 HydrophobicContact CG2-CZ 4.42Å; K216-F311 HydrophobicContact CB-CD1 4.16Å; K216-F311 HydrophobicContact CG-CD1 4.01Å; F217-F311 HydrophobicContact CE2-CE1 4.03Å; F217-F311 HydrophobicContact CZ-CE1 4.13Å; L307-F311 HydrophobicContact CB-CD2 4.46Å; L307-F311 HydrophobicContact CD2-CE2 3.98Å; L307-F311 VanDerWaalsContact O-CD2 3.25Å; L307-F311 WeakPolarHBondContact O-CD2 3.49Å; L307-F311 PolarHBondContact O-N 3.35Å; F311-T315 PolarHBondContact O-N 2.96Å; F311-T315 VanDerWaalsContact O-N 3.15Å; F311-T315 PolarHBondContact O-OG1 3.21Å |
| 312 | G | 90.8 | Very high | 89.6 | Confident | 0 Ų | 0 | 34.5 Ų | 34.5 | 0% | 0 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -63 | -52 | 171.5 | 0 | 0 | 0 | 0 | 0 | 112.9 | T308 T310 L314 T315 M324 | T308-G312 WeakPolarHBondContact O-CA 3.47Å; T308-G312 PolarHBondContact O-N 3.01Å; T310-G312 VanDerWaalsContact C-N 3.33Å; T310-G312 PolarHBondContact O-N 3.44Å; G312-L314 PolarHBondContact O-N 3.3Å; G312-T315 WeakPolarHBondContact O-CB 3.47Å; G312-T315 PolarHBondContact O-N 3.38Å; G312-T315 VanDerWaalsContact O-N 3.13Å; G312-M324 WeakPolarHBondContact CA-SD 3.46Å |
| 313 | Y | 91 | Very high | 88.9 | Confident | 4 Ų | 4 | 32.6 Ų | 32.6 | 2% | 0.016 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -58.1 | -49 | 174.2 | 169 | -110.3 | 0 | 0 | 0 | 111.5 | M73 A74 V78 A249 Q250 A309 T310 T315 F316 Y317 V320 | M73-Y313 HydrophobicContact CB-CG 4.46Å; M73-Y313 HydrophobicContact CG-CD1 4.14Å; M73-Y313 HydrophobicContact CG-CD2 4.48Å; M73-Y313 HydrophobicContact CG-CG 3.94Å; M73-Y313 VanDerWaalsContact SD-CB 3.56Å; M73-Y313 HydrophobicContact SD-CD1 3.8Å; M73-Y313 HydrophobicContact SD-CG 3.86Å; A74-Y313 HydrophobicContact CB-CD2 3.79Å; A74-Y313 HydrophobicContact CB-CE2 3.96Å; V78-Y313 HydrophobicContact CG2-CD1 3.74Å; V78-Y313 HydrophobicContact CG2-CE1 3.54Å; A249-Y313 HydrophobicContact CB-CE1 4.24Å; Q250-Y313 PolarHBondContact N-OH 3.44Å; A309-Y313 WeakPolarHBondContact O-CB 3.41Å; A309-Y313 PolarHBondContact O-N 3.18Å; T310-Y313 PolarHBondContact O-N 3.06Å; Y313-T315 PolarHBondContact O-N 3.48Å; Y313-F316 PolarHBondContact O-N 2.81Å; Y313-Y317 WeakPolarHBondContact CD2-O 3.44Å; Y313-Y317 WeakPolarHBondContact CE2-O 3.43Å; Y313-Y317 VanDerWaalsContact O-CA 3.25Å; Y313-Y317 WeakPolarHBondContact O-CA 3.16Å; Y313-Y317 PolarHBondContact O-N 2.72Å; Y313-V320 HydrophobicContact CD2-CG2 4.4Å |
| 314 | L | 88.6 | Confident | 88.4 | Confident | 39 Ų | 39 | 29.3 Ų | 29.3 | 20% | 0.204 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -65.7 | -13 | -179.6 | -69.2 | 175.5 | 0 | 0 | 0 | 113.5 | K216 A249 T310 G312 Y317 | K216-L314 HydrophobicContact CD-CB 3.7Å; K216-L314 WeakPolarHBondContact CD-O 3.4Å; K216-L314 WeakPolarHBondContact CE-O 3.35Å; K216-L314 PolarHBondContact NZ-O 3.45Å; A249-L314 HydrophobicContact CB-CD2 3.85Å; T310-L314 HydrophobicContact CG2-CD1 3.83Å; T310-L314 HydrophobicContact CG2-CG 4.4Å; T310-L314 VanDerWaalsContact O-CB 3.31Å; T310-L314 WeakPolarHBondContact O-CB 3.36Å; T310-L314 WeakPolarHBondContact O-CG 3.44Å; T310-L314 PolarHBondContact O-N 2.79Å; G312-L314 PolarHBondContact O-N 3.3Å; L314-Y317 HydrophobicContact CD2-CE1 4.15Å; L314-Y317 WeakPolarHBondContact O-CE2 3.2Å |
| 315 | T | 85.6 | Confident | 87.9 | Confident | 17 Ų | 17 | 28.5 Ų | 28.5 | 10% | 0.104 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -78.2 | -39.9 | 175.5 | -59 | 0 | 0 | 0 | 0 | 111.4 | L219 F311 G312 Y313 Y328 | L219-T315 HydrophobicContact CD1-CG2 4.38Å; F311-T315 PolarHBondContact O-N 2.96Å; F311-T315 VanDerWaalsContact O-N 3.15Å; F311-T315 PolarHBondContact O-OG1 3.21Å; G312-T315 WeakPolarHBondContact O-CB 3.47Å; G312-T315 PolarHBondContact O-N 3.38Å; G312-T315 VanDerWaalsContact O-N 3.13Å; Y313-T315 PolarHBondContact O-N 3.48Å; T315-Y328 HydrophobicContact CG2-CE1 3.99Å |
| 316 | F | 83.2 | Confident | 87.2 | Confident | 40 Ų | 40 | 32.6 Ų | 32.6 | 18% | 0.175 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -121.1 | -6.1 | -172.6 | -54.6 | -75.3 | 0 | 0 | 0 | 114.6 | Y313 S318 N319 V320 M324 M327 Y328 | Y313-F316 PolarHBondContact O-N 2.81Å; F316-S318 PolarHBondContact O-N 2.86Å; F316-N319 PolarHBondContact O-N 3.48Å; F316-N319 VanDerWaalsContact O-N 3.15Å; F316-V320 HydrophobicContact CB-CG2 3.84Å; F316-M324 HydrophobicContact CD2-CG 4.23Å; F316-M324 HydrophobicContact CE2-CG 3.94Å; F316-M327 HydrophobicContact CD1-CB 4.1Å; F316-M327 HydrophobicContact CD2-CB 4.22Å; F316-M327 HydrophobicContact CE1-CB 3.65Å; F316-M327 HydrophobicContact CE2-CB 3.77Å; F316-M327 HydrophobicContact CG-CB 4.37Å; F316-M327 HydrophobicContact CZ-CB 3.46Å; F316-M327 VanDerWaalsContact CZ-CB 3.46Å; F316-Y328 HydrophobicContact CE2-CD2 4.27Å; F316-Y328 HydrophobicContact CE2-CE1 4.07Å; F316-Y328 AromaticContact CE2-CE2 3.78Å; F316-Y328 HydrophobicContact CE2-CE2 3.78Å; F316-Y328 AromaticContact CE2-CZ 3.66Å; F316-Y328 AromaticContact CZ-CD1 3.87Å; F316-Y328 HydrophobicContact CZ-CD1 3.87Å; F316-Y328 HydrophobicContact CZ-CD2 4.11Å; F316-Y328 AromaticContact CZ-CE1 3.74Å; F316-Y328 HydrophobicContact CZ-CE1 3.74Å; F316-Y328 HydrophobicContact CZ-CE2 4Å; F316-Y328 HydrophobicContact CZ-CG 4.06Å; F316-Y328 AromaticContact CZ-CZ 3.81Å |
| 317 | Y | 86.1 | Confident | 86.5 | Confident | 30 Ų | 30 | 35 Ų | 35 | 12% | 0.118 | 18% | 0.184 | C | C | . | . | G | 310 helix | trans | 51.2 | -119.5 | -179 | -64.4 | -92.6 | 0 | 0 | 0 | 113.1 | S246 C247 A249 Y313 L314 N319 V320 | S246-Y317 WeakPolarHBondContact O-CB 3.49Å; C247-Y317 HydrophobicContact CB-CD2 4.24Å; C247-Y317 HydrophobicContact CB-CE1 4.42Å; C247-Y317 HydrophobicContact CB-CE2 3.83Å; C247-Y317 WeakPolarHBondContact O-CE1 3.25Å; C247-Y317 VanDerWaalsContact O-CZ 3.28Å; C247-Y317 PolarHBondContact O-OH 3.11Å; A249-Y317 HydrophobicContact CB-CE1 4.42Å; Y313-Y317 WeakPolarHBondContact CD2-O 3.44Å; Y313-Y317 WeakPolarHBondContact CE2-O 3.43Å; Y313-Y317 VanDerWaalsContact O-CA 3.25Å; Y313-Y317 WeakPolarHBondContact O-CA 3.16Å; Y313-Y317 PolarHBondContact O-N 2.72Å; L314-Y317 HydrophobicContact CD2-CE1 4.15Å; L314-Y317 WeakPolarHBondContact O-CE2 3.2Å; Y317-N319 PolarHBondContact O-N 3.08Å; Y317-V320 VanDerWaalsContact O-CG2 3.3Å; Y317-V320 WeakPolarHBondContact O-CG2 3.32Å |
| 318 | S | 77.6 | Confident | 85.9 | Confident | 71 Ų | 71 | 31.7 Ų | 31.7 | 50% | 0.497 | 17% | 0.166 | S | C | . | . | G | 310 helix | trans | -72.9 | -11.3 | -176.7 | 55.6 | 0 | 0 | 0 | 0 | 113.9 | F316 | F316-S318 PolarHBondContact O-N 2.86Š|
| 319 | N | 80.6 | Confident | 85.2 | Confident | 112 Ų | 112 | 35.2 Ų | 35.2 | 60% | 0.599 | 19% | 0.191 | S | C | * | . | G | 310 helix | trans | -103.9 | 28.8 | -172.4 | -57.7 | -28.5 | 0 | 0 | 0 | 112.3 | F316 Y317 E321 | F316-N319 PolarHBondContact O-N 3.48Å; F316-N319 VanDerWaalsContact O-N 3.15Å; Y317-N319 PolarHBondContact O-N 3.08Å; N319-E321 PolarHBondContact O-N 3.44Å |
| 320 | V | 82.9 | Confident | 84.2 | Confident | 8 Ų | 8 | 38.8 Ų | 38.8 | 5% | 0.048 | 21% | 0.207 | C | C | . | . | trans | -75.7 | 122 | 178.5 | 179.6 | 0 | 0 | 0 | 0 | 109.2 | A70 Y71 A74 Y313 F316 Y317 | A70-V320 HydrophobicContact CB-CG1 3.91Å; Y71-V320 WeakPolarHBondContact CD2-O 3.49Å; A74-V320 HydrophobicContact CB-CB 4.05Å; A74-V320 HydrophobicContact CB-CG2 4.17Å; Y313-V320 HydrophobicContact CD2-CG2 4.4Å; F316-V320 HydrophobicContact CB-CG2 3.84Å; Y317-V320 VanDerWaalsContact O-CG2 3.3Å; Y317-V320 WeakPolarHBondContact O-CG2 3.32Å | ||
| 321 | E | 84.9 | Confident | 83.4 | Confident | 81 Ų | 81 | 46.5 Ų | 46.5 | 38% | 0.379 | 24% | 0.239 | S | C | . | . | trans | -74.2 | 159.8 | 169.4 | -75.6 | 178.8 | -177 | 0 | 0 | 112.2 | N319 E323 H326 M327 | N319-E321 PolarHBondContact O-N 3.44Å; E321-E323 PolarHBondContact O-N 3.4Å; E321-E323 VanDerWaalsContact O-N 3.11Å; E321-H326 IonicContact OE2-CG 3.45Å; E321-H326 IonicContact OE2-ND1 2.76Å; E321-H326 PolarHBondContact OE2-ND1 2.98Å; E321-M327 HydrophobicContact CB-CG 3.96Å; E321-M327 HydrophobicContact CB-SD 4.07Å; E321-M327 HydrophobicContact CG-CE 3.91Å; E321-M327 HydrophobicContact CG-CG 4.14Å; E321-M327 HydrophobicContact CG-SD 3.6Å; E321-M327 WeakPolarHBondContact OE1-CE 3.04Å | ||
| 322 | A | 79.2 | Confident | 83 | Confident | 20 Ų | 20 | 46.3 Ų | 46.3 | 17% | 0.165 | 24% | 0.239 | C | C | . | . | S | Bend | trans | -57.9 | -24.7 | 177.8 | 0 | 0 | 0 | 0 | 0 | 113.7 | Y71 I397 Q398 | Y71-A322 HydrophobicContact CD2-CB 4.36Å; Y71-A322 HydrophobicContact CG-CB 4.41Å; A322-I397 HydrophobicContact CB-CG2 4.07Å; A322-Q398 HydrophobicContact CB-CB 4.06Å |
| 323 | E | 83.4 | Confident | 82.9 | Confident | 14 Ų | 14 | 50.9 Ų | 50.9 | 7% | 0.065 | 27% | 0.269 | C | S | . | . | S | Bend | trans | -117.5 | 97.1 | 169.5 | -178.1 | 164.4 | -156 | 0 | 0 | 109.6 | S148 E321 L325 H326 | S148-E323 PolarHBondContact OG-OE1 3.46Å; S148-E323 PolarHBondContact OG-OE2 3.42Å; E321-E323 PolarHBondContact O-N 3.4Å; E321-E323 VanDerWaalsContact O-N 3.11Å; E323-L325 HydrophobicContact CG-CB 4.41Å; E323-L325 PolarHBondContact O-N 3.16Å; E323-L325 VanDerWaalsContact O-N 3.07Å; E323-H326 WeakPolarHBondContact O-CB 3.38Å; E323-H326 PolarHBondContact O-N 2.97Å |
| 324 | M | 84.8 | Confident | 82.8 | Confident | 2 Ų | 2 | 52.9 Ų | 52.9 | 1% | 0.01 | 28% | 0.28 | C | S | . | . | G | 310 helix | trans | -59.7 | -24.6 | -176.2 | -176 | -173.9 | 75 | 0 | 0 | 113.7 | A70 F208 V212 G312 F316 H326 M327 Y328 | A70-M324 HydrophobicContact CB-CB 4.47Å; A70-M324 HydrophobicContact CB-CG 4.45Å; A70-M324 HydrophobicContact CB-SD 3.69Å; F208-M324 HydrophobicContact CE2-CE 3.77Å; F208-M324 HydrophobicContact CZ-CE 3.47Å; F208-M324 VanDerWaalsContact CZ-CE 3.47Å; V212-M324 HydrophobicContact CG1-CE 4.13Å; V212-M324 HydrophobicContact CG2-CE 3.61Å; G312-M324 WeakPolarHBondContact CA-SD 3.46Å; F316-M324 HydrophobicContact CD2-CG 4.23Å; F316-M324 HydrophobicContact CE2-CG 3.94Å; M324-H326 PolarHBondContact O-N 2.66Å; M324-M327 WeakPolarHBondContact O-CB 3.43Å; M324-M327 PolarHBondContact O-N 3.43Å; M324-Y328 HydrophobicContact CE-CE2 4.15Å; M324-Y328 HydrophobicContact CG-CE2 4.09Å; M324-Y328 WeakPolarHBondContact O-CD2 3.39Å |
| 325 | L | 83.8 | Confident | 82.9 | Confident | 1 Ų | 1 | 51.2 Ų | 51.2 | 1% | 0.005 | 27% | 0.271 | C | S | . | . | G | 310 helix | trans | -70.1 | -24.9 | -176.4 | -152 | 68 | 0 | 0 | 0 | 113 | E149 F208 E323 M327 V338 R339 V342 | E149-L325 HydrophobicContact CG-CD2 4.16Å; F208-L325 HydrophobicContact CD2-CD1 4.27Å; F208-L325 HydrophobicContact CE2-CD1 3.83Å; E323-L325 HydrophobicContact CG-CB 4.41Å; E323-L325 PolarHBondContact O-N 3.16Å; E323-L325 VanDerWaalsContact O-N 3.07Å; L325-M327 VanDerWaalsContact C-N 3.3Å; L325-M327 PolarHBondContact O-N 3.24Å; L325-V338 HydrophobicContact CD1-CG1 3.81Å; L325-R339 HydrophobicContact CD2-CB 4.44Å; L325-R339 HydrophobicContact CD2-CG 3.73Å; L325-R339 HydrophobicContact CG-CG 4.01Å; L325-R339 PolarHBondContact O-NH2 3.42Å; L325-V342 HydrophobicContact CD2-CB 4.3Å; L325-V342 HydrophobicContact CD2-CG1 4.38Å; L325-V342 HydrophobicContact CD2-CG2 4.32Å |
| 326 | H | 81.8 | Confident | 83.1 | Confident | 86 Ų | 86 | 51.5 Ų | 51.5 | 40% | 0.398 | 27% | 0.272 | S | S | . | . | G | 310 helix | trans | -69.8 | -28.9 | 176 | -168.3 | -110 | 0 | 0 | 0 | 112.2 | E321 E323 M324 Y328 | E321-H326 IonicContact OE2-CG 3.45Å; E321-H326 IonicContact OE2-ND1 2.76Å; E321-H326 PolarHBondContact OE2-ND1 2.98Å; E323-H326 WeakPolarHBondContact O-CB 3.38Å; E323-H326 PolarHBondContact O-N 2.97Å; M324-H326 PolarHBondContact O-N 2.66Å; H326-Y328 VanDerWaalsContact C-N 3.29Å; H326-Y328 PolarHBondContact O-N 2.66Å |
| 327 | M | 81.4 | Confident | 83.6 | Confident | 58 Ų | 58 | 52.7 Ų | 52.7 | 29% | 0.286 | 28% | 0.284 | S | S | . | . | G | 310 helix | trans | -74.1 | -14.7 | -178.4 | -63.8 | -87.2 | 73.8 | 0 | 0 | 114.5 | F316 E321 M324 L325 | F316-M327 HydrophobicContact CD1-CB 4.1Å; F316-M327 HydrophobicContact CD2-CB 4.22Å; F316-M327 HydrophobicContact CE1-CB 3.65Å; F316-M327 HydrophobicContact CE2-CB 3.77Å; F316-M327 HydrophobicContact CG-CB 4.37Å; F316-M327 HydrophobicContact CZ-CB 3.46Å; F316-M327 VanDerWaalsContact CZ-CB 3.46Å; E321-M327 HydrophobicContact CB-CG 3.96Å; E321-M327 HydrophobicContact CB-SD 4.07Å; E321-M327 HydrophobicContact CG-CE 3.91Å; E321-M327 HydrophobicContact CG-CG 4.14Å; E321-M327 HydrophobicContact CG-SD 3.6Å; E321-M327 WeakPolarHBondContact OE1-CE 3.04Å; M324-M327 WeakPolarHBondContact O-CB 3.43Å; M324-M327 PolarHBondContact O-N 3.43Å; L325-M327 VanDerWaalsContact C-N 3.3Å; L325-M327 PolarHBondContact O-N 3.24Å |
| 328 | Y | 82.9 | Confident | 83.9 | Confident | 8 Ų | 8 | 51.4 Ų | 51.4 | 3% | 0.031 | 28% | 0.28 | C | S | . | . | S | Bend | trans | -85.2 | 144.7 | 177.3 | -71.1 | -77.8 | 0 | 0 | 0 | 112 | K215 L219 T315 F316 M324 H326 Q330 I335 R339 | K215-Y328 HydrophobicContact CB-CE1 3.89Å; K215-Y328 HydrophobicContact CG-CE1 4.31Å; L219-Y328 HydrophobicContact CD1-CD1 4.48Å; L219-Y328 HydrophobicContact CD1-CE1 4.22Å; T315-Y328 HydrophobicContact CG2-CE1 3.99Å; F316-Y328 HydrophobicContact CE2-CD2 4.27Å; F316-Y328 HydrophobicContact CE2-CE1 4.07Å; F316-Y328 AromaticContact CE2-CE2 3.78Å; F316-Y328 HydrophobicContact CE2-CE2 3.78Å; F316-Y328 AromaticContact CE2-CZ 3.66Å; F316-Y328 AromaticContact CZ-CD1 3.87Å; F316-Y328 HydrophobicContact CZ-CD1 3.87Å; F316-Y328 HydrophobicContact CZ-CD2 4.11Å; F316-Y328 AromaticContact CZ-CE1 3.74Å; F316-Y328 HydrophobicContact CZ-CE1 3.74Å; F316-Y328 HydrophobicContact CZ-CE2 4Å; F316-Y328 HydrophobicContact CZ-CG 4.06Å; F316-Y328 AromaticContact CZ-CZ 3.81Å; M324-Y328 HydrophobicContact CE-CE2 4.15Å; M324-Y328 HydrophobicContact CG-CE2 4.09Å; M324-Y328 WeakPolarHBondContact O-CD2 3.39Å; H326-Y328 VanDerWaalsContact C-N 3.29Å; H326-Y328 PolarHBondContact O-N 2.66Å; Y328-Q330 PolarHBondContact O-N 3.02Å; Y328-I335 HydrophobicContact CD1-CD1 3.64Å; Y328-I335 HydrophobicContact CD1-CG1 4.34Å; Y328-I335 HydrophobicContact CD2-CD1 4.31Å; Y328-I335 HydrophobicContact CE1-CD1 4.29Å; Y328-I335 HydrophobicContact CG-CD1 3.66Å; Y328-I335 HydrophobicContact CG-CG1 4.28Å; Y328-I335 HydrophobicContact CG-CG2 4.48Å; Y328-R339 PolarHBondContact O-NH2 3.39Å |
| 329 | S | 79.9 | Confident | 84.6 | Confident | 77 Ų | 77 | 48.1 Ų | 48.1 | 54% | 0.538 | 26% | 0.256 | S | S | . | . | trans | -57.7 | 130.9 | -179.9 | -179.1 | 0 | 0 | 0 | 0 | 112.3 | K331 D332 | S329-K331 PolarHBondContact O-N 3.27Å; S329-D332 PolarHBondContact O-N 2.94Å | ||
| 330 | Q | 74.8 | Confident | 85.2 | Confident | 75 Ų | 75 | 46.2 Ų | 46.2 | 35% | 0.35 | 25% | 0.246 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -69.5 | -21 | -177.2 | -52.3 | -172.2 | 2.4 | 0 | 0 | 113.6 | T156 Y328 | T156-Q330 PolarHBondContact OG1-O 3.33Å; Y328-Q330 PolarHBondContact O-N 3.02Å |
| 331 | K | 76.3 | Confident | 85.7 | Confident | 191 Ų | 191 | 46.5 Ų | 46.5 | 83% | 0.83 | 25% | 0.249 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -87.8 | -7.6 | -176.9 | -63.8 | -177.5 | -179.5 | 176.4 | 0 | 113.2 | S329 P333 | S329-K331 PolarHBondContact O-N 3.27Å; K331-P333 WeakPolarHBondContact O-CD 3.14Å |
| 332 | D | 84.4 | Confident | 86.1 | Confident | 39 Ų | 39 | 42.9 Ų | 42.9 | 21% | 0.209 | 23% | 0.232 | C | C | . | . | trans | -80 | 118.1 | -176.9 | -167 | -44 | 0 | 0 | 0 | 110.8 | K215 S329 L334 I335 L336 | K215-D332 VanDerWaalsContact CE-OD2 3.25Å; K215-D332 WeakPolarHBondContact CE-OD2 3.33Å; K215-D332 VanDerWaalsContact NZ-CG 3.27Å; K215-D332 IonicContact NZ-OD1 3.29Å; K215-D332 PolarHBondContact NZ-OD1 3.28Å; K215-D332 IonicContact NZ-OD2 2.53Å; K215-D332 PolarHBondContact NZ-OD2 3.47Å; S329-D332 PolarHBondContact O-N 2.94Å; D332-L334 PolarHBondContact O-N 3.49Å; D332-L334 WeakPolarHBondContact OD1-CB 3.05Å; D332-L334 PolarHBondContact OD1-N 2.85Å; D332-I335 HydrophobicContact CB-CB 4.04Å; D332-I335 HydrophobicContact CB-CG1 3.8Å; D332-I335 PolarHBondContact O-N 3.23Å; D332-I335 VanDerWaalsContact O-N 3.12Å; D332-L336 PolarHBondContact O-N 3.31Å | ||
| 333 | P | 87.2 | Confident | 86.8 | Confident | 95 Ų | 95 | 42.5 Ų | 42.5 | 62% | 0.617 | 23% | 0.228 | S | C | * | . | H | α-helix | trans | -64.1 | -28.9 | -175.1 | 26.4 | -34.8 | 0 | 0 | 0 | 112.5 | K331 C337 | K331-P333 WeakPolarHBondContact O-CD 3.14Å; P333-C337 PolarHBondContact O-N 3.34Å; P333-C337 VanDerWaalsContact O-N 3.11Å; P333-C337 PolarHBondContact O-SG 3.1Å; P333-C337 VanDerWaalsContact O-SG 3.34Å |
| 334 | L | 90.1 | Very high | 87.3 | Confident | 47 Ų | 47 | 45.7 Ų | 45.7 | 25% | 0.246 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -67.7 | -44.5 | 176 | -174.8 | 69.3 | 0 | 0 | 0 | 110.4 | F207 Y214 K215 D332 L336 C337 V338 | F207-L334 HydrophobicContact CE2-CD1 4.42Å; F207-L334 HydrophobicContact CZ-CD1 4.1Å; Y214-L334 HydrophobicContact CD1-CD2 3.6Å; Y214-L334 HydrophobicContact CE1-CD2 4.04Å; K215-L334 HydrophobicContact CG-CD2 4.31Å; D332-L334 PolarHBondContact O-N 3.49Å; D332-L334 WeakPolarHBondContact OD1-CB 3.05Å; D332-L334 PolarHBondContact OD1-N 2.85Å; L334-L336 VanDerWaalsContact C-N 3.32Å; L334-L336 PolarHBondContact O-N 2.95Å; L334-C337 WeakPolarHBondContact O-CB 3.44Å; L334-C337 PolarHBondContact O-N 3.42Å; L334-V338 VanDerWaalsContact O-CG2 3.31Å; L334-V338 WeakPolarHBondContact O-CG2 3.32Å; L334-V338 PolarHBondContact O-N 3.32Å |
| 335 | I | 89.3 | Confident | 87.6 | Confident | 4 Ų | 4 | 45.6 Ų | 45.6 | 2% | 0.021 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -66.3 | -37.9 | 179.3 | -59.6 | -61.1 | 0 | 0 | 0 | 110.7 | K215 Y328 D332 C337 V338 R339 | K215-I335 HydrophobicContact CD-CD1 4.2Å; K215-I335 HydrophobicContact CG-CD1 3.96Å; Y328-I335 HydrophobicContact CD1-CD1 3.64Å; Y328-I335 HydrophobicContact CD1-CG1 4.34Å; Y328-I335 HydrophobicContact CD2-CD1 4.31Å; Y328-I335 HydrophobicContact CE1-CD1 4.29Å; Y328-I335 HydrophobicContact CG-CD1 3.66Å; Y328-I335 HydrophobicContact CG-CG1 4.28Å; Y328-I335 HydrophobicContact CG-CG2 4.48Å; D332-I335 HydrophobicContact CB-CB 4.04Å; D332-I335 HydrophobicContact CB-CG1 3.8Å; D332-I335 PolarHBondContact O-N 3.23Å; D332-I335 VanDerWaalsContact O-N 3.12Å; I335-C337 VanDerWaalsContact C-N 3.34Å; I335-C337 PolarHBondContact O-N 3.06Å; I335-V338 WeakPolarHBondContact O-CB 3.36Å; I335-V338 PolarHBondContact O-N 3.37Å; I335-V338 VanDerWaalsContact O-N 3.14Å; I335-R339 HydrophobicContact CG2-CG 4.48Å; I335-R339 WeakPolarHBondContact O-CG 3.33Å; I335-R339 PolarHBondContact O-N 2.99Å |
| 336 | L | 91.3 | Very high | 88.1 | Confident | 22 Ų | 22 | 45.6 Ų | 45.6 | 12% | 0.115 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -59 | -45.5 | 173.6 | -175.1 | 65.9 | 0 | 0 | 0 | 111.7 | V153 T156 F157 D332 L334 V338 R339 L340 | V153-L336 HydrophobicContact CB-CD1 4.29Å; V153-L336 HydrophobicContact CG1-CD1 4.07Å; V153-L336 HydrophobicContact CG2-CD1 4.16Å; T156-L336 HydrophobicContact CG2-CD1 4.23Å; T156-L336 HydrophobicContact CG2-CD2 4.01Å; F157-L336 HydrophobicContact CE1-CD2 4.31Å; F157-L336 HydrophobicContact CE2-CD1 4.23Å; F157-L336 HydrophobicContact CE2-CD2 4.1Å; F157-L336 HydrophobicContact CE2-CG 4.26Å; F157-L336 HydrophobicContact CZ-CD2 3.93Å; F157-L336 HydrophobicContact CZ-CG 4.39Å; D332-L336 PolarHBondContact O-N 3.31Å; L334-L336 VanDerWaalsContact C-N 3.32Å; L334-L336 PolarHBondContact O-N 2.95Å; L336-V338 VanDerWaalsContact C-N 3.31Å; L336-V338 PolarHBondContact O-N 3.49Å; L336-R339 PolarHBondContact O-N 2.82Å; L336-L340 PolarHBondContact O-N 2.86Å |
| 337 | C | 92.4 | Very high | 88.5 | Confident | 66 Ų | 66 | 42.4 Ų | 42.4 | 45% | 0.446 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -61.4 | -39.3 | 174 | -72.1 | 0 | 0 | 0 | 0 | 112.2 | F207 P333 L334 I335 L340 A341 | F207-C337 HydrophobicContact CE1-CB 4.14Å; F207-C337 HydrophobicContact CZ-CB 4.16Å; P333-C337 PolarHBondContact O-N 3.34Å; P333-C337 VanDerWaalsContact O-N 3.11Å; P333-C337 PolarHBondContact O-SG 3.1Å; P333-C337 VanDerWaalsContact O-SG 3.34Å; L334-C337 WeakPolarHBondContact O-CB 3.44Å; L334-C337 PolarHBondContact O-N 3.42Å; I335-C337 VanDerWaalsContact C-N 3.34Å; I335-C337 PolarHBondContact O-N 3.06Å; C337-L340 PolarHBondContact O-N 2.96Å; C337-A341 WeakPolarHBondContact O-CB 3.49Å; C337-A341 PolarHBondContact O-N 3.37Å |
| 338 | V | 92.8 | Very high | 88.9 | Confident | 3 Ų | 3 | 41 Ų | 41 | 2% | 0.018 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -64.3 | -45 | 176.1 | 171.1 | 0 | 0 | 0 | 0 | 111.1 | F207 F208 S211 L325 L334 I335 L336 L340 A341 V342 | F207-V338 HydrophobicContact CD1-CG2 4.26Å; F207-V338 HydrophobicContact CE1-CB 4.4Å; F207-V338 HydrophobicContact CE1-CG2 3.67Å; F207-V338 HydrophobicContact CZ-CG2 4.13Å; F208-V338 HydrophobicContact CB-CG1 4.19Å; F208-V338 HydrophobicContact CD2-CG1 3.51Å; F208-V338 HydrophobicContact CE2-CG1 4.35Å; F208-V338 HydrophobicContact CG-CG1 4.3Å; S211-V338 VanDerWaalsContact OG-CG2 3.31Å; S211-V338 WeakPolarHBondContact OG-CG2 3.22Å; L325-V338 HydrophobicContact CD1-CG1 3.81Å; L334-V338 VanDerWaalsContact O-CG2 3.31Å; L334-V338 WeakPolarHBondContact O-CG2 3.32Å; L334-V338 PolarHBondContact O-N 3.32Å; I335-V338 WeakPolarHBondContact O-CB 3.36Å; I335-V338 PolarHBondContact O-N 3.37Å; I335-V338 VanDerWaalsContact O-N 3.14Å; L336-V338 VanDerWaalsContact C-N 3.31Å; L336-V338 PolarHBondContact O-N 3.49Å; V338-L340 VanDerWaalsContact C-N 3.34Å; V338-L340 PolarHBondContact O-N 2.95Å; V338-A341 WeakPolarHBondContact O-CB 3.02Å; V338-A341 PolarHBondContact O-N 2.95Å; V338-A341 VanDerWaalsContact O-N 3.13Å; V338-V342 HydrophobicContact CG1-CG2 4.33Å; V338-V342 WeakPolarHBondContact O-CG2 3.46Å; V338-V342 PolarHBondContact O-N 3.32Å |
| 339 | R | 92.6 | Very high | 89.2 | Confident | 1 Ų | 1 | 40.6 Ų | 40.6 | 0% | 0.004 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -57.7 | -47 | 176 | -74 | 179.9 | 171.8 | 169.8 | 5.7 | 111.4 | E149 V153 L325 Y328 I335 L336 A341 V342 L343 | E149-R339 WeakPolarHBondContact OE2-CD 3.38Å; E149-R339 WeakPolarHBondContact OE2-CG 3.36Å; E149-R339 IonicContact OE2-CZ 2.85Å; E149-R339 IonicContact OE2-NE 3.99Å; E149-R339 PolarHBondContact OE2-NE 3.49Å; V153-R339 HydrophobicContact CG2-CB 3.6Å; V153-R339 HydrophobicContact CG2-CG 4.49Å; L325-R339 HydrophobicContact CD2-CB 4.44Å; L325-R339 HydrophobicContact CD2-CG 3.73Å; L325-R339 HydrophobicContact CG-CG 4.01Å; L325-R339 PolarHBondContact O-NH2 3.42Å; Y328-R339 PolarHBondContact O-NH2 3.39Å; I335-R339 HydrophobicContact CG2-CG 4.48Å; I335-R339 WeakPolarHBondContact O-CG 3.33Å; I335-R339 PolarHBondContact O-N 2.99Å; L336-R339 PolarHBondContact O-N 2.82Å; R339-A341 VanDerWaalsContact C-N 3.34Å; R339-A341 PolarHBondContact O-N 3.35Å; R339-V342 PolarHBondContact O-N 2.86Å; R339-L343 VanDerWaalsContact O-CB 3.31Å; R339-L343 WeakPolarHBondContact O-CB 3.43Å; R339-L343 VanDerWaalsContact O-CG 3.23Å; R339-L343 WeakPolarHBondContact O-CG 3.42Å; R339-L343 PolarHBondContact O-N 2.93Å |
| 340 | L | 93.4 | Very high | 89.6 | Confident | 73 Ų | 73 | 37 Ų | 37 | 38% | 0.382 | 20% | 0.197 | S | C | . | . | H | α-helix | trans | -58.7 | -43.8 | 174 | -76.9 | 171.3 | 0 | 0 | 0 | 112.6 | V153 F157 L336 C337 V338 L343 L344 | V153-L340 HydrophobicContact CG1-CD2 3.58Å; V153-L340 HydrophobicContact CG1-CG 3.96Å; F157-L340 HydrophobicContact CE2-CD1 3.85Å; F157-L340 HydrophobicContact CE2-CD2 4.37Å; F157-L340 HydrophobicContact CE2-CG 4.4Å; F157-L340 HydrophobicContact CZ-CD1 3.87Å; L336-L340 PolarHBondContact O-N 2.86Å; C337-L340 PolarHBondContact O-N 2.96Å; V338-L340 VanDerWaalsContact C-N 3.34Å; V338-L340 PolarHBondContact O-N 2.95Å; L340-L343 PolarHBondContact O-N 3.29Å; L340-L344 WeakPolarHBondContact O-CB 3.43Å; L340-L344 PolarHBondContact O-N 3.23Å |
| 341 | A | 93.8 | Very high | 90.1 | Very high | 13 Ų | 13 | 33.7 Ų | 33.7 | 11% | 0.107 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -64.6 | -44 | 178.9 | 0 | 0 | 0 | 0 | 0 | 112 | C204 F207 C337 V338 R339 L344 A345 | C204-A341 HydrophobicContact CB-CB 3.99Å; C204-A341 WeakPolarHBondContact CB-O 3.28Å; F207-A341 HydrophobicContact CD1-CB 3.87Å; F207-A341 HydrophobicContact CE1-CB 4.38Å; C337-A341 WeakPolarHBondContact O-CB 3.49Å; C337-A341 PolarHBondContact O-N 3.37Å; V338-A341 WeakPolarHBondContact O-CB 3.02Å; V338-A341 PolarHBondContact O-N 2.95Å; V338-A341 VanDerWaalsContact O-N 3.13Å; R339-A341 VanDerWaalsContact C-N 3.34Å; R339-A341 PolarHBondContact O-N 3.35Å; A341-L344 PolarHBondContact O-N 3.38Å; A341-A345 WeakPolarHBondContact O-CB 3.45Å; A341-A345 PolarHBondContact O-N 3.47Å |
| 342 | V | 93.3 | Very high | 90.5 | Very high | 6 Ų | 6 | 25 Ų | 25 | 4% | 0.036 | 15% | 0.146 | C | C | . | . | H | α-helix | trans | -64.2 | -46.4 | 176.1 | 172.9 | 0 | 0 | 0 | 0 | 110.5 | L67 I145 F208 L325 V338 R339 L344 A345 V346 | L67-V342 HydrophobicContact CD1-CG1 4.33Å; I145-V342 HydrophobicContact CG2-CG1 4.21Å; F208-V342 HydrophobicContact CB-CG2 4.25Å; F208-V342 HydrophobicContact CD2-CG2 4.4Å; F208-V342 HydrophobicContact CG-CG2 4.27Å; L325-V342 HydrophobicContact CD2-CB 4.3Å; L325-V342 HydrophobicContact CD2-CG1 4.38Å; L325-V342 HydrophobicContact CD2-CG2 4.32Å; V338-V342 HydrophobicContact CG1-CG2 4.33Å; V338-V342 WeakPolarHBondContact O-CG2 3.46Å; V338-V342 PolarHBondContact O-N 3.32Å; R339-V342 PolarHBondContact O-N 2.86Å; V342-L344 VanDerWaalsContact C-N 3.32Å; V342-L344 PolarHBondContact O-N 2.81Å; V342-A345 PolarHBondContact O-N 3.27Å; V342-A345 VanDerWaalsContact O-N 3.15Å; V342-V346 HydrophobicContact CG1-CG1 4.32Å; V342-V346 WeakPolarHBondContact O-CG1 3.42Å; V342-V346 WeakPolarHBondContact O-CG2 3.48Å; V342-V346 PolarHBondContact O-N 3.48Å |
| 343 | L | 93.8 | Very high | 90.5 | Very high | 12 Ų | 12 | 23.6 Ų | 23.6 | 6% | 0.063 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -58 | -43 | 176.6 | -76.2 | 170.8 | 0 | 0 | 0 | 112.1 | I146 E149 L150 V153 R339 L340 V346 T347 | I146-L343 HydrophobicContact CB-CD2 4.35Å; I146-L343 HydrophobicContact CG1-CD2 4.06Å; E149-L343 HydrophobicContact CB-CD1 4.42Å; E149-L343 HydrophobicContact CB-CD2 4.08Å; E149-L343 HydrophobicContact CB-CG 4.34Å; L150-L343 HydrophobicContact CB-CD1 4.32Å; L150-L343 HydrophobicContact CB-CD2 4.32Å; L150-L343 HydrophobicContact CD1-CD1 4.11Å; V153-L343 HydrophobicContact CB-CD1 4.43Å; V153-L343 HydrophobicContact CG2-CD1 3.82Å; R339-L343 VanDerWaalsContact O-CB 3.31Å; R339-L343 WeakPolarHBondContact O-CB 3.43Å; R339-L343 VanDerWaalsContact O-CG 3.23Å; R339-L343 WeakPolarHBondContact O-CG 3.42Å; R339-L343 PolarHBondContact O-N 2.93Å; L340-L343 PolarHBondContact O-N 3.29Å; L343-V346 WeakPolarHBondContact O-CG2 3.39Å; L343-T347 VanDerWaalsContact O-CB 3.25Å; L343-T347 WeakPolarHBondContact O-CB 3.43Å; L343-T347 PolarHBondContact O-N 2.86Å; L343-T347 PolarHBondContact O-OG1 2.71Å |
| 344 | L | 92.8 | Very high | 90.4 | Very high | 80 Ų | 80 | 19.2 Ų | 19.2 | 42% | 0.419 | 11% | 0.109 | S | C | . | . | H | α-helix | trans | -62.2 | -48 | 174.6 | 179 | 62.5 | 0 | 0 | 0 | 111.1 | L200 L340 A341 V342 T347 L348 | L200-L344 HydrophobicContact CD2-CD2 4.44Å; L340-L344 WeakPolarHBondContact O-CB 3.43Å; L340-L344 PolarHBondContact O-N 3.23Å; A341-L344 PolarHBondContact O-N 3.38Å; V342-L344 VanDerWaalsContact C-N 3.32Å; V342-L344 PolarHBondContact O-N 2.81Å; L344-T347 PolarHBondContact O-N 3.45Å; L344-L348 HydrophobicContact CD1-CD1 3.99Å; L344-L348 HydrophobicContact CD1-CG 4.21Å; L344-L348 HydrophobicContact CG-CD1 4.05Å; L344-L348 WeakPolarHBondContact O-CB 3.3Å; L344-L348 VanDerWaalsContact O-CG 3.28Å; L344-L348 WeakPolarHBondContact O-CG 3.45Å; L344-L348 PolarHBondContact O-N 3.04Å |
| 345 | A | 92.6 | Very high | 90 | Very high | 0 Ų | 0 | 19.5 Ų | 19.5 | 0% | 0 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -61.6 | -47.1 | -178.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | C204 M205 A341 V342 L348 T349 | C204-A345 HydrophobicContact CB-CB 3.92Å; M205-A345 HydrophobicContact CE-CB 3.85Å; M205-A345 HydrophobicContact SD-CB 3.48Å; M205-A345 WeakPolarHBondContact SD-CB 3.32Å; A341-A345 WeakPolarHBondContact O-CB 3.45Å; A341-A345 PolarHBondContact O-N 3.47Å; V342-A345 PolarHBondContact O-N 3.27Å; V342-A345 VanDerWaalsContact O-N 3.15Å; A345-L348 PolarHBondContact O-N 2.99Å; A345-T349 WeakPolarHBondContact O-CB 3.43Å; A345-T349 PolarHBondContact O-N 3.39Å; A345-T349 VanDerWaalsContact O-N 3.08Å; A345-T349 PolarHBondContact O-OG1 3.15Å |
| 346 | V | 92.5 | Very high | 89.5 | Confident | 2 Ų | 2 | 19.8 Ų | 19.8 | 1% | 0.012 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -66.7 | -39.8 | 178.7 | -59.4 | 0 | 0 | 0 | 0 | 111.4 | Y142 I145 I146 V342 L343 L348 T349 V350 | Y142-V346 HydrophobicContact CD1-CB 3.8Å; Y142-V346 HydrophobicContact CD1-CG1 3.76Å; Y142-V346 HydrophobicContact CE1-CG1 4.4Å; Y142-V346 HydrophobicContact CG-CB 4.28Å; I145-V346 HydrophobicContact CD1-CG1 4.12Å; I145-V346 HydrophobicContact CG2-CG2 4.45Å; I146-V346 HydrophobicContact CD1-CG2 4.22Å; I146-V346 HydrophobicContact CG1-CG2 3.84Å; V342-V346 HydrophobicContact CG1-CG1 4.32Å; V342-V346 WeakPolarHBondContact O-CG1 3.42Å; V342-V346 WeakPolarHBondContact O-CG2 3.48Å; V342-V346 PolarHBondContact O-N 3.48Å; L343-V346 WeakPolarHBondContact O-CG2 3.39Å; V346-L348 VanDerWaalsContact C-N 3.33Å; V346-L348 PolarHBondContact O-N 2.98Å; V346-T349 PolarHBondContact O-N 3.07Å; V346-V350 WeakPolarHBondContact O-CG2 3.13Å; V346-V350 PolarHBondContact O-N 3.04Å; V346-V350 VanDerWaalsContact O-N 3.1Å |
| 347 | T | 91.4 | Very high | 89.1 | Confident | 19 Ų | 19 | 18.7 Ų | 18.7 | 12% | 0.117 | 11% | 0.105 | C | C | . | . | H | α-helix | trans | -62.5 | -40.3 | 177.4 | -58.6 | 0 | 0 | 0 | 0 | 111.7 | I181 I182 L343 L344 T349 P351 | I181-T347 HydrophobicContact CG2-CG2 3.69Å; I182-T347 HydrophobicContact CG1-CG2 4.2Å; L343-T347 VanDerWaalsContact O-CB 3.25Å; L343-T347 WeakPolarHBondContact O-CB 3.43Å; L343-T347 PolarHBondContact O-N 2.86Å; L343-T347 PolarHBondContact O-OG1 2.71Å; L344-T347 PolarHBondContact O-N 3.45Å; T347-T349 VanDerWaalsContact C-N 3.27Å; T347-T349 PolarHBondContact O-N 2.9Å; T347-P351 WeakPolarHBondContact O-CD 3.48Å |
| 348 | L | 89.1 | Confident | 88.7 | Confident | 27 Ų | 27 | 16 Ų | 16 | 14% | 0.141 | 9% | 0.086 | C | C | . | . | H | α-helix | trans | -70.8 | -23 | 175.6 | -69.1 | 174.7 | 0 | 0 | 0 | 113.1 | L185 L200 L344 A345 V346 V352 | L185-L348 HydrophobicContact CD2-CD2 4.21Å; L200-L348 HydrophobicContact CD2-CD1 3.73Å; L200-L348 HydrophobicContact CG-CD1 4.17Å; L344-L348 HydrophobicContact CD1-CD1 3.99Å; L344-L348 HydrophobicContact CD1-CG 4.21Å; L344-L348 HydrophobicContact CG-CD1 4.05Å; L344-L348 WeakPolarHBondContact O-CB 3.3Å; L344-L348 VanDerWaalsContact O-CG 3.28Å; L344-L348 WeakPolarHBondContact O-CG 3.45Å; L344-L348 PolarHBondContact O-N 3.04Å; A345-L348 PolarHBondContact O-N 2.99Å; V346-L348 VanDerWaalsContact C-N 3.33Å; V346-L348 PolarHBondContact O-N 2.98Å; L348-V352 WeakPolarHBondContact O-CG2 3.48Å |
| 349 | T | 89.4 | Confident | 88 | Confident | 1 Ų | 1 | 19.3 Ų | 19.3 | 1% | 0.006 | 10% | 0.098 | C | C | . | . | H | α-helix | trans | -85.5 | -30.6 | -177.6 | -58.8 | 0 | 0 | 0 | 0 | 112.6 | N59 Y142 S201 A345 V346 T347 V352 V353 | N59-T349 PolarHBondContact ND2-OG1 3.38Å; N59-T349 PolarHBondContact OD1-OG1 3.04Å; Y142-T349 HydrophobicContact CE1-CG2 4.14Å; Y142-T349 HydrophobicContact CE2-CG2 3.81Å; Y142-T349 WeakPolarHBondContact OH-CG2 3.35Å; S201-T349 PolarHBondContact OG-OG1 3.13Å; A345-T349 WeakPolarHBondContact O-CB 3.43Å; A345-T349 PolarHBondContact O-N 3.39Å; A345-T349 VanDerWaalsContact O-N 3.08Å; A345-T349 PolarHBondContact O-OG1 3.15Å; V346-T349 PolarHBondContact O-N 3.07Å; T347-T349 VanDerWaalsContact C-N 3.27Å; T347-T349 PolarHBondContact O-N 2.9Å; T349-V352 VanDerWaalsContact O-CB 3.25Å; T349-V352 WeakPolarHBondContact O-CB 3.43Å; T349-V352 PolarHBondContact O-N 3.04Å; T349-V353 HydrophobicContact CG2-CG2 4.26Å; T349-V353 PolarHBondContact O-N 3Å |
| 350 | V | 89.6 | Confident | 87.4 | Confident | 0 Ų | 0 | 19.5 Ų | 19.5 | 0% | 0 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -55.1 | -47.1 | 179.5 | 174.1 | 0 | 0 | 0 | 0 | 113.5 | M139 Y142 L143 I182 V346 V352 V353 L354 | M139-V350 HydrophobicContact CE-CG1 3.84Å; M139-V350 HydrophobicContact CG-CG1 4.4Å; Y142-V350 HydrophobicContact CD2-CG2 3.82Å; Y142-V350 HydrophobicContact CG-CG2 4.01Å; L143-V350 HydrophobicContact CD2-CG2 4.41Å; I182-V350 HydrophobicContact CD1-CB 4.45Å; I182-V350 HydrophobicContact CD1-CG1 4.3Å; I182-V350 HydrophobicContact CD1-CG2 4.48Å; I182-V350 HydrophobicContact CG2-CB 4.2Å; I182-V350 HydrophobicContact CG2-CG1 3.51Å; V346-V350 WeakPolarHBondContact O-CG2 3.13Å; V346-V350 PolarHBondContact O-N 3.04Å; V346-V350 VanDerWaalsContact O-N 3.1Å; V350-V352 PolarHBondContact O-N 2.91Å; V350-V353 PolarHBondContact O-N 3.18Å; V350-L354 PolarHBondContact O-N 2.68Å |
| 351 | P | 84.6 | Confident | 87 | Confident | 7 Ų | 7 | 17.8 Ų | 17.8 | 5% | 0.045 | 9% | 0.091 | C | C | . | . | H | α-helix | trans | -61 | -31.2 | 176.6 | -24.3 | 34.1 | 0 | 0 | 0 | 113.9 | L185 T347 F355 | L185-P351 HydrophobicContact CB-CB 4.22Å; L185-P351 HydrophobicContact CB-CG 3.62Å; L185-P351 HydrophobicContact CD2-CG 4.17Å; T347-P351 WeakPolarHBondContact O-CD 3.48Å; P351-F355 PolarHBondContact O-N 3.04Å |
| 352 | V | 83.6 | Confident | 86.5 | Confident | 9 Ų | 9 | 19.1 Ų | 19.1 | 6% | 0.055 | 9% | 0.094 | C | C | . | . | H | α-helix | trans | -65.4 | -49.6 | 178.5 | -173.4 | 0 | 0 | 0 | 0 | 110 | L194 L348 T349 V350 L354 F355 P356 | L194-V352 HydrophobicContact CD1-CB 3.95Å; L194-V352 HydrophobicContact CD1-CG1 3.76Å; L194-V352 HydrophobicContact CD1-CG2 3.26Å; L194-V352 HydrophobicContact CD2-CG1 3.95Å; L194-V352 HydrophobicContact CG-CG1 4.21Å; L194-V352 HydrophobicContact CG-CG2 4.39Å; L348-V352 WeakPolarHBondContact O-CG2 3.48Å; T349-V352 VanDerWaalsContact O-CB 3.25Å; T349-V352 WeakPolarHBondContact O-CB 3.43Å; T349-V352 PolarHBondContact O-N 3.04Å; V350-V352 PolarHBondContact O-N 2.91Å; V352-L354 VanDerWaalsContact C-N 3.3Å; V352-L354 PolarHBondContact O-N 3.38Å; V352-F355 WeakPolarHBondContact O-CB 3.47Å; V352-F355 PolarHBondContact O-N 3.16Å; V352-P356 WeakPolarHBondContact O-CD 3.43Å |
| 353 | V | 85.9 | Confident | 85.7 | Confident | 9 Ų | 9 | 21.8 Ų | 21.8 | 6% | 0.055 | 11% | 0.107 | C | C | . | . | H | α-helix | trans | -69.4 | -28.9 | -179.1 | 178.2 | 0 | 0 | 0 | 0 | 112.3 | N135 A138 M139 Y142 T349 V350 F355 P356 I357 | N135-V353 HydrophobicContact CB-CG1 3.64Å; N135-V353 PolarHBondContact ND2-O 3.39Å; A138-V353 HydrophobicContact CB-CG1 4.25Å; M139-V353 HydrophobicContact CG-CB 4.12Å; M139-V353 HydrophobicContact CG-CG1 3.77Å; Y142-V353 HydrophobicContact CE2-CG2 3.95Å; T349-V353 HydrophobicContact CG2-CG2 4.26Å; T349-V353 PolarHBondContact O-N 3Å; V350-V353 PolarHBondContact O-N 3.18Å; V353-F355 VanDerWaalsContact C-N 3.28Å; V353-F355 PolarHBondContact O-N 3.46Å; V353-P356 WeakPolarHBondContact O-CD 3.36Å; V353-I357 WeakPolarHBondContact O-CG1 3.48Å |
| 354 | L | 84.6 | Confident | 85.1 | Confident | 2 Ų | 2 | 24.1 Ų | 24.1 | 1% | 0.01 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -66.7 | -29.5 | 175.4 | -171.7 | 147.8 | 0 | 0 | 0 | 112.4 | M139 A186 V350 V352 I357 R358 A380 | M139-L354 HydrophobicContact CE-CB 4.25Å; M139-L354 HydrophobicContact CE-CD1 3.83Å; M139-L354 HydrophobicContact CE-CG 4.41Å; M139-L354 HydrophobicContact SD-CB 4.06Å; A186-L354 HydrophobicContact CB-CD1 3.93Å; A186-L354 HydrophobicContact CB-CD2 4.13Å; V350-L354 PolarHBondContact O-N 2.68Å; V352-L354 VanDerWaalsContact C-N 3.3Å; V352-L354 PolarHBondContact O-N 3.38Å; L354-I357 PolarHBondContact O-N 2.96Å; L354-R358 HydrophobicContact CD2-CB 4.34Å; L354-R358 WeakPolarHBondContact O-CB 3.41Å; L354-R358 PolarHBondContact O-N 2.83Å; L354-A380 HydrophobicContact CD2-CB 4.39Å |
| 355 | F | 80.6 | Confident | 84.7 | Confident | 54 Ų | 54 | 25.2 Ų | 25.2 | 24% | 0.237 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -59.7 | -52.5 | -175 | 178.6 | -91.4 | 0 | 0 | 0 | 113.7 | L191 P351 V352 V353 I357 R358 R359 | L191-F355 HydrophobicContact CD1-CB 3.76Å; L191-F355 HydrophobicContact CD1-CD2 3.78Å; L191-F355 HydrophobicContact CD1-CG 3.89Å; P351-F355 PolarHBondContact O-N 3.04Å; V352-F355 WeakPolarHBondContact O-CB 3.47Å; V352-F355 PolarHBondContact O-N 3.16Å; V353-F355 VanDerWaalsContact C-N 3.28Å; V353-F355 PolarHBondContact O-N 3.46Å; F355-I357 PolarHBondContact O-N 3.18Å; F355-R358 PolarHBondContact O-N 3.21Å; F355-R359 PolarHBondContact O-N 3.15Å |
| 356 | P | 78.6 | Confident | 84.2 | Confident | 9 Ų | 9 | 28.7 Ų | 28.7 | 6% | 0.058 | 14% | 0.14 | C | C | . | . | H | α-helix | trans | -65.2 | -34.4 | 175.5 | -1.1 | 0.9 | 0 | 0 | 0 | 113.9 | E274 V352 V353 R358 R359 A360 | E274-P356 WeakPolarHBondContact OE1-CG 3.33Å; E274-P356 WeakPolarHBondContact OE2-CG 3.42Å; V352-P356 WeakPolarHBondContact O-CD 3.43Å; V353-P356 WeakPolarHBondContact O-CD 3.36Å; P356-R358 VanDerWaalsContact C-N 3.33Å; P356-R358 PolarHBondContact O-N 2.91Å; P356-R359 PolarHBondContact O-N 2.77Å; P356-A360 WeakPolarHBondContact O-CB 3.43Å; P356-A360 PolarHBondContact O-N 3.44Å |
| 357 | I | 83.9 | Confident | 83.5 | Confident | 0 Ų | 0 | 32.5 Ų | 32.5 | 0% | 0 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -59.8 | -49.1 | 175.5 | -54.7 | 175.1 | 0 | 0 | 0 | 109.5 | N135 V136 M139 V353 L354 F355 R359 A360 L361 L383 | N135-I357 HydrophobicContact CB-CD1 3.45Å; N135-I357 VanDerWaalsContact CB-CD1 3.45Å; N135-I357 HydrophobicContact CB-CG1 3.27Å; V136-I357 HydrophobicContact CG2-CD1 4.26Å; M139-I357 HydrophobicContact SD-CD1 3.48Å; M139-I357 WeakPolarHBondContact SD-CD1 3.26Å; V353-I357 WeakPolarHBondContact O-CG1 3.48Å; L354-I357 PolarHBondContact O-N 2.96Å; F355-I357 PolarHBondContact O-N 3.18Å; I357-R359 VanDerWaalsContact C-N 3.31Å; I357-R359 PolarHBondContact O-N 3.18Å; I357-A360 PolarHBondContact O-N 2.69Å; I357-L361 HydrophobicContact CG2-CD1 4.06Å; I357-L361 HydrophobicContact CG2-CG 4.3Å; I357-L361 WeakPolarHBondContact O-CB 3.43Å; I357-L361 WeakPolarHBondContact O-CG 3.42Å; I357-L361 PolarHBondContact O-N 3.37Å; I357-L383 HydrophobicContact CB-CD1 4.11Å; I357-L383 HydrophobicContact CG2-CD1 3.54Å; I357-L383 HydrophobicContact CG2-CD2 3.74Å; I357-L383 HydrophobicContact CG2-CG 4.29Å |
| 358 | R | 83.6 | Confident | 82.5 | Confident | 9 Ų | 9 | 35.6 Ų | 35.6 | 3% | 0.034 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -60.4 | -43.5 | 179.4 | -178.4 | 175.3 | 64.3 | -162.3 | -1.2 | 111 | A186 L354 F355 P356 Q362 H376 I379 | A186-R358 PolarHBondContact O-NH1 2.9Å; L354-R358 HydrophobicContact CD2-CB 4.34Å; L354-R358 WeakPolarHBondContact O-CB 3.41Å; L354-R358 PolarHBondContact O-N 2.83Å; F355-R358 PolarHBondContact O-N 3.21Å; P356-R358 VanDerWaalsContact C-N 3.33Å; P356-R358 PolarHBondContact O-N 2.91Å; R358-Q362 HydrophobicContact CG-CG 4.46Å; R358-Q362 WeakPolarHBondContact O-CB 3.32Å; R358-Q362 WeakPolarHBondContact O-CG 3.16Å; R358-Q362 PolarHBondContact O-N 2.72Å; R358-H376 PolarHBondContact NE-CE1 3Å; R358-H376 VanDerWaalsContact NE-CE1 3.32Å; R358-H376 PolarHBondContact NH1-CE1 3.48Å; R358-H376 PolarHBondContact NH1-NE2 3.5Å; R358-H376 PolarHBondContact NH2-CE1 3.43Å; R358-I379 HydrophobicContact CB-CG2 4.4Å; R358-I379 HydrophobicContact CG-CG2 4.05Å |
| 359 | R | 78.5 | Confident | 82 | Confident | 73 Ų | 73 | 40.9 Ų | 40.9 | 28% | 0.275 | 22% | 0.222 | S | C | . | . | H | α-helix | trans | -61 | -47.6 | 176.1 | -177.4 | 177.2 | 172.8 | 170.7 | 0.4 | 111.2 | F355 P356 I357 Q362 Q363 | F355-R359 PolarHBondContact O-N 3.15Å; P356-R359 PolarHBondContact O-N 2.77Å; I357-R359 VanDerWaalsContact C-N 3.31Å; I357-R359 PolarHBondContact O-N 3.18Å; R359-Q362 PolarHBondContact O-N 2.94Å; R359-Q363 WeakPolarHBondContact O-CB 3.29Å; R359-Q363 VanDerWaalsContact O-CG 3.3Å; R359-Q363 WeakPolarHBondContact O-CG 3.46Å; R359-Q363 PolarHBondContact O-N 2.95Å |
| 360 | A | 80.3 | Confident | 81.5 | Confident | 4 Ų | 4 | 45 Ų | 45 | 3% | 0.033 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -60.7 | -47.3 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | A128 P356 I357 Q363 L364 | A128-A360 HydrophobicContact CB-CB 4.45Å; P356-A360 WeakPolarHBondContact O-CB 3.43Å; P356-A360 PolarHBondContact O-N 3.44Å; I357-A360 PolarHBondContact O-N 2.69Å; A360-Q363 PolarHBondContact O-N 3.44Å; A360-L364 WeakPolarHBondContact O-CB 3.28Å; A360-L364 PolarHBondContact O-N 2.93Å |
| 361 | L | 84.6 | Confident | 81.1 | Confident | 38 Ų | 38 | 49.2 Ų | 49.2 | 20% | 0.199 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -65.3 | -39.7 | 177.7 | -73.4 | -178.7 | 0 | 0 | 0 | 112.8 | I357 Q363 L364 L365 I379 L383 | I357-L361 HydrophobicContact CG2-CD1 4.06Å; I357-L361 HydrophobicContact CG2-CG 4.3Å; I357-L361 WeakPolarHBondContact O-CB 3.43Å; I357-L361 WeakPolarHBondContact O-CG 3.42Å; I357-L361 PolarHBondContact O-N 3.37Å; L361-Q363 VanDerWaalsContact C-N 3.34Å; L361-L364 PolarHBondContact O-N 3.31Å; L361-L365 WeakPolarHBondContact O-CB 3.12Å; L361-L365 PolarHBondContact O-N 2.96Å; L361-I379 HydrophobicContact CB-CG2 4.4Å; L361-I379 HydrophobicContact CD1-CG2 3.99Å; L361-L383 HydrophobicContact CD1-CD1 3.94Å; L361-L383 HydrophobicContact CD1-CD2 3.87Å; L361-L383 HydrophobicContact CD1-CG 4.03Å |
| 362 | Q | 83.3 | Confident | 81.1 | Confident | 40 Ų | 40 | 50.7 Ų | 50.7 | 19% | 0.187 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -63.1 | -42.1 | 175.3 | -76.3 | -179.2 | -29.5 | 0 | 0 | 111.6 | R358 R359 L364 F366 I379 | R358-Q362 HydrophobicContact CG-CG 4.46Å; R358-Q362 WeakPolarHBondContact O-CB 3.32Å; R358-Q362 WeakPolarHBondContact O-CG 3.16Å; R358-Q362 PolarHBondContact O-N 2.72Å; R359-Q362 PolarHBondContact O-N 2.94Å; Q362-L364 VanDerWaalsContact C-N 3.31Å; Q362-L364 PolarHBondContact O-N 3.41Å; Q362-F366 CarbonylContact O-C 3.18Å; Q362-F366 VanDerWaalsContact O-C 3.23Å; Q362-F366 WeakPolarHBondContact O-CA 3.44Å; Q362-F366 PolarHBondContact O-N 2.91Å; Q362-I379 HydrophobicContact CG-CD1 3.54Å |
| 363 | Q | 77.2 | Confident | 81.3 | Confident | 63 Ų | 63 | 56.8 Ų | 56.8 | 29% | 0.294 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -68.9 | -28.3 | 176.9 | -71.7 | -65.2 | -30.2 | 0 | 0 | 113.2 | E112 K124 R359 A360 L361 | E112-Q363 HydrophobicContact CG-CB 4.49Å; K124-Q363 WeakPolarHBondContact CE-O 3.28Å; K124-Q363 PolarHBondContact NZ-O 3.2Å; R359-Q363 WeakPolarHBondContact O-CB 3.29Å; R359-Q363 VanDerWaalsContact O-CG 3.3Å; R359-Q363 WeakPolarHBondContact O-CG 3.46Å; R359-Q363 PolarHBondContact O-N 2.95Å; A360-Q363 PolarHBondContact O-N 3.44Å; L361-Q363 VanDerWaalsContact C-N 3.34Å |
| 364 | L | 80.4 | Confident | 81.5 | Confident | 60 Ų | 60 | 61.2 Ų | 61.2 | 31% | 0.314 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -82 | -51.7 | 179.8 | -172.6 | 67.9 | 0 | 0 | 0 | 112.2 | V125 A360 L361 Q362 | V125-L364 HydrophobicContact CB-CD1 4.19Å; V125-L364 HydrophobicContact CG1-CD1 4.28Å; V125-L364 HydrophobicContact CG2-CD1 3.64Å; A360-L364 WeakPolarHBondContact O-CB 3.28Å; A360-L364 PolarHBondContact O-N 2.93Å; L361-L364 PolarHBondContact O-N 3.31Å; Q362-L364 VanDerWaalsContact C-N 3.31Å; Q362-L364 PolarHBondContact O-N 3.41Å |
| 365 | L | 83.6 | Confident | 81.6 | Confident | 104 Ų | 104 | 63 Ų | 63 | 55% | 0.545 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -83.9 | -30.2 | -173.9 | -64.2 | 172.3 | 0 | 0 | 0 | 113.1 | L361 | L361-L365 WeakPolarHBondContact O-CB 3.12Å; L361-L365 PolarHBondContact O-N 2.96Å |
| 366 | F | 83.8 | Confident | 81.9 | Confident | 72 Ų | 72 | 60.7 Ų | 60.7 | 32% | 0.316 | 33% | 0.333 | S | S | . | . | S | Bend | trans | -136.6 | 60.4 | -172.5 | -55.2 | -78.6 | 0 | 0 | 0 | 112.2 | Q362 G368 K369 R375 | Q362-F366 CarbonylContact O-C 3.18Å; Q362-F366 VanDerWaalsContact O-C 3.23Å; Q362-F366 WeakPolarHBondContact O-CA 3.44Å; Q362-F366 PolarHBondContact O-N 2.91Å; F366-G368 PolarHBondContact O-N 3.34Å; F366-K369 HydrophobicContact CB-CB 4.28Å; F366-K369 HydrophobicContact CB-CD 4.31Å; F366-K369 HydrophobicContact CB-CG 4.34Å; F366-K369 HydrophobicContact CD1-CD 4.15Å; F366-K369 PolarHBondContact O-N 3.34Å; F366-R375 VanDerWaalsContact CD2-CD 3.44Å; F366-R375 HydrophobicContact CD2-CG 4.23Å; F366-R375 HydrophobicContact CE2-CG 4.06Å |
| 367 | P | 76.5 | Confident | 82.5 | Confident | 83 Ų | 83 | 62.9 Ų | 62.9 | 54% | 0.539 | 35% | 0.345 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.1 | 129.5 | -179.2 | 25.5 | -34 | 0 | 0 | 0 | 110.9 | K369 | P367-K369 PolarHBondContact O-N 3.17Å; P367-K369 VanDerWaalsContact O-N 3.16Å |
| 368 | G | 70.9 | Confident | 82.9 | Confident | 84 Ų | 84 | 64.9 Ų | 64.9 | 87% | 0.866 | 36% | 0.362 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 71.1 | 3.8 | 173.7 | 0 | 0 | 0 | 0 | 0 | 116.4 | F366 | F366-G368 PolarHBondContact O-N 3.34Š|
| 369 | K | 78.6 | Confident | 83.2 | Confident | 138 Ų | 138 | 65.1 Ų | 65.1 | 60% | 0.6 | 36% | 0.364 | S | S | * | . | P | Polyproline II helix | trans | -79.1 | 133.8 | 176.5 | -67.4 | -159.4 | 178.2 | -176.1 | 0 | 111.6 | F366 P367 | F366-K369 HydrophobicContact CB-CB 4.28Å; F366-K369 HydrophobicContact CB-CD 4.31Å; F366-K369 HydrophobicContact CB-CG 4.34Å; F366-K369 HydrophobicContact CD1-CD 4.15Å; F366-K369 PolarHBondContact O-N 3.34Å; P367-K369 PolarHBondContact O-N 3.17Å; P367-K369 VanDerWaalsContact O-N 3.16Å |
| 370 | A | 78.9 | Confident | 83.7 | Confident | 86 Ų | 86 | 61.7 Ų | 61.7 | 71% | 0.711 | 35% | 0.351 | S | S | * | . | P | Polyproline II helix | trans | -55.9 | 152.3 | 173.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | S372 R375 | A370-S372 PolarHBondContact O-N 3Å; A370-R375 PolarHBondContact O-NH1 3.39Å; A370-R375 PolarHBondContact O-NH2 3.17Å |
| 371 | F | 80.4 | Confident | 84.3 | Confident | 90 Ų | 90 | 65.4 Ų | 65.4 | 40% | 0.395 | 37% | 0.37 | S | S | . | . | P | Polyproline II helix | trans | -55.9 | 135.3 | -179.5 | 176.8 | -92.1 | 0 | 0 | 0 | 111.7 | K189 W373 H376 | K189-F371 HydrophobicContact CD-CZ 4.48Å; F371-W373 AromaticContact CE1-CD1 3.84Å; F371-W373 HydrophobicContact CE1-CD2 4.13Å; F371-W373 HydrophobicContact CE1-CG 4.01Å; F371-W373 AromaticContact CE1-NE1 3.86Å; F371-W373 HydrophobicContact CZ-CD2 4.2Å; F371-W373 HydrophobicContact CZ-CG 4.45Å; F371-H376 HydrophobicContact CE2-CB 4.08Å; F371-H376 AromaticContact CE2-CE1 4Å; F371-H376 AromaticContact CE2-CG 3.87Å; F371-H376 AromaticContact CE2-ND1 3.51Å; F371-H376 HydrophobicContact CZ-CB 4.17Å |
| 372 | S | 86.4 | Confident | 84.7 | Confident | 37 Ų | 37 | 69.2 Ų | 69.2 | 26% | 0.259 | 39% | 0.389 | S | S | . | . | trans | -137.8 | 128.9 | 173.2 | 66.5 | 0 | 0 | 0 | 0 | 110.3 | A370 R375 H376 | A370-S372 PolarHBondContact O-N 3Å; S372-R375 PolarHBondContact O-N 3.18Å; S372-R375 WeakPolarHBondContact OG-CB 3.38Å; S372-R375 VanDerWaalsContact OG-CZ 3.27Å; S372-R375 PolarHBondContact OG-NH1 3.38Å; S372-H376 PolarHBondContact O-N 3.21Å | ||
| 373 | W | 86.9 | Confident | 85 | Confident | 138 Ų | 138 | 67.8 Ų | 67.8 | 52% | 0.523 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -55.7 | -46.2 | 178.5 | -85.3 | 107.5 | 0 | 0 | 0 | 114.3 | F371 R375 H376 V377 | F371-W373 AromaticContact CE1-CD1 3.84Å; F371-W373 HydrophobicContact CE1-CD2 4.13Å; F371-W373 HydrophobicContact CE1-CG 4.01Å; F371-W373 AromaticContact CE1-NE1 3.86Å; F371-W373 HydrophobicContact CZ-CD2 4.2Å; F371-W373 HydrophobicContact CZ-CG 4.45Å; W373-R375 VanDerWaalsContact C-N 3.33Å; W373-R375 PolarHBondContact O-N 2.96Å; W373-H376 WeakPolarHBondContact O-CB 3.48Å; W373-H376 PolarHBondContact O-N 3.07Å; W373-H376 VanDerWaalsContact O-N 3.07Å; W373-V377 HydrophobicContact CE3-CG2 4.36Å; W373-V377 WeakPolarHBondContact O-CG2 3.23Å; W373-V377 PolarHBondContact O-N 2.87Å |
| 374 | P | 89.4 | Confident | 85.8 | Confident | 102 Ų | 102 | 65.1 Ų | 65.1 | 66% | 0.662 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -59.8 | -43.2 | -178.9 | -25.7 | 35.1 | 0 | 0 | 0 | 112.6 | H376 V377 A378 | P374-H376 VanDerWaalsContact C-N 3.34Å; P374-H376 PolarHBondContact O-N 2.91Å; P374-V377 PolarHBondContact O-N 2.72Å; P374-A378 WeakPolarHBondContact O-CB 3.31Å; P374-A378 PolarHBondContact O-N 3.33Å |
| 375 | R | 88.4 | Confident | 86.4 | Confident | 40 Ų | 40 | 66.1 Ų | 66.1 | 15% | 0.151 | 38% | 0.379 | C | S | . | . | H | α-helix | trans | -64.6 | -39.2 | 175.7 | -172.1 | 175.4 | 68.5 | -126.3 | 9.1 | 112.3 | F366 A370 S372 W373 I379 | F366-R375 VanDerWaalsContact CD2-CD 3.44Å; F366-R375 HydrophobicContact CD2-CG 4.23Å; F366-R375 HydrophobicContact CE2-CG 4.06Å; A370-R375 PolarHBondContact O-NH1 3.39Å; A370-R375 PolarHBondContact O-NH2 3.17Å; S372-R375 PolarHBondContact O-N 3.18Å; S372-R375 WeakPolarHBondContact OG-CB 3.38Å; S372-R375 VanDerWaalsContact OG-CZ 3.27Å; S372-R375 PolarHBondContact OG-NH1 3.38Å; W373-R375 VanDerWaalsContact C-N 3.33Å; W373-R375 PolarHBondContact O-N 2.96Å; R375-I379 HydrophobicContact CG-CD1 3.88Å; R375-I379 HydrophobicContact CG-CG1 4.48Å; R375-I379 WeakPolarHBondContact O-CB 3.32Å; R375-I379 VanDerWaalsContact O-CG1 3.24Å; R375-I379 WeakPolarHBondContact O-CG1 3.34Å; R375-I379 PolarHBondContact O-N 3.48Å |
| 376 | H | 86.4 | Confident | 86.8 | Confident | 5 Ų | 5 | 65.9 Ų | 65.9 | 2% | 0.023 | 38% | 0.378 | C | S | . | . | H | α-helix | trans | -63.6 | -45.9 | 179.2 | -172.9 | 88.2 | 0 | 0 | 0 | 111.5 | R358 F371 S372 W373 P374 A380 | R358-H376 PolarHBondContact NE-CE1 3Å; R358-H376 VanDerWaalsContact NE-CE1 3.32Å; R358-H376 PolarHBondContact NH1-CE1 3.48Å; R358-H376 PolarHBondContact NH1-NE2 3.5Å; R358-H376 PolarHBondContact NH2-CE1 3.43Å; F371-H376 HydrophobicContact CE2-CB 4.08Å; F371-H376 AromaticContact CE2-CE1 4Å; F371-H376 AromaticContact CE2-CG 3.87Å; F371-H376 AromaticContact CE2-ND1 3.51Å; F371-H376 HydrophobicContact CZ-CB 4.17Å; S372-H376 PolarHBondContact O-N 3.21Å; W373-H376 WeakPolarHBondContact O-CB 3.48Å; W373-H376 PolarHBondContact O-N 3.07Å; W373-H376 VanDerWaalsContact O-N 3.07Å; P374-H376 VanDerWaalsContact C-N 3.34Å; P374-H376 PolarHBondContact O-N 2.91Å; H376-A380 PolarHBondContact O-N 3.3Å |
| 377 | V | 90.5 | Very high | 87.3 | Confident | 54 Ų | 54 | 62.5 Ų | 62.5 | 33% | 0.327 | 36% | 0.363 | S | S | . | . | H | α-helix | trans | -67.6 | -45.9 | 176.6 | 177.1 | 0 | 0 | 0 | 0 | 111 | L187 W373 P374 I379 A380 L381 | L187-V377 HydrophobicContact CD1-CG2 4.38Å; L187-V377 HydrophobicContact CD2-CB 4.14Å; L187-V377 HydrophobicContact CD2-CG1 4.29Å; L187-V377 HydrophobicContact CD2-CG2 3.82Å; W373-V377 HydrophobicContact CE3-CG2 4.36Å; W373-V377 WeakPolarHBondContact O-CG2 3.23Å; W373-V377 PolarHBondContact O-N 2.87Å; P374-V377 PolarHBondContact O-N 2.72Å; V377-I379 PolarHBondContact O-N 2.96Å; V377-A380 PolarHBondContact O-N 3.08Å; V377-L381 WeakPolarHBondContact O-CB 3.23Å; V377-L381 PolarHBondContact O-N 3.27Å |
| 378 | A | 91.4 | Very high | 88.1 | Confident | 42 Ų | 42 | 59.1 Ų | 59.1 | 35% | 0.347 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -60.1 | -44.5 | -179.1 | 0 | 0 | 0 | 0 | 0 | 112.5 | P374 L381 I382 | P374-A378 WeakPolarHBondContact O-CB 3.31Å; P374-A378 PolarHBondContact O-N 3.33Å; A378-L381 PolarHBondContact O-N 3.44Å; A378-I382 WeakPolarHBondContact O-CB 3.03Å; A378-I382 WeakPolarHBondContact O-CD1 3.25Å; A378-I382 WeakPolarHBondContact O-CG1 3.35Å; A378-I382 PolarHBondContact O-N 3.38Å |
| 379 | I | 90.2 | Very high | 89.2 | Confident | 15 Ų | 15 | 59 Ų | 59 | 8% | 0.077 | 32% | 0.323 | C | S | . | . | H | α-helix | trans | -62.9 | -45 | 177.7 | -68 | 168.7 | 0 | 0 | 0 | 110.8 | R358 L361 Q362 R375 V377 L383 | R358-I379 HydrophobicContact CB-CG2 4.4Å; R358-I379 HydrophobicContact CG-CG2 4.05Å; L361-I379 HydrophobicContact CB-CG2 4.4Å; L361-I379 HydrophobicContact CD1-CG2 3.99Å; Q362-I379 HydrophobicContact CG-CD1 3.54Å; R375-I379 HydrophobicContact CG-CD1 3.88Å; R375-I379 HydrophobicContact CG-CG1 4.48Å; R375-I379 WeakPolarHBondContact O-CB 3.32Å; R375-I379 VanDerWaalsContact O-CG1 3.24Å; R375-I379 WeakPolarHBondContact O-CG1 3.34Å; R375-I379 PolarHBondContact O-N 3.48Å; V377-I379 PolarHBondContact O-N 2.96Å; I379-L383 HydrophobicContact CG2-CD1 3.88Å; I379-L383 HydrophobicContact CG2-CG 4.44Å; I379-L383 WeakPolarHBondContact O-CB 3.28Å; I379-L383 VanDerWaalsContact O-CG 3.28Å; I379-L383 WeakPolarHBondContact O-CG 3.12Å; I379-L383 PolarHBondContact O-N 3.39Å |
| 380 | A | 90 | Very high | 89.8 | Confident | 1 Ų | 1 | 55.9 Ų | 55.9 | 1% | 0.008 | 31% | 0.312 | C | S | . | . | H | α-helix | trans | -63.2 | -43.5 | 178.6 | 0 | 0 | 0 | 0 | 0 | 111.8 | L187 L354 H376 V377 L384 | L187-A380 HydrophobicContact CD2-CB 3.92Å; L354-A380 HydrophobicContact CD2-CB 4.39Å; H376-A380 PolarHBondContact O-N 3.3Å; V377-A380 PolarHBondContact O-N 3.08Å; A380-L384 VanDerWaalsContact O-CB 3.26Å; A380-L384 WeakPolarHBondContact O-CB 3.31Å; A380-L384 PolarHBondContact O-N 2.86Å |
| 381 | L | 92 | Very high | 90.5 | Very high | 82 Ų | 82 | 51.8 Ų | 51.8 | 43% | 0.429 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -64.7 | -48.8 | 178.9 | -175.6 | 68.6 | 0 | 0 | 0 | 111.8 | L183 V377 A378 L383 L384 V385 | L183-L381 HydrophobicContact CD2-CD1 4.32Å; V377-L381 WeakPolarHBondContact O-CB 3.23Å; V377-L381 PolarHBondContact O-N 3.27Å; A378-L381 PolarHBondContact O-N 3.44Å; L381-L383 VanDerWaalsContact C-N 3.35Å; L381-L383 PolarHBondContact O-N 3.15Å; L381-L384 PolarHBondContact O-N 3.31Å; L381-V385 HydrophobicContact CD1-CG2 4.49Å; L381-V385 WeakPolarHBondContact O-CB 3.47Å; L381-V385 VanDerWaalsContact O-CG2 3.28Å; L381-V385 WeakPolarHBondContact O-CG2 3.48Å; L381-V385 PolarHBondContact O-N 2.82Å |
| 382 | I | 92.4 | Very high | 91 | Very high | 118 Ų | 118 | 50.5 Ų | 50.5 | 61% | 0.605 | 28% | 0.275 | S | S | * | . | H | α-helix | trans | -61.1 | -45.2 | 179.7 | -69.5 | 165.9 | 0 | 0 | 0 | 110.6 | A378 V385 L386 | A378-I382 WeakPolarHBondContact O-CB 3.03Å; A378-I382 WeakPolarHBondContact O-CD1 3.25Å; A378-I382 WeakPolarHBondContact O-CG1 3.35Å; A378-I382 PolarHBondContact O-N 3.38Å; I382-V385 PolarHBondContact O-N 3Å; I382-L386 WeakPolarHBondContact O-CB 3.39Å; I382-L386 PolarHBondContact O-N 3.25Å |
| 383 | L | 91.3 | Very high | 91.1 | Very high | 9 Ų | 9 | 53.4 Ų | 53.4 | 5% | 0.047 | 29% | 0.294 | C | S | . | . | H | α-helix | trans | -60.6 | -47.7 | 176.1 | -78.8 | 172.9 | 0 | 0 | 0 | 111.6 | I357 L361 I379 L381 V385 L386 V387 | I357-L383 HydrophobicContact CB-CD1 4.11Å; I357-L383 HydrophobicContact CG2-CD1 3.54Å; I357-L383 HydrophobicContact CG2-CD2 3.74Å; I357-L383 HydrophobicContact CG2-CG 4.29Å; L361-L383 HydrophobicContact CD1-CD1 3.94Å; L361-L383 HydrophobicContact CD1-CD2 3.87Å; L361-L383 HydrophobicContact CD1-CG 4.03Å; I379-L383 HydrophobicContact CG2-CD1 3.88Å; I379-L383 HydrophobicContact CG2-CG 4.44Å; I379-L383 WeakPolarHBondContact O-CB 3.28Å; I379-L383 VanDerWaalsContact O-CG 3.28Å; I379-L383 WeakPolarHBondContact O-CG 3.12Å; I379-L383 PolarHBondContact O-N 3.39Å; L381-L383 VanDerWaalsContact C-N 3.35Å; L381-L383 PolarHBondContact O-N 3.15Å; L383-V385 VanDerWaalsContact C-N 3.33Å; L383-V385 PolarHBondContact O-N 3.45Å; L383-L386 WeakPolarHBondContact O-CB 3.45Å; L383-L386 PolarHBondContact O-N 3.41Å; L383-V387 VanDerWaalsContact O-CG2 3.26Å; L383-V387 WeakPolarHBondContact O-CG2 3.5Å; L383-V387 PolarHBondContact O-N 2.87Å |
| 384 | L | 92.3 | Very high | 91.1 | Very high | 7 Ų | 7 | 48.2 Ų | 48.2 | 4% | 0.037 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -63.6 | -40.6 | -178.3 | -172.4 | 62.8 | 0 | 0 | 0 | 111.6 | S178 I182 L183 A380 L381 N388 | S178-L384 WeakPolarHBondContact O-CD2 3.41Å; I182-L384 HydrophobicContact CG2-CD1 4.04Å; L183-L384 HydrophobicContact CB-CD2 3.82Å; L183-L384 HydrophobicContact CD1-CD2 4.26Å; A380-L384 VanDerWaalsContact O-CB 3.26Å; A380-L384 WeakPolarHBondContact O-CB 3.31Å; A380-L384 PolarHBondContact O-N 2.86Å; L381-L384 PolarHBondContact O-N 3.31Å; L384-N388 WeakPolarHBondContact O-CB 3.41Å; L384-N388 PolarHBondContact O-N 3.46Å; L384-N388 PolarHBondContact O-ND2 3.47Å |
| 385 | V | 93.3 | Very high | 90.8 | Very high | 81 Ų | 81 | 48.2 Ų | 48.2 | 49% | 0.491 | 28% | 0.278 | S | S | . | . | H | α-helix | trans | -62.7 | -46.6 | 174.2 | 170.6 | 0 | 0 | 0 | 0 | 110.8 | L381 I382 L383 V387 N388 V389 | L381-V385 HydrophobicContact CD1-CG2 4.49Å; L381-V385 WeakPolarHBondContact O-CB 3.47Å; L381-V385 VanDerWaalsContact O-CG2 3.28Å; L381-V385 WeakPolarHBondContact O-CG2 3.48Å; L381-V385 PolarHBondContact O-N 2.82Å; I382-V385 PolarHBondContact O-N 3Å; L383-V385 VanDerWaalsContact C-N 3.33Å; L383-V385 PolarHBondContact O-N 3.45Å; V385-V387 PolarHBondContact O-N 3.46Å; V385-N388 PolarHBondContact O-N 2.8Å; V385-V389 HydrophobicContact CG1-CG2 4.42Å; V385-V389 WeakPolarHBondContact O-CG2 3.37Å; V385-V389 PolarHBondContact O-N 3.42Å |
| 386 | L | 93.4 | Very high | 90.7 | Very high | 100 Ų | 100 | 48.6 Ų | 48.6 | 52% | 0.524 | 29% | 0.285 | S | S | . | . | H | α-helix | trans | -57.5 | -47.9 | 178.2 | -174.9 | 98.5 | 0 | 0 | 0 | 111.7 | I382 L383 V389 L390 | I382-L386 WeakPolarHBondContact O-CB 3.39Å; I382-L386 PolarHBondContact O-N 3.25Å; L383-L386 WeakPolarHBondContact O-CB 3.45Å; L383-L386 PolarHBondContact O-N 3.41Å; L386-V389 PolarHBondContact O-N 3.28Å; L386-L390 PolarHBondContact O-N 3.46Å |
| 387 | V | 93.5 | Very high | 90.7 | Very high | 0 Ų | 0 | 48.7 Ų | 48.7 | 0% | 0 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -65.7 | -42.9 | 179.8 | -179.3 | 0 | 0 | 0 | 0 | 110.6 | V136 M139 S140 L143 L383 V385 V389 L390 V391 | V136-V387 HydrophobicContact CG1-CG2 4.26Å; M139-V387 HydrophobicContact CB-CG1 3.93Å; M139-V387 HydrophobicContact CB-CG2 4.28Å; M139-V387 HydrophobicContact CE-CG2 4.14Å; S140-V387 WeakPolarHBondContact OG-CG1 3.47Å; L143-V387 HydrophobicContact CD1-CB 4.23Å; L143-V387 HydrophobicContact CD1-CG1 3.54Å; L143-V387 HydrophobicContact CG-CG1 4.23Å; L383-V387 VanDerWaalsContact O-CG2 3.26Å; L383-V387 WeakPolarHBondContact O-CG2 3.5Å; L383-V387 PolarHBondContact O-N 2.87Å; V385-V387 PolarHBondContact O-N 3.46Å; V387-V389 PolarHBondContact O-N 3.48Å; V387-L390 PolarHBondContact O-N 2.93Å; V387-V391 HydrophobicContact CG1-CG2 4.4Å; V387-V391 VanDerWaalsContact O-CG2 3.3Å; V387-V391 WeakPolarHBondContact O-CG2 3.23Å; V387-V391 PolarHBondContact O-N 3.22Å |
| 388 | N | 93.1 | Very high | 90.6 | Very high | 13 Ų | 13 | 47.1 Ų | 47.1 | 7% | 0.07 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -60.2 | -45.3 | 176.8 | -88.6 | -88.7 | 0 | 0 | 0 | 111.9 | S178 L384 V385 L390 V391 I392 | S178-N388 PolarHBondContact OG-ND2 3.37Å; S178-N388 PolarHBondContact OG-OD1 3.19Å; L384-N388 WeakPolarHBondContact O-CB 3.41Å; L384-N388 PolarHBondContact O-N 3.46Å; L384-N388 PolarHBondContact O-ND2 3.47Å; V385-N388 PolarHBondContact O-N 2.8Å; N388-L390 VanDerWaalsContact C-N 3.33Å; N388-L390 PolarHBondContact O-N 3.49Å; N388-V391 PolarHBondContact O-N 3.01Å; N388-I392 WeakPolarHBondContact O-CD1 3.46Å; N388-I392 VanDerWaalsContact O-CG1 3.26Å; N388-I392 WeakPolarHBondContact O-CG1 3.29Å; N388-I392 PolarHBondContact O-N 3.16Å |
| 389 | V | 93.6 | Very high | 90.4 | Very high | 82 Ų | 82 | 46.5 Ų | 46.5 | 50% | 0.497 | 27% | 0.265 | S | S | . | . | H | α-helix | trans | -60 | -45.1 | 176.2 | 171.3 | 0 | 0 | 0 | 0 | 110.6 | V385 L386 V387 V391 I392 C393 | V385-V389 HydrophobicContact CG1-CG2 4.42Å; V385-V389 WeakPolarHBondContact O-CG2 3.37Å; V385-V389 PolarHBondContact O-N 3.42Å; L386-V389 PolarHBondContact O-N 3.28Å; V387-V389 PolarHBondContact O-N 3.48Å; V389-V391 PolarHBondContact O-N 3.02Å; V389-I392 PolarHBondContact O-N 3.38Å; V389-C393 PolarHBondContact O-N 2.85Å; V389-C393 VanDerWaalsContact O-N 3.1Å; V389-C393 PolarHBondContact O-SG 3.06Å |
| 390 | L | 92.6 | Very high | 90.4 | Very high | 72 Ų | 72 | 46.2 Ų | 46.2 | 38% | 0.377 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -58.7 | -46.8 | 178.3 | -170.7 | 122.3 | 0 | 0 | 0 | 111.7 | S140 L386 V387 N388 I392 C393 V394 | S140-L390 WeakPolarHBondContact OG-CD2 3.33Å; L386-L390 PolarHBondContact O-N 3.46Å; V387-L390 PolarHBondContact O-N 2.93Å; N388-L390 VanDerWaalsContact C-N 3.33Å; N388-L390 PolarHBondContact O-N 3.49Å; L390-I392 VanDerWaalsContact C-N 3.33Å; L390-I392 PolarHBondContact O-N 2.98Å; L390-C393 PolarHBondContact O-N 3.36Å; L390-V394 HydrophobicContact CD2-CG2 4.31Å; L390-V394 HydrophobicContact CG-CG2 4.33Å; L390-V394 VanDerWaalsContact O-CG2 3.25Å; L390-V394 WeakPolarHBondContact O-CG2 3.33Å; L390-V394 PolarHBondContact O-N 2.95Å |
| 391 | V | 92.4 | Very high | 90.5 | Very high | 0 Ų | 0 | 46.2 Ų | 46.2 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -68 | -31.8 | -179.3 | 174.8 | 0 | 0 | 0 | 0 | 112.9 | S140 L143 F144 K147 I174 V387 N388 V389 C393 | S140-V391 WeakPolarHBondContact O-CG2 3.08Å; L143-V391 HydrophobicContact CB-CG1 4.42Å; L143-V391 HydrophobicContact CB-CG2 3.89Å; F144-V391 HydrophobicContact CB-CG1 4.05Å; F144-V391 HydrophobicContact CD2-CG1 4.21Å; K147-V391 HydrophobicContact CB-CG1 4.5Å; K147-V391 HydrophobicContact CD-CG1 3.95Å; K147-V391 PolarHBondContact NZ-O 3.49Å; I174-V391 HydrophobicContact CD1-CB 4.06Å; I174-V391 HydrophobicContact CD1-CG1 3.53Å; V387-V391 HydrophobicContact CG1-CG2 4.4Å; V387-V391 VanDerWaalsContact O-CG2 3.3Å; V387-V391 WeakPolarHBondContact O-CG2 3.23Å; V387-V391 PolarHBondContact O-N 3.22Å; N388-V391 PolarHBondContact O-N 3.01Å; V389-V391 PolarHBondContact O-N 3.02Å; V391-C393 VanDerWaalsContact C-N 3.33Å |
| 392 | I | 90.9 | Very high | 90.3 | Very high | 62 Ų | 62 | 42.3 Ų | 42.3 | 32% | 0.318 | 24% | 0.243 | S | C | . | . | H | α-helix | trans | -67.1 | -38.7 | 174.1 | -69.7 | 165.3 | 0 | 0 | 0 | 110.3 | N171 I175 N388 V389 L390 | N171-I392 HydrophobicContact CB-CG1 4.48Å; I175-I392 HydrophobicContact CD1-CD1 4.37Å; N388-I392 WeakPolarHBondContact O-CD1 3.46Å; N388-I392 VanDerWaalsContact O-CG1 3.26Å; N388-I392 WeakPolarHBondContact O-CG1 3.29Å; N388-I392 PolarHBondContact O-N 3.16Å; V389-I392 PolarHBondContact O-N 3.38Å; L390-I392 VanDerWaalsContact C-N 3.33Å; L390-I392 PolarHBondContact O-N 2.98Å |
| 393 | C | 89.6 | Confident | 90.3 | Very high | 99 Ų | 99 | 38.9 Ų | 38.9 | 67% | 0.669 | 23% | 0.228 | S | C | * | . | H | α-helix | trans | -78.5 | -26.1 | -179.2 | -66.4 | 0 | 0 | 0 | 0 | 114.3 | V389 L390 V391 | V389-C393 PolarHBondContact O-N 2.85Å; V389-C393 VanDerWaalsContact O-N 3.1Å; V389-C393 PolarHBondContact O-SG 3.06Å; L390-C393 PolarHBondContact O-N 3.36Å; V391-C393 VanDerWaalsContact C-N 3.33Å |
| 394 | V | 86.9 | Confident | 90.4 | Very high | 28 Ų | 28 | 39 Ų | 39 | 17% | 0.17 | 23% | 0.228 | C | C | . | . | trans | -81.4 | 127.5 | -177.8 | 172.3 | 0 | 0 | 0 | 0 | 110.9 | L390 T396 I400 | L390-V394 HydrophobicContact CD2-CG2 4.31Å; L390-V394 HydrophobicContact CG-CG2 4.33Å; L390-V394 VanDerWaalsContact O-CG2 3.25Å; L390-V394 WeakPolarHBondContact O-CG2 3.33Å; L390-V394 PolarHBondContact O-N 2.95Å; V394-T396 WeakPolarHBondContact CG1-O 3.21Å; V394-I400 HydrophobicContact CB-CD1 4.49Å; V394-I400 HydrophobicContact CG1-CD1 3.99Å; V394-I400 HydrophobicContact CG1-CG1 3.71Å | ||
| 395 | P | 81.9 | Confident | 90.3 | Very high | 103 Ų | 103 | 38.7 Ų | 38.7 | 67% | 0.669 | 23% | 0.226 | S | C | * | . | trans | -81.6 | -36.7 | -179.5 | 30.3 | -33.3 | 0 | 0 | 0 | 113.2 | ||||
| 396 | T | 85.9 | Confident | 90.3 | Very high | 48 Ų | 48 | 34.9 Ų | 34.9 | 29% | 0.294 | 20% | 0.203 | S | C | . | . | trans | -126 | 142.3 | -174.4 | 77.8 | 0 | 0 | 0 | 0 | 112 | V394 Q398 D399 | V394-T396 WeakPolarHBondContact CG1-O 3.21Å; T396-Q398 PolarHBondContact O-N 3.48Å; T396-D399 PolarHBondContact O-N 3.04Å; T396-D399 PolarHBondContact OG1-N 3.06Å; T396-D399 PolarHBondContact OG1-OD2 3.43Å | ||
| 397 | I | 87.9 | Confident | 90.4 | Very high | 6 Ų | 6 | 31.4 Ų | 31.4 | 3% | 0.031 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -67.2 | -28.5 | 173.7 | -161.8 | 171.7 | 0 | 0 | 0 | 112 | F144 I145 A322 D399 I400 F401 | F144-I397 HydrophobicContact CD1-CB 3.73Å; F144-I397 HydrophobicContact CD1-CD1 4.06Å; F144-I397 HydrophobicContact CD1-CG1 4.07Å; F144-I397 HydrophobicContact CE1-CB 3.8Å; F144-I397 HydrophobicContact CG-CB 4.26Å; F144-I397 HydrophobicContact CG-CG1 4.37Å; F144-I397 HydrophobicContact CZ-CB 4.37Å; I145-I397 HydrophobicContact CD1-CD1 4.45Å; I145-I397 HydrophobicContact CG1-CD1 3.97Å; A322-I397 HydrophobicContact CB-CG2 4.07Å; I397-D399 VanDerWaalsContact C-N 3.33Å; I397-D399 PolarHBondContact O-N 3.37Å; I397-I400 WeakPolarHBondContact O-CB 3.44Å; I397-I400 PolarHBondContact O-N 3.39Å; I397-I400 VanDerWaalsContact O-N 3.12Å; I397-F401 HydrophobicContact CD1-CE1 4.39Å; I397-F401 HydrophobicContact CD1-CE2 3.84Å; I397-F401 HydrophobicContact CD1-CZ 3.56Å; I397-F401 HydrophobicContact CG1-CD2 4.31Å; I397-F401 HydrophobicContact CG1-CE1 4.21Å; I397-F401 HydrophobicContact CG1-CE2 3.73Å; I397-F401 HydrophobicContact CG1-CZ 3.67Å; I397-F401 HydrophobicContact CG2-CE2 4.33Å; I397-F401 PolarHBondContact O-N 2.99Å; I397-F401 VanDerWaalsContact O-N 3.08Å |
| 398 | Q | 86.9 | Confident | 90.4 | Very high | 22 Ų | 22 | 31.5 Ų | 31.5 | 10% | 0.103 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -60.4 | -40.1 | 178.1 | 179.8 | 176.1 | -2.5 | 0 | 0 | 112.1 | Y71 Y260 A322 T396 I400 F401 G402 | Y71-Q398 HydrophobicContact CE1-CG 4.5Å; Y71-Q398 PolarHBondContact OH-NE2 3.32Å; Y71-Q398 PolarHBondContact OH-OE1 3.15Å; Y260-Q398 HydrophobicContact CD1-CG 3.9Å; Y260-Q398 HydrophobicContact CE1-CG 4.47Å; Y260-Q398 HydrophobicContact CG-CG 4Å; A322-Q398 HydrophobicContact CB-CB 4.06Å; T396-Q398 PolarHBondContact O-N 3.48Å; Q398-I400 VanDerWaalsContact C-N 3.29Å; Q398-I400 PolarHBondContact O-N 3.46Å; Q398-F401 PolarHBondContact O-N 3.27Å; Q398-G402 PolarHBondContact O-N 3.05Å |
| 399 | D | 88.1 | Confident | 90.5 | Very high | 28 Ų | 28 | 30.9 Ų | 30.9 | 15% | 0.15 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -62.8 | -37.5 | 176.4 | -72 | -46.3 | 0 | 0 | 0 | 111.5 | T396 I397 G402 V403 W462 | T396-D399 PolarHBondContact O-N 3.04Å; T396-D399 PolarHBondContact OG1-N 3.06Å; T396-D399 PolarHBondContact OG1-OD2 3.43Å; I397-D399 VanDerWaalsContact C-N 3.33Å; I397-D399 PolarHBondContact O-N 3.37Å; D399-G402 PolarHBondContact O-N 3.22Å; D399-V403 WeakPolarHBondContact O-CB 3.44Å; D399-V403 VanDerWaalsContact O-CG2 3.27Å; D399-V403 WeakPolarHBondContact O-CG2 3.43Å; D399-V403 PolarHBondContact O-N 2.91Å; D399-W462 PolarHBondContact OD1-NE1 2.53Å |
| 400 | I | 91.1 | Very high | 90.5 | Very high | 9 Ų | 9 | 27 Ų | 27 | 5% | 0.046 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -62.8 | -51.4 | 175.5 | -52.6 | -179.1 | 0 | 0 | 0 | 109.6 | F144 V394 I397 Q398 G402 I404 | F144-I400 HydrophobicContact CB-CD1 4.29Å; F144-I400 HydrophobicContact CD2-CD1 4.27Å; V394-I400 HydrophobicContact CB-CD1 4.49Å; V394-I400 HydrophobicContact CG1-CD1 3.99Å; V394-I400 HydrophobicContact CG1-CG1 3.71Å; I397-I400 WeakPolarHBondContact O-CB 3.44Å; I397-I400 PolarHBondContact O-N 3.39Å; I397-I400 VanDerWaalsContact O-N 3.12Å; Q398-I400 VanDerWaalsContact C-N 3.29Å; Q398-I400 PolarHBondContact O-N 3.46Å; I400-G402 VanDerWaalsContact C-N 3.33Å; I400-G402 PolarHBondContact O-N 3.33Å; I400-I404 HydrophobicContact CG2-CG1 4.23Å; I400-I404 VanDerWaalsContact O-CB 3.3Å; I400-I404 WeakPolarHBondContact O-CB 3.04Å; I400-I404 WeakPolarHBondContact O-CG1 3.24Å; I400-I404 PolarHBondContact O-N 3.5Å |
| 401 | F | 90.5 | Very high | 90.7 | Very high | 2 Ų | 2 | 24.4 Ų | 24.4 | 1% | 0.009 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -64.3 | -38.5 | 179.9 | -62.7 | -29.9 | 0 | 0 | 0 | 112.6 | S64 I264 F267 I397 Q398 G405 | S64-F401 WeakPolarHBondContact O-CZ 3.48Å; S64-F401 WeakPolarHBondContact OG-CE1 3.23Å; I264-F401 HydrophobicContact CB-CB 4.49Å; I264-F401 HydrophobicContact CG1-CB 3.6Å; I264-F401 HydrophobicContact CG1-CD2 4.26Å; I264-F401 HydrophobicContact CG1-CG 4.34Å; F267-F401 AromaticContact CD1-CD1 3.62Å; F267-F401 HydrophobicContact CD1-CD1 3.62Å; F267-F401 AromaticContact CD1-CE1 3.97Å; F267-F401 HydrophobicContact CD1-CE1 3.97Å; F267-F401 HydrophobicContact CD1-CG 4.39Å; F267-F401 AromaticContact CE1-CD1 3.48Å; F267-F401 HydrophobicContact CE1-CD1 3.48Å; F267-F401 VanDerWaalsContact CE1-CD1 3.48Å; F267-F401 AromaticContact CE1-CE1 3.41Å; F267-F401 HydrophobicContact CE1-CE1 3.41Å; F267-F401 VanDerWaalsContact CE1-CE1 3.41Å; F267-F401 HydrophobicContact CE1-CZ 4.48Å; F267-F401 HydrophobicContact CG-CD1 4.41Å; F267-F401 HydrophobicContact CZ-CD1 4.16Å; F267-F401 HydrophobicContact CZ-CE1 4.11Å; I397-F401 HydrophobicContact CD1-CE1 4.39Å; I397-F401 HydrophobicContact CD1-CE2 3.84Å; I397-F401 HydrophobicContact CD1-CZ 3.56Å; I397-F401 HydrophobicContact CG1-CD2 4.31Å; I397-F401 HydrophobicContact CG1-CE1 4.21Å; I397-F401 HydrophobicContact CG1-CE2 3.73Å; I397-F401 HydrophobicContact CG1-CZ 3.67Å; I397-F401 HydrophobicContact CG2-CE2 4.33Å; I397-F401 PolarHBondContact O-N 2.99Å; I397-F401 VanDerWaalsContact O-N 3.08Å; Q398-F401 PolarHBondContact O-N 3.27Å; F401-G405 VanDerWaalsContact O-CA 3.26Å; F401-G405 WeakPolarHBondContact O-CA 3.1Å; F401-G405 PolarHBondContact O-N 3.45Å |
| 402 | G | 89.7 | Confident | 90.8 | Very high | 0 Ų | 0 | 24.4 Ų | 24.4 | 0% | 0 | 15% | 0.148 | C | C | . | . | H | α-helix | trans | -61.2 | -54.8 | 176 | 0 | 0 | 0 | 0 | 0 | 112.1 | Q398 D399 I400 S406 M458 | Q398-G402 PolarHBondContact O-N 3.05Å; D399-G402 PolarHBondContact O-N 3.22Å; I400-G402 VanDerWaalsContact C-N 3.33Å; I400-G402 PolarHBondContact O-N 3.33Å; G402-S406 WeakPolarHBondContact O-CB 3.15Å; G402-S406 PolarHBondContact O-N 2.85Å; G402-S406 PolarHBondContact O-OG 2.86Å; G402-M458 VanDerWaalsContact CA-SD 3.52Å |
| 403 | V | 91.8 | Very high | 91 | Very high | 46 Ų | 46 | 21.4 Ų | 21.4 | 28% | 0.279 | 13% | 0.133 | S | C | . | . | H | α-helix | trans | -63.6 | -49.2 | -178.4 | 174.5 | 0 | 0 | 0 | 0 | 111.7 | D399 S406 T407 M458 W462 | D399-V403 WeakPolarHBondContact O-CB 3.44Å; D399-V403 VanDerWaalsContact O-CG2 3.27Å; D399-V403 WeakPolarHBondContact O-CG2 3.43Å; D399-V403 PolarHBondContact O-N 2.91Å; V403-S406 PolarHBondContact O-N 3.04Å; V403-S406 PolarHBondContact O-OG 3.36Å; V403-T407 WeakPolarHBondContact O-CB 3.48Å; V403-T407 WeakPolarHBondContact O-CG2 3.3Å; V403-T407 PolarHBondContact O-N 3.43Å; V403-T407 VanDerWaalsContact O-N 3.15Å; V403-T407 PolarHBondContact O-OG1 3.32Å; V403-M458 HydrophobicContact CB-CE 4.22Å; V403-M458 HydrophobicContact CG2-CE 3.71Å; V403-W462 HydrophobicContact CG2-CH2 3.54Å; V403-W462 HydrophobicContact CG2-CZ2 3.76Å |
| 404 | I | 93.1 | Very high | 91.3 | Very high | 12 Ų | 12 | 17.2 Ų | 17.2 | 6% | 0.062 | 10% | 0.103 | C | C | . | . | H | α-helix | trans | -73 | -37.6 | -174.9 | -57.7 | -65 | 0 | 0 | 0 | 110.4 | L133 F267 I400 S408 A409 | L133-I404 HydrophobicContact CD1-CD1 4.04Å; L133-I404 HydrophobicContact CG-CD1 4.28Å; F267-I404 HydrophobicContact CD2-CB 4.29Å; F267-I404 HydrophobicContact CD2-CG2 3.67Å; F267-I404 HydrophobicContact CE2-CG2 3.84Å; I400-I404 HydrophobicContact CG2-CG1 4.23Å; I400-I404 VanDerWaalsContact O-CB 3.3Å; I400-I404 WeakPolarHBondContact O-CB 3.04Å; I400-I404 WeakPolarHBondContact O-CG1 3.24Å; I400-I404 PolarHBondContact O-N 3.5Å; I404-S408 WeakPolarHBondContact CG2-OG 3.47Å; I404-S408 PolarHBondContact O-N 2.83Å; I404-S408 PolarHBondContact O-OG 2.97Å; I404-A409 PolarHBondContact O-N 3.47Å |
| 405 | G | 91.3 | Very high | 91.7 | Very high | 0 Ų | 0 | 16.9 Ų | 16.9 | 0% | 0 | 10% | 0.1 | C | C | . | . | H | α-helix | trans | -72.5 | -25.8 | 177.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | P263 F401 P410 | P263-G405 VanDerWaalsContact O-CA 3.29Å; P263-G405 WeakPolarHBondContact O-CA 3.48Å; F401-G405 VanDerWaalsContact O-CA 3.26Å; F401-G405 WeakPolarHBondContact O-CA 3.1Å; F401-G405 PolarHBondContact O-N 3.45Å; G405-P410 WeakPolarHBondContact O-CD 3.38Å |
| 406 | S | 92.7 | Very high | 92.4 | Very high | 0 Ų | 0 | 12.8 Ų | 12.8 | 0% | 0 | 7% | 0.072 | C | C | . | . | H | α-helix | trans | -90.6 | -18.5 | 176.8 | 59.5 | 0 | 0 | 0 | 0 | 113.7 | G402 V403 P410 M451 M458 | G402-S406 WeakPolarHBondContact O-CB 3.15Å; G402-S406 PolarHBondContact O-N 2.85Å; G402-S406 PolarHBondContact O-OG 2.86Å; V403-S406 PolarHBondContact O-N 3.04Å; V403-S406 PolarHBondContact O-OG 3.36Å; S406-P410 WeakPolarHBondContact O-CG 3.25Å; S406-M451 WeakPolarHBondContact O-CG 3.29Å; S406-M458 WeakPolarHBondContact OG-CE 3.5Å |
| 407 | T | 94.4 | Very high | 92.8 | Very high | 28 Ų | 28 | 10.5 Ų | 10.5 | 17% | 0.172 | 6% | 0.058 | C | C | . | . | H | α-helix | trans | -108 | -68.6 | -178.3 | 56.5 | 0 | 0 | 0 | 0 | 112.1 | V403 S411 L455 | V403-T407 WeakPolarHBondContact O-CB 3.48Å; V403-T407 WeakPolarHBondContact O-CG2 3.3Å; V403-T407 PolarHBondContact O-N 3.43Å; V403-T407 VanDerWaalsContact O-N 3.15Å; V403-T407 PolarHBondContact O-OG1 3.32Å; T407-S411 WeakPolarHBondContact O-CB 3.32Å; T407-S411 PolarHBondContact O-N 3.47Å; T407-S411 PolarHBondContact O-OG 3.02Å; T407-L455 HydrophobicContact CG2-CD1 4.13Å; T407-L455 HydrophobicContact CG2-CD2 3.64Å; T407-L455 HydrophobicContact CG2-CG 4.22Å |
| 408 | S | 94.6 | Very high | 93 | Very high | 1 Ų | 1 | 10.2 Ų | 10.2 | 1% | 0.007 | 6% | 0.057 | C | C | . | . | H | α-helix | trans | -75.1 | -37 | -169.3 | 75.7 | 0 | 0 | 0 | 0 | 112.2 | H134 I404 S411 L412 | H134-S408 PolarHBondContact ND1-OG 3.13Å; I404-S408 WeakPolarHBondContact CG2-OG 3.47Å; I404-S408 PolarHBondContact O-N 2.83Å; I404-S408 PolarHBondContact O-OG 2.97Å; S408-S411 WeakPolarHBondContact O-CB 3.13Å; S408-S411 PolarHBondContact O-N 3.12Å; S408-L412 WeakPolarHBondContact O-CB 3.14Å; S408-L412 WeakPolarHBondContact O-CG 3.15Å; S408-L412 PolarHBondContact O-N 2.86Å |
| 409 | A | 93.9 | Very high | 93.4 | Very high | 0 Ų | 0 | 12.1 Ų | 12.1 | 0% | 0 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -65.2 | -51.8 | 179.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | A266 V270 I404 S411 L412 I413 | A266-A409 HydrophobicContact CB-CB 3.88Å; V270-A409 HydrophobicContact CG2-CB 3.37Å; I404-A409 PolarHBondContact O-N 3.47Å; A409-S411 PolarHBondContact O-N 2.99Å; A409-L412 PolarHBondContact O-N 3.32Å; A409-I413 HydrophobicContact CB-CD1 4.31Å; A409-I413 WeakPolarHBondContact O-CB 3.22Å; A409-I413 VanDerWaalsContact O-CG1 3.32Å; A409-I413 WeakPolarHBondContact O-CG1 3.35Å; A409-I413 PolarHBondContact O-N 3.13Å |
| 410 | P | 95.1 | Very high | 93.6 | Very high | 0 Ų | 0 | 10.8 Ų | 10.8 | 0% | 0 | 6% | 0.06 | C | C | . | . | H | α-helix | trans | -55 | -40.3 | 173 | -7 | -2 | 0 | 0 | 0 | 112.6 | G405 S406 F414 I415 F450 M451 | G405-P410 WeakPolarHBondContact O-CD 3.38Å; S406-P410 WeakPolarHBondContact O-CG 3.25Å; P410-F414 WeakPolarHBondContact O-CA 3.31Å; P410-F414 WeakPolarHBondContact O-CB 3.34Å; P410-F414 PolarHBondContact O-N 3.02Å; P410-I415 PolarHBondContact O-N 3.38Å; P410-I415 VanDerWaalsContact O-N 3.09Å; P410-F450 HydrophobicContact CB-CD1 3.69Å; P410-F450 HydrophobicContact CB-CE1 4.19Å; P410-F450 HydrophobicContact CG-CD1 3.65Å; P410-F450 HydrophobicContact CG-CE1 3.72Å; P410-M451 HydrophobicContact CB-CB 3.94Å; P410-M451 HydrophobicContact CG-CB 4Å; P410-M451 HydrophobicContact CG-CG 4.43Å |
| 411 | S | 96 | Very high | 93.6 | Very high | 18 Ų | 18 | 11 Ų | 11 | 13% | 0.126 | 6% | 0.06 | C | C | . | . | I | π-helix | trans | -63 | -45.7 | -179.9 | -61.9 | 0 | 0 | 0 | 0 | 112.1 | T407 S408 A409 L416 | T407-S411 WeakPolarHBondContact O-CB 3.32Å; T407-S411 PolarHBondContact O-N 3.47Å; T407-S411 PolarHBondContact O-OG 3.02Å; S408-S411 WeakPolarHBondContact O-CB 3.13Å; S408-S411 PolarHBondContact O-N 3.12Å; A409-S411 PolarHBondContact O-N 2.99Å; S411-L416 WeakPolarHBondContact O-CB 3.23Å; S411-L416 VanDerWaalsContact O-CG 3.26Å; S411-L416 WeakPolarHBondContact O-CG 3.37Å; S411-L416 PolarHBondContact O-N 3.5Å |
| 412 | L | 95.1 | Very high | 93.5 | Very high | 0 Ų | 0 | 12.9 Ų | 12.9 | 0% | 0 | 7% | 0.07 | C | C | . | . | I | π-helix | trans | -81.4 | -34.8 | -176.4 | -72.5 | 168.5 | 0 | 0 | 0 | 114 | Y111 V130 I131 H134 V270 H272 P273 S408 A409 L416 P417 | Y111-L412 HydrophobicContact CE1-CD2 4.44Å; Y111-L412 PolarHBondContact OH-O 3.43Å; V130-L412 HydrophobicContact CG1-CD1 4.26Å; V130-L412 HydrophobicContact CG1-CD2 3.88Å; V130-L412 HydrophobicContact CG1-CG 3.67Å; I131-L412 HydrophobicContact CG1-CD2 4.01Å; H134-L412 HydrophobicContact CB-CD1 3.56Å; V270-L412 HydrophobicContact CG1-CB 4.11Å; V270-L412 HydrophobicContact CG1-CD1 3.73Å; H272-L412 HydrophobicContact CB-CB 4.31Å; H272-L412 PolarHBondContact CD2-O 3.47Å; P273-L412 HydrophobicContact CG-CD1 3.84Å; P273-L412 HydrophobicContact CG-CD2 4.31Å; S408-L412 WeakPolarHBondContact O-CB 3.14Å; S408-L412 WeakPolarHBondContact O-CG 3.15Å; S408-L412 PolarHBondContact O-N 2.86Å; A409-L412 PolarHBondContact O-N 3.32Å; L412-L416 HydrophobicContact CD2-CD1 4.07Å; L412-P417 WeakPolarHBondContact O-CD 3.49Å; L412-P417 WeakPolarHBondContact O-CG 3.36Å |
| 413 | I | 95.3 | Very high | 93.5 | Very high | 0 Ų | 0 | 21.4 Ų | 21.4 | 0% | 0 | 10% | 0.103 | C | C | . | . | I | π-helix | trans | -83.7 | -41.5 | -178.1 | -60.4 | 170.8 | 0 | 0 | 0 | 110.7 | S95 A266 V270 A409 F443 | S95-I413 WeakPolarHBondContact CB-O 3.4Å; S95-I413 PolarHBondContact OG-O 2.89Å; A266-I413 WeakPolarHBondContact O-CD1 3.41Å; V270-I413 HydrophobicContact CG2-CD1 3.79Å; V270-I413 HydrophobicContact CG2-CG1 4.1Å; A409-I413 HydrophobicContact CB-CD1 4.31Å; A409-I413 WeakPolarHBondContact O-CB 3.22Å; A409-I413 VanDerWaalsContact O-CG1 3.32Å; A409-I413 WeakPolarHBondContact O-CG1 3.35Å; A409-I413 PolarHBondContact O-N 3.13Å; I413-F443 HydrophobicContact CG2-CZ 4.42Å; I413-F443 WeakPolarHBondContact O-CE1 3.47Å; I413-F443 WeakPolarHBondContact O-CZ 3.46Å |
| 414 | F | 95.5 | Very high | 93.3 | Very high | 10 Ų | 10 | 20.1 Ų | 20.1 | 4% | 0.044 | 9% | 0.094 | C | C | . | . | I | π-helix | trans | -111.7 | -59.1 | -169.1 | -58.4 | -95.1 | 0 | 0 | 0 | 111.7 | L91 P410 S418 F443 L446 G447 F450 | L91-F414 HydrophobicContact CB-CE1 4.13Å; L91-F414 HydrophobicContact CB-CZ 4.38Å; L91-F414 HydrophobicContact CD1-CE1 3.94Å; L91-F414 HydrophobicContact CD1-CZ 4.19Å; L91-F414 HydrophobicContact CG-CE1 4.41Å; P410-F414 WeakPolarHBondContact O-CA 3.31Å; P410-F414 WeakPolarHBondContact O-CB 3.34Å; P410-F414 PolarHBondContact O-N 3.02Å; F414-S418 VanDerWaalsContact O-CB 3.23Å; F414-S418 WeakPolarHBondContact O-CB 3.4Å; F414-S418 PolarHBondContact O-N 3.31Å; F414-S418 PolarHBondContact O-OG 3.34Å; F414-S418 VanDerWaalsContact O-OG 3.1Å; F414-F443 HydrophobicContact CB-CE1 4.45Å; F414-F443 HydrophobicContact CB-CZ 4.46Å; F414-F443 AromaticContact CD1-CD2 3.73Å; F414-F443 HydrophobicContact CD1-CD2 3.73Å; F414-F443 HydrophobicContact CD1-CE1 4.21Å; F414-F443 AromaticContact CD1-CE2 3.23Å; F414-F443 HydrophobicContact CD1-CE2 3.23Å; F414-F443 HydrophobicContact CD1-CG 4.39Å; F414-F443 AromaticContact CD1-CZ 3.5Å; F414-F443 HydrophobicContact CD1-CZ 3.5Å; F414-F443 VanDerWaalsContact CD1-CZ 3.5Å; F414-F443 HydrophobicContact CE1-CD2 4.2Å; F414-F443 AromaticContact CE1-CE2 3.48Å; F414-F443 HydrophobicContact CE1-CE2 3.48Å; F414-F443 VanDerWaalsContact CE1-CE2 3.48Å; F414-F443 AromaticContact CE1-CZ 3.95Å; F414-F443 HydrophobicContact CE1-CZ 3.95Å; F414-F443 HydrophobicContact CG-CE2 4.26Å; F414-F443 HydrophobicContact CG-CZ 4.12Å; F414-L446 HydrophobicContact CD1-CD2 4.45Å; F414-L446 HydrophobicContact CE1-CD2 4.14Å; F414-G447 VanDerWaalsContact CB-CA 3.42Å; F414-F450 HydrophobicContact CE2-CD1 4.35Å |
| 415 | I | 96 | Very high | 92.8 | Very high | 22 Ų | 22 | 19.9 Ų | 19.9 | 11% | 0.113 | 9% | 0.093 | C | C | . | . | I | π-helix | trans | -69.2 | -55.5 | -164.8 | -59.3 | 174.3 | 0 | 0 | 0 | 111.5 | P410 I419 V448 M451 | P410-I415 PolarHBondContact O-N 3.38Å; P410-I415 VanDerWaalsContact O-N 3.09Å; I415-I419 HydrophobicContact CG2-CD1 3.52Å; I415-I419 HydrophobicContact CG2-CG1 4.39Å; I415-I419 WeakPolarHBondContact O-CB 3.4Å; I415-I419 WeakPolarHBondContact O-CG1 3.45Å; I415-I419 PolarHBondContact O-N 2.92Å; I415-V448 HydrophobicContact CD1-CG2 3.95Å; I415-V448 HydrophobicContact CG1-CG2 4.13Å; I415-M451 HydrophobicContact CD1-CE 3.84Å; I415-M451 HydrophobicContact CD1-SD 4.16Å |
| 416 | L | 94.9 | Very high | 92 | Very high | 16 Ų | 16 | 22.6 Ų | 22.6 | 8% | 0.084 | 11% | 0.111 | C | C | . | . | H | α-helix | trans | -64.5 | -48.6 | -174.6 | -67.9 | 172.4 | 0 | 0 | 0 | 112.7 | Y111 V127 V130 S411 L412 S418 I419 F420 | Y111-L416 HydrophobicContact CE1-CB 4.3Å; Y111-L416 HydrophobicContact CE1-CD1 4.1Å; V127-L416 HydrophobicContact CG2-CD1 4.31Å; V127-L416 HydrophobicContact CG2-CD2 3.91Å; V130-L416 HydrophobicContact CB-CD1 4.35Å; V130-L416 HydrophobicContact CG1-CD1 4.11Å; S411-L416 WeakPolarHBondContact O-CB 3.23Å; S411-L416 VanDerWaalsContact O-CG 3.26Å; S411-L416 WeakPolarHBondContact O-CG 3.37Å; S411-L416 PolarHBondContact O-N 3.5Å; L412-L416 HydrophobicContact CD2-CD1 4.07Å; L416-S418 PolarHBondContact O-N 3.25Å; L416-I419 PolarHBondContact O-N 3.32Å; L416-F420 HydrophobicContact CB-CE2 4.16Å; L416-F420 HydrophobicContact CB-CZ 4.22Å; L416-F420 HydrophobicContact CD2-CE1 4.36Å; L416-F420 HydrophobicContact CD2-CZ 4.15Å; L416-F420 WeakPolarHBondContact O-CB 3.17Å; L416-F420 VanDerWaalsContact O-CD2 3.31Å; L416-F420 WeakPolarHBondContact O-CD2 3.42Å; L416-F420 WeakPolarHBondContact O-CG 3.39Å; L416-F420 PolarHBondContact O-N 2.88Å |
| 417 | P | 94.1 | Very high | 90.8 | Very high | 0 Ų | 0 | 24.7 Ų | 24.7 | 0% | 0 | 13% | 0.125 | C | C | . | . | H | α-helix | trans | -61 | -42.3 | 178.6 | -25.4 | 38.3 | 0 | 0 | 0 | 112.9 | S95 L98 L412 Y421 | S95-P417 WeakPolarHBondContact OG-CG 3.49Å; L98-P417 HydrophobicContact CB-CB 4.3Å; L412-P417 WeakPolarHBondContact O-CD 3.49Å; L412-P417 WeakPolarHBondContact O-CG 3.36Å; P417-Y421 WeakPolarHBondContact O-CB 3.34Å; P417-Y421 PolarHBondContact O-N 3.28Å |
| 418 | S | 93.9 | Very high | 89.1 | Confident | 1 Ų | 1 | 32.5 Ų | 32.5 | 1% | 0.007 | 16% | 0.16 | C | C | . | . | H | α-helix | trans | -59.7 | -50.6 | 174.9 | -79.8 | 0 | 0 | 0 | 0 | 112.6 | F414 L416 F420 Y421 L422 A440 F443 G444 | F414-S418 VanDerWaalsContact O-CB 3.23Å; F414-S418 WeakPolarHBondContact O-CB 3.4Å; F414-S418 PolarHBondContact O-N 3.31Å; F414-S418 PolarHBondContact O-OG 3.34Å; F414-S418 VanDerWaalsContact O-OG 3.1Å; L416-S418 PolarHBondContact O-N 3.25Å; S418-F420 VanDerWaalsContact C-N 3.33Å; S418-F420 PolarHBondContact O-N 3.37Å; S418-Y421 PolarHBondContact O-N 2.68Å; S418-L422 WeakPolarHBondContact O-CG 3.48Å; S418-L422 PolarHBondContact O-N 3.18Å; S418-A440 WeakPolarHBondContact CB-O 3.36Å; S418-A440 PolarHBondContact OG-O 2.96Å; S418-F443 VanDerWaalsContact OG-CD1 3.23Å; S418-F443 WeakPolarHBondContact OG-CD1 3.4Å; S418-G444 WeakPolarHBondContact OG-CA 3.18Å; S418-G444 PolarHBondContact OG-N 2.97Å; S418-G444 VanDerWaalsContact OG-N 3.08Å |
| 419 | I | 93.6 | Very high | 87.7 | Confident | 62 Ų | 62 | 36.8 Ų | 36.8 | 32% | 0.318 | 19% | 0.186 | S | C | . | . | H | α-helix | trans | -67.4 | -39.1 | -175.9 | -69 | 177.6 | 0 | 0 | 0 | 110.4 | F119 I415 L416 L422 R423 | F119-I419 HydrophobicContact CE1-CG2 4.41Å; F119-I419 HydrophobicContact CE2-CG2 3.29Å; F119-I419 HydrophobicContact CZ-CG2 3.13Å; I415-I419 HydrophobicContact CG2-CD1 3.52Å; I415-I419 HydrophobicContact CG2-CG1 4.39Å; I415-I419 WeakPolarHBondContact O-CB 3.4Å; I415-I419 WeakPolarHBondContact O-CG1 3.45Å; I415-I419 PolarHBondContact O-N 2.92Å; L416-I419 PolarHBondContact O-N 3.32Å; I419-L422 PolarHBondContact O-N 3.06Å; I419-R423 WeakPolarHBondContact O-CB 3.48Å; I419-R423 WeakPolarHBondContact O-CG 3.19Å; I419-R423 PolarHBondContact O-N 3.15Å; I419-R423 VanDerWaalsContact O-N 3.09Å |
| 420 | F | 92.8 | Very high | 86.7 | Confident | 0 Ų | 0 | 38.9 Ų | 38.9 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -61 | -45.6 | 173.5 | -66.4 | -17.3 | 0 | 0 | 0 | 111.5 | L99 Y111 L114 A118 V127 L416 S418 L422 R423 I424 | L99-F420 HydrophobicContact CD1-CD2 4.44Å; Y111-F420 HydrophobicContact CD1-CE2 4.02Å; Y111-F420 AromaticContact CE1-CE2 3.51Å; Y111-F420 HydrophobicContact CE1-CE2 3.51Å; Y111-F420 HydrophobicContact CE1-CZ 4.14Å; L114-F420 HydrophobicContact CB-CE2 4.29Å; L114-F420 HydrophobicContact CD2-CB 4.4Å; L114-F420 HydrophobicContact CD2-CD2 3.43Å; L114-F420 VanDerWaalsContact CD2-CD2 3.43Å; L114-F420 HydrophobicContact CD2-CE2 3.88Å; L114-F420 HydrophobicContact CD2-CG 4.13Å; L114-F420 HydrophobicContact CG-CD2 3.88Å; L114-F420 HydrophobicContact CG-CE2 4.16Å; L114-F420 HydrophobicContact CG-CG 4.25Å; A118-F420 HydrophobicContact CB-CD1 3.86Å; A118-F420 HydrophobicContact CB-CE1 4.25Å; V127-F420 HydrophobicContact CG2-CE1 4.21Å; V127-F420 HydrophobicContact CG2-CZ 3.61Å; L416-F420 HydrophobicContact CB-CE2 4.16Å; L416-F420 HydrophobicContact CB-CZ 4.22Å; L416-F420 HydrophobicContact CD2-CE1 4.36Å; L416-F420 HydrophobicContact CD2-CZ 4.15Å; L416-F420 WeakPolarHBondContact O-CB 3.17Å; L416-F420 VanDerWaalsContact O-CD2 3.31Å; L416-F420 WeakPolarHBondContact O-CD2 3.42Å; L416-F420 WeakPolarHBondContact O-CG 3.39Å; L416-F420 PolarHBondContact O-N 2.88Å; S418-F420 VanDerWaalsContact C-N 3.33Å; S418-F420 PolarHBondContact O-N 3.37Å; F420-L422 PolarHBondContact O-N 3.13Å; F420-R423 PolarHBondContact O-N 3.47Å; F420-I424 HydrophobicContact CB-CD1 4.08Å; F420-I424 WeakPolarHBondContact O-CB 3.35Å; F420-I424 VanDerWaalsContact O-CG1 3.28Å; F420-I424 WeakPolarHBondContact O-CG1 3.37Å; F420-I424 PolarHBondContact O-N 3.33Å |
| 421 | Y | 90.9 | Very high | 85.6 | Confident | 12 Ų | 12 | 42.8 Ų | 42.8 | 5% | 0.047 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -58.7 | -49.2 | 178.1 | -169.9 | -90.1 | 0 | 0 | 0 | 111.7 | L98 T101 C102 P417 S418 R423 V425 E430 P436 K437 A440 | L98-Y421 HydrophobicContact CB-CD2 4.35Å; L98-Y421 HydrophobicContact CD2-CD1 4.35Å; L98-Y421 HydrophobicContact CD2-CD2 3.49Å; L98-Y421 VanDerWaalsContact CD2-CD2 3.49Å; L98-Y421 HydrophobicContact CD2-CE2 3.79Å; L98-Y421 HydrophobicContact CD2-CG 3.79Å; T101-Y421 HydrophobicContact CG2-CE2 4.03Å; C102-Y421 WeakPolarHBondContact SG-CA 3.46Å; C102-Y421 PolarHBondContact SG-N 2.97Å; P417-Y421 WeakPolarHBondContact O-CB 3.34Å; P417-Y421 PolarHBondContact O-N 3.28Å; S418-Y421 PolarHBondContact O-N 2.68Å; Y421-R423 VanDerWaalsContact C-N 3.27Å; Y421-R423 PolarHBondContact O-N 3.49Å; Y421-V425 HydrophobicContact CD1-CG2 4.26Å; Y421-V425 HydrophobicContact CD2-CG2 3.74Å; Y421-V425 HydrophobicContact CE1-CG2 4.21Å; Y421-V425 HydrophobicContact CE2-CG2 3.72Å; Y421-V425 HydrophobicContact CG-CG2 4.02Å; Y421-V425 VanDerWaalsContact O-CB 3.29Å; Y421-V425 WeakPolarHBondContact O-CB 3.36Å; Y421-V425 VanDerWaalsContact O-CG2 3.29Å; Y421-V425 WeakPolarHBondContact O-CG2 3.36Å; Y421-V425 PolarHBondContact O-N 3.49Å; Y421-V425 VanDerWaalsContact O-N 3.12Å; Y421-E430 VanDerWaalsContact OH-CD 3.24Å; Y421-E430 PolarHBondContact OH-OE1 3.32Å; Y421-E430 VanDerWaalsContact OH-OE1 3.13Å; Y421-E430 PolarHBondContact OH-OE2 2.97Å; Y421-P436 HydrophobicContact CE1-CB 4.4Å; Y421-K437 HydrophobicContact CE1-CG 4.13Å; Y421-A440 HydrophobicContact CD1-CB 3.77Å; Y421-A440 HydrophobicContact CE1-CB 4.48Å; Y421-A440 HydrophobicContact CG-CB 4.36Å |
| 422 | L | 89.7 | Confident | 84.1 | Confident | 42 Ų | 42 | 48.9 Ų | 48.9 | 22% | 0.22 | 25% | 0.245 | C | C | . | . | H | α-helix | trans | -62.9 | -30.8 | -179.4 | -69.9 | 172.4 | 0 | 0 | 0 | 113.7 | S418 I419 F420 K437 A440 L441 | S418-L422 WeakPolarHBondContact O-CG 3.48Å; S418-L422 PolarHBondContact O-N 3.18Å; I419-L422 PolarHBondContact O-N 3.06Å; F420-L422 PolarHBondContact O-N 3.13Å; L422-K437 HydrophobicContact CD2-CB 4Å; L422-K437 HydrophobicContact CD2-CG 4.21Å; L422-K437 WeakPolarHBondContact CD2-O 3.43Å; L422-A440 HydrophobicContact CD2-CB 4.25Å; L422-A440 HydrophobicContact CG-CB 4.28Å; L422-L441 HydrophobicContact CD1-CB 4.18Å; L422-L441 HydrophobicContact CD1-CD1 4.06Å |
| 423 | R | 88.8 | Confident | 83 | Confident | 180 Ų | 180 | 56.1 Ų | 56.1 | 68% | 0.679 | 28% | 0.283 | S | S | * | . | H | α-helix | trans | -93.3 | -35.2 | -177.5 | -75.1 | -67.1 | -172.5 | 173.1 | -0.2 | 114.3 | F119 I419 F420 Y421 | F119-R423 HydrophobicContact CE1-CG 4.24Å; F119-R423 HydrophobicContact CZ-CG 3.82Å; I419-R423 WeakPolarHBondContact O-CB 3.48Å; I419-R423 WeakPolarHBondContact O-CG 3.19Å; I419-R423 PolarHBondContact O-N 3.15Å; I419-R423 VanDerWaalsContact O-N 3.09Å; F420-R423 PolarHBondContact O-N 3.47Å; Y421-R423 VanDerWaalsContact C-N 3.27Å; Y421-R423 PolarHBondContact O-N 3.49Å |
| 424 | I | 87.2 | Confident | 82.3 | Confident | 19 Ų | 19 | 57.1 Ų | 57.1 | 10% | 0.097 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -88 | -37.8 | -172.9 | -65.9 | 176.7 | 0 | 0 | 0 | 111.1 | C102 I105 V106 L114 A118 F420 P426 | C102-I424 HydrophobicContact CB-CD1 4.19Å; I105-I424 HydrophobicContact CG2-CG2 4.38Å; V106-I424 HydrophobicContact CG2-CD1 4.29Å; V106-I424 HydrophobicContact CG2-CG2 3.29Å; L114-I424 HydrophobicContact CD1-CD1 3.39Å; L114-I424 HydrophobicContact CG-CD1 3.75Å; A118-I424 HydrophobicContact CB-CD1 4.26Å; A118-I424 HydrophobicContact CB-CG1 4.21Å; F420-I424 HydrophobicContact CB-CD1 4.08Å; F420-I424 WeakPolarHBondContact O-CB 3.35Å; F420-I424 VanDerWaalsContact O-CG1 3.28Å; F420-I424 WeakPolarHBondContact O-CG1 3.37Å; F420-I424 PolarHBondContact O-N 3.33Å; I424-P426 WeakPolarHBondContact O-CD 3.42Å |
| 425 | V | 83 | Confident | 81.8 | Confident | 7 Ų | 7 | 65.3 Ų | 65.3 | 4% | 0.042 | 32% | 0.321 | C | S | . | . | S | Bend | trans | -72.6 | 111.9 | -179.1 | -178.5 | 0 | 0 | 0 | 0 | 109.2 | I105 Y421 S427 E430 K437 | I105-V425 HydrophobicContact CD1-CG2 3.82Å; Y421-V425 HydrophobicContact CD1-CG2 4.26Å; Y421-V425 HydrophobicContact CD2-CG2 3.74Å; Y421-V425 HydrophobicContact CE1-CG2 4.21Å; Y421-V425 HydrophobicContact CE2-CG2 3.72Å; Y421-V425 HydrophobicContact CG-CG2 4.02Å; Y421-V425 VanDerWaalsContact O-CB 3.29Å; Y421-V425 WeakPolarHBondContact O-CB 3.36Å; Y421-V425 VanDerWaalsContact O-CG2 3.29Å; Y421-V425 WeakPolarHBondContact O-CG2 3.36Å; Y421-V425 PolarHBondContact O-N 3.49Å; Y421-V425 VanDerWaalsContact O-N 3.12Å; V425-S427 PolarHBondContact O-N 2.85Å; V425-E430 HydrophobicContact CG1-CB 4.27Å; V425-E430 HydrophobicContact CG1-CG 4.27Å; V425-K437 PolarHBondContact O-NZ 2.71Å |
| 426 | P | 74.8 | Confident | 81.2 | Confident | 57 Ų | 57 | 66.2 Ų | 66.2 | 37% | 0.37 | 33% | 0.328 | S | S | . | . | trans | -59.8 | 140.8 | -174.8 | -19.9 | 31.5 | 0 | 0 | 0 | 111.2 | I424 E428 V429 E430 | I424-P426 WeakPolarHBondContact O-CD 3.42Å; P426-E428 PolarHBondContact O-N 3.22Å; P426-V429 HydrophobicContact CB-CG2 4.3Å; P426-V429 HydrophobicContact CG-CG2 4.37Å; P426-V429 PolarHBondContact O-N 2.91Å; P426-V429 VanDerWaalsContact O-N 3.09Å; P426-E430 PolarHBondContact O-N 2.91Å | ||
| 427 | S | 66.3 | Low | 80.8 | Confident | 44 Ų | 44 | 65.5 Ų | 65.5 | 31% | 0.308 | 32% | 0.324 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -69.8 | -12.3 | 178.1 | -61.1 | 0 | 0 | 0 | 0 | 114.1 | V425 E430 F432 K437 | V425-S427 PolarHBondContact O-N 2.85Å; S427-E430 VanDerWaalsContact CA-O 3.3Å; S427-E430 WeakPolarHBondContact CA-O 3.4Å; S427-E430 CarbonylContact O-C 3.45Å; S427-F432 WeakPolarHBondContact OG-CD2 3.25Å; S427-F432 WeakPolarHBondContact OG-CE1 3.25Å; S427-F432 WeakPolarHBondContact OG-CE2 3.4Å; S427-F432 WeakPolarHBondContact OG-CZ 3.38Å; S427-K437 PolarHBondContact OG-NZ 2.97Å |
| 428 | E | 59.5 | Low | 80.5 | Confident | 192 Ų | 192 | 69 Ų | 69 | 90% | 0.897 | 34% | 0.342 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -72.9 | -27.8 | 171.4 | -60.9 | 177.8 | -172.7 | 0 | 0 | 112.4 | P426 | P426-E428 PolarHBondContact O-N 3.22Š|
| 429 | V | 65.7 | Low | 80.4 | Confident | 90 Ų | 90 | 72.7 Ų | 72.7 | 55% | 0.545 | 36% | 0.359 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.2 | -40 | 177.4 | -176.3 | 0 | 0 | 0 | 0 | 110.7 | P426 | P426-V429 HydrophobicContact CB-CG2 4.3Å; P426-V429 HydrophobicContact CG-CG2 4.37Å; P426-V429 PolarHBondContact O-N 2.91Å; P426-V429 VanDerWaalsContact O-N 3.09Å |
| 430 | E | 71.9 | Confident | 80.2 | Confident | 45 Ų | 45 | 69.8 Ų | 69.8 | 21% | 0.21 | 34% | 0.344 | C | S | . | . | S | Bend | trans | -134.3 | 112.7 | 176.1 | -69 | -171 | 168.6 | 0 | 0 | 110.5 | Y421 V425 P426 S427 K437 | Y421-E430 VanDerWaalsContact OH-CD 3.24Å; Y421-E430 PolarHBondContact OH-OE1 3.32Å; Y421-E430 VanDerWaalsContact OH-OE1 3.13Å; Y421-E430 PolarHBondContact OH-OE2 2.97Å; V425-E430 HydrophobicContact CG1-CB 4.27Å; V425-E430 HydrophobicContact CG1-CG 4.27Å; P426-E430 PolarHBondContact O-N 2.91Å; S427-E430 VanDerWaalsContact CA-O 3.3Å; S427-E430 WeakPolarHBondContact CA-O 3.4Å; S427-E430 CarbonylContact O-C 3.45Å; E430-K437 HydrophobicContact CB-CD 4.41Å; E430-K437 VanDerWaalsContact O-CE 3.3Å; E430-K437 WeakPolarHBondContact O-CE 3.39Å; E430-K437 PolarHBondContact O-NZ 2.8Å |
| 431 | P | 71.9 | Confident | 80.2 | Confident | 81 Ų | 81 | 74.5 Ų | 74.5 | 53% | 0.526 | 37% | 0.369 | S | S | . | . | trans | -60.7 | 152.3 | 179 | 23 | -30.9 | 0 | 0 | 0 | 111 | L433 S434 | P431-L433 PolarHBondContact O-N 2.89Å; P431-L433 VanDerWaalsContact O-N 3.1Å; P431-S434 WeakPolarHBondContact O-CB 3.26Å; P431-S434 PolarHBondContact O-N 3.35Å; P431-S434 PolarHBondContact O-OG 2.7Å | ||
| 432 | F | 65.1 | Low | 80.3 | Confident | 147 Ų | 147 | 78 Ų | 78 | 65% | 0.645 | 39% | 0.394 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.1 | -27.7 | -176.6 | -77.5 | -74 | 0 | 0 | 0 | 114.1 | S427 S434 K437 | S427-F432 WeakPolarHBondContact OG-CD2 3.25Å; S427-F432 WeakPolarHBondContact OG-CE1 3.25Å; S427-F432 WeakPolarHBondContact OG-CE2 3.4Å; S427-F432 WeakPolarHBondContact OG-CZ 3.38Å; F432-S434 VanDerWaalsContact C-N 3.31Å; F432-K437 HydrophobicContact CD1-CD 4.43Å |
| 433 | L | 72.1 | Confident | 80.6 | Confident | 152 Ų | 152 | 76.5 Ų | 76.5 | 80% | 0.796 | 39% | 0.386 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -90.7 | 11 | 177.4 | -149.2 | 70.7 | 0 | 0 | 0 | 113.3 | P431 | P431-L433 PolarHBondContact O-N 2.89Å; P431-L433 VanDerWaalsContact O-N 3.1Å |
| 434 | S | 81.4 | Confident | 80.8 | Confident | 21 Ų | 21 | 68.4 Ų | 68.4 | 15% | 0.147 | 36% | 0.359 | C | S | . | . | S | Bend | trans | -69.5 | 146.4 | 174.6 | 62.5 | 0 | 0 | 0 | 0 | 111.1 | P431 F432 P436 K437 I438 | P431-S434 WeakPolarHBondContact O-CB 3.26Å; P431-S434 PolarHBondContact O-N 3.35Å; P431-S434 PolarHBondContact O-OG 2.7Å; F432-S434 VanDerWaalsContact C-N 3.31Å; S434-P436 VanDerWaalsContact C-CD 3.43Å; S434-P436 VanDerWaalsContact C-N 3.34Å; S434-K437 PolarHBondContact O-N 2.63Å; S434-K437 VanDerWaalsContact O-N 3.14Å; S434-I438 WeakPolarHBondContact O-CG1 3.17Å; S434-I438 PolarHBondContact O-N 2.74Å |
| 435 | W | 84.3 | Confident | 81.2 | Confident | 182 Ų | 182 | 71.1 Ų | 71.1 | 69% | 0.689 | 38% | 0.376 | S | S | * | . | H | α-helix | trans | -52.1 | -42.9 | 178.9 | -171.8 | -104 | 0 | 0 | 0 | 113.8 | K437 I438 Q439 | W435-K437 PolarHBondContact O-N 2.96Å; W435-I438 PolarHBondContact O-N 3.35Å; W435-Q439 VanDerWaalsContact NE1-CD 3.32Å; W435-Q439 VanDerWaalsContact O-CG 3.32Å; W435-Q439 WeakPolarHBondContact O-CG 3.25Å; W435-Q439 PolarHBondContact O-N 3.08Å |
| 436 | P | 84.4 | Confident | 81.8 | Confident | 40 Ų | 40 | 74.6 Ų | 74.6 | 26% | 0.26 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -63.6 | -38.2 | 178 | -22.6 | 35.3 | 0 | 0 | 0 | 113.8 | Y421 S434 Q439 A440 | Y421-P436 HydrophobicContact CE1-CB 4.4Å; S434-P436 VanDerWaalsContact C-CD 3.43Å; S434-P436 VanDerWaalsContact C-N 3.34Å; P436-Q439 PolarHBondContact O-N 3.02Å; P436-A440 WeakPolarHBondContact O-CB 3.16Å; P436-A440 PolarHBondContact O-N 3.37Å |
| 437 | K | 85.6 | Confident | 82.7 | Confident | 2 Ų | 2 | 71.9 Ų | 71.9 | 1% | 0.009 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -71.3 | -37 | 177.3 | -74.9 | -171.4 | 170.2 | 176.3 | 0 | 112 | Y421 L422 V425 S427 E430 F432 S434 W435 A440 L441 | Y421-K437 HydrophobicContact CE1-CG 4.13Å; L422-K437 HydrophobicContact CD2-CB 4Å; L422-K437 HydrophobicContact CD2-CG 4.21Å; L422-K437 WeakPolarHBondContact CD2-O 3.43Å; V425-K437 PolarHBondContact O-NZ 2.71Å; S427-K437 PolarHBondContact OG-NZ 2.97Å; E430-K437 HydrophobicContact CB-CD 4.41Å; E430-K437 VanDerWaalsContact O-CE 3.3Å; E430-K437 WeakPolarHBondContact O-CE 3.39Å; E430-K437 PolarHBondContact O-NZ 2.8Å; F432-K437 HydrophobicContact CD1-CD 4.43Å; S434-K437 PolarHBondContact O-N 2.63Å; S434-K437 VanDerWaalsContact O-N 3.14Å; W435-K437 PolarHBondContact O-N 2.96Å; K437-A440 PolarHBondContact O-N 3.47Å; K437-L441 WeakPolarHBondContact O-CB 3.31Å; K437-L441 PolarHBondContact O-N 3.07Å |
| 438 | I | 88.8 | Confident | 84.1 | Confident | 72 Ų | 72 | 73.4 Ų | 73.4 | 37% | 0.369 | 38% | 0.383 | S | S | . | . | H | α-helix | trans | -64 | -43.6 | 173.1 | -64.7 | 170.3 | 0 | 0 | 0 | 110.4 | S434 W435 L441 C442 | S434-I438 WeakPolarHBondContact O-CG1 3.17Å; S434-I438 PolarHBondContact O-N 2.74Å; W435-I438 PolarHBondContact O-N 3.35Å; I438-L441 PolarHBondContact O-N 3.47Å; I438-C442 WeakPolarHBondContact O-CB 3.11Å; I438-C442 PolarHBondContact O-N 3.31Å |
| 439 | Q | 90.3 | Very high | 85.7 | Confident | 80 Ų | 80 | 68.7 Ų | 68.7 | 37% | 0.374 | 36% | 0.364 | S | S | . | . | H | α-helix | trans | -60 | -47.3 | 174.6 | -73.7 | -179.1 | -35.6 | 0 | 0 | 111.7 | W435 P436 L441 C442 F443 | W435-Q439 VanDerWaalsContact NE1-CD 3.32Å; W435-Q439 VanDerWaalsContact O-CG 3.32Å; W435-Q439 WeakPolarHBondContact O-CG 3.25Å; W435-Q439 PolarHBondContact O-N 3.08Å; P436-Q439 PolarHBondContact O-N 3.02Å; Q439-L441 VanDerWaalsContact C-N 3.32Å; Q439-L441 PolarHBondContact O-N 3.4Å; Q439-C442 PolarHBondContact O-N 3.45Å; Q439-F443 VanDerWaalsContact O-CB 3.23Å; Q439-F443 WeakPolarHBondContact O-CB 3.42Å; Q439-F443 PolarHBondContact O-N 3.14Å |
| 440 | A | 90.3 | Very high | 87 | Confident | 0 Ų | 0 | 65.9 Ų | 65.9 | 0% | 0 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -61.3 | -39.6 | 177.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | S418 Y421 L422 P436 K437 F443 G444 | S418-A440 WeakPolarHBondContact CB-O 3.36Å; S418-A440 PolarHBondContact OG-O 2.96Å; Y421-A440 HydrophobicContact CD1-CB 3.77Å; Y421-A440 HydrophobicContact CE1-CB 4.48Å; Y421-A440 HydrophobicContact CG-CB 4.36Å; L422-A440 HydrophobicContact CD2-CB 4.25Å; L422-A440 HydrophobicContact CG-CB 4.28Å; P436-A440 WeakPolarHBondContact O-CB 3.16Å; P436-A440 PolarHBondContact O-N 3.37Å; K437-A440 PolarHBondContact O-N 3.47Å; A440-F443 PolarHBondContact O-N 3.24Å; A440-G444 PolarHBondContact O-N 3.46Å |
| 441 | L | 93.1 | Very high | 88.1 | Confident | 99 Ų | 99 | 66.2 Ų | 66.2 | 52% | 0.518 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -65.1 | -49.2 | 175.7 | -179.4 | 63.7 | 0 | 0 | 0 | 111.7 | L422 K437 I438 Q439 F443 G444 V445 | L422-L441 HydrophobicContact CD1-CB 4.18Å; L422-L441 HydrophobicContact CD1-CD1 4.06Å; K437-L441 WeakPolarHBondContact O-CB 3.31Å; K437-L441 PolarHBondContact O-N 3.07Å; I438-L441 PolarHBondContact O-N 3.47Å; Q439-L441 VanDerWaalsContact C-N 3.32Å; Q439-L441 PolarHBondContact O-N 3.4Å; L441-F443 VanDerWaalsContact C-N 3.27Å; L441-F443 PolarHBondContact O-N 3.43Å; L441-G444 PolarHBondContact O-N 3.11Å; L441-G444 VanDerWaalsContact O-N 3.14Å; L441-V445 HydrophobicContact CD1-CG2 4.5Å; L441-V445 WeakPolarHBondContact O-CG2 3.25Å; L441-V445 PolarHBondContact O-N 2.96Å |
| 442 | C | 93.3 | Very high | 89.1 | Confident | 85 Ų | 85 | 65.1 Ų | 65.1 | 57% | 0.574 | 35% | 0.345 | S | S | * | . | H | α-helix | trans | -57.7 | -42.9 | 176.4 | -174.7 | 0 | 0 | 0 | 0 | 111.1 | I438 Q439 G444 V445 L446 | I438-C442 WeakPolarHBondContact O-CB 3.11Å; I438-C442 PolarHBondContact O-N 3.31Å; Q439-C442 PolarHBondContact O-N 3.45Å; C442-G444 VanDerWaalsContact C-N 3.34Å; C442-G444 PolarHBondContact O-N 3.26Å; C442-V445 PolarHBondContact O-N 2.79Å; C442-L446 WeakPolarHBondContact O-CB 3.43Å; C442-L446 PolarHBondContact O-N 2.96Å |
| 443 | F | 94.3 | Very high | 90.4 | Very high | 11 Ų | 11 | 62.6 Ų | 62.6 | 5% | 0.048 | 34% | 0.337 | C | S | . | . | H | α-helix | trans | -61.2 | -40.6 | 176.6 | -170 | -120.5 | 0 | 0 | 0 | 112.4 | L91 Y94 L98 I413 F414 S418 Q439 A440 L441 G447 | L91-F443 HydrophobicContact CB-CE2 3.94Å; L91-F443 HydrophobicContact CB-CZ 4.41Å; L91-F443 HydrophobicContact CD2-CD2 4Å; L91-F443 HydrophobicContact CD2-CE2 3.57Å; L91-F443 HydrophobicContact CG-CE2 4.28Å; L91-F443 WeakPolarHBondContact O-CZ 3.48Å; Y94-F443 HydrophobicContact CD1-CD1 4.17Å; Y94-F443 HydrophobicContact CD1-CD2 4.27Å; Y94-F443 HydrophobicContact CD1-CE1 4.2Å; Y94-F443 HydrophobicContact CD1-CE2 4.27Å; Y94-F443 HydrophobicContact CD1-CG 4.24Å; Y94-F443 HydrophobicContact CD1-CZ 4.26Å; Y94-F443 HydrophobicContact CE1-CB 4.36Å; Y94-F443 HydrophobicContact CE1-CD1 4.09Å; Y94-F443 HydrophobicContact CE1-CD2 4.44Å; Y94-F443 HydrophobicContact CE1-CG 4.06Å; L98-F443 HydrophobicContact CD1-CD1 4.02Å; L98-F443 HydrophobicContact CD1-CE1 4.39Å; I413-F443 HydrophobicContact CG2-CZ 4.42Å; I413-F443 WeakPolarHBondContact O-CE1 3.47Å; I413-F443 WeakPolarHBondContact O-CZ 3.46Å; F414-F443 HydrophobicContact CB-CE1 4.45Å; F414-F443 HydrophobicContact CB-CZ 4.46Å; F414-F443 AromaticContact CD1-CD2 3.73Å; F414-F443 HydrophobicContact CD1-CD2 3.73Å; F414-F443 HydrophobicContact CD1-CE1 4.21Å; F414-F443 AromaticContact CD1-CE2 3.23Å; F414-F443 HydrophobicContact CD1-CE2 3.23Å; F414-F443 HydrophobicContact CD1-CG 4.39Å; F414-F443 AromaticContact CD1-CZ 3.5Å; F414-F443 HydrophobicContact CD1-CZ 3.5Å; F414-F443 VanDerWaalsContact CD1-CZ 3.5Å; F414-F443 HydrophobicContact CE1-CD2 4.2Å; F414-F443 AromaticContact CE1-CE2 3.48Å; F414-F443 HydrophobicContact CE1-CE2 3.48Å; F414-F443 VanDerWaalsContact CE1-CE2 3.48Å; F414-F443 AromaticContact CE1-CZ 3.95Å; F414-F443 HydrophobicContact CE1-CZ 3.95Å; F414-F443 HydrophobicContact CG-CE2 4.26Å; F414-F443 HydrophobicContact CG-CZ 4.12Å; S418-F443 VanDerWaalsContact OG-CD1 3.23Å; S418-F443 WeakPolarHBondContact OG-CD1 3.4Å; Q439-F443 VanDerWaalsContact O-CB 3.23Å; Q439-F443 WeakPolarHBondContact O-CB 3.42Å; Q439-F443 PolarHBondContact O-N 3.14Å; A440-F443 PolarHBondContact O-N 3.24Å; L441-F443 VanDerWaalsContact C-N 3.27Å; L441-F443 PolarHBondContact O-N 3.43Å; F443-G447 PolarHBondContact O-N 3.45Å; F443-G447 VanDerWaalsContact O-N 3.12Å |
| 444 | G | 94.4 | Very high | 91.3 | Very high | 10 Ų | 10 | 55.7 Ų | 55.7 | 10% | 0.103 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -68.5 | -42.1 | 176 | 0 | 0 | 0 | 0 | 0 | 112.8 | S418 A440 L441 C442 G447 V448 | S418-G444 WeakPolarHBondContact OG-CA 3.18Å; S418-G444 PolarHBondContact OG-N 2.97Å; S418-G444 VanDerWaalsContact OG-N 3.08Å; A440-G444 PolarHBondContact O-N 3.46Å; L441-G444 PolarHBondContact O-N 3.11Å; L441-G444 VanDerWaalsContact O-N 3.14Å; C442-G444 VanDerWaalsContact C-N 3.34Å; C442-G444 PolarHBondContact O-N 3.26Å; G444-G447 PolarHBondContact O-N 3.5Å; G444-V448 PolarHBondContact O-N 3.41Å |
| 445 | V | 95.3 | Very high | 91.7 | Very high | 76 Ų | 76 | 56.6 Ų | 56.6 | 46% | 0.461 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -63 | -43.6 | 175.9 | 172.9 | 0 | 0 | 0 | 0 | 110.8 | L441 C442 G447 V448 L449 | L441-V445 HydrophobicContact CD1-CG2 4.5Å; L441-V445 WeakPolarHBondContact O-CG2 3.25Å; L441-V445 PolarHBondContact O-N 2.96Å; C442-V445 PolarHBondContact O-N 2.79Å; V445-G447 VanDerWaalsContact C-N 3.25Å; V445-G447 PolarHBondContact O-N 3.49Å; V445-V448 PolarHBondContact O-N 2.85Å; V445-V448 VanDerWaalsContact O-N 3.14Å; V445-L449 HydrophobicContact CG1-CD1 4.07Å; V445-L449 HydrophobicContact CG1-CG 4.35Å; V445-L449 WeakPolarHBondContact O-CG 3.43Å; V445-L449 PolarHBondContact O-N 3.36Å |
| 446 | L | 94.4 | Very high | 91.9 | Very high | 81 Ų | 81 | 49.9 Ų | 49.9 | 42% | 0.424 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -56 | -42.3 | 173.6 | -179.6 | 65.9 | 0 | 0 | 0 | 111.2 | F414 C442 L449 F450 | F414-L446 HydrophobicContact CD1-CD2 4.45Å; F414-L446 HydrophobicContact CE1-CD2 4.14Å; C442-L446 WeakPolarHBondContact O-CB 3.43Å; C442-L446 PolarHBondContact O-N 2.96Å; L446-L449 PolarHBondContact O-N 3.24Å; L446-F450 VanDerWaalsContact O-CB 3.27Å; L446-F450 WeakPolarHBondContact O-CB 3.34Å; L446-F450 PolarHBondContact O-N 2.9Å |
| 447 | G | 94 | Very high | 92.1 | Very high | 0 Ų | 0 | 53.5 Ų | 53.5 | 0% | 0 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -60.7 | -43.7 | 174.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | F414 F443 G444 V445 F450 M451 | F414-G447 VanDerWaalsContact CB-CA 3.42Å; F443-G447 PolarHBondContact O-N 3.45Å; F443-G447 VanDerWaalsContact O-N 3.12Å; G444-G447 PolarHBondContact O-N 3.5Å; V445-G447 VanDerWaalsContact C-N 3.25Å; V445-G447 PolarHBondContact O-N 3.49Å; G447-F450 PolarHBondContact O-N 2.94Å; G447-M451 WeakPolarHBondContact O-CB 3.35Å; G447-M451 PolarHBondContact O-N 3.34Å |
| 448 | V | 95.6 | Very high | 92 | Very high | 75 Ų | 75 | 53.5 Ų | 53.5 | 46% | 0.455 | 30% | 0.304 | S | S | . | . | H | α-helix | trans | -66.1 | -43.1 | 177.3 | 174.6 | 0 | 0 | 0 | 0 | 111.1 | I415 G444 V445 M451 A452 | I415-V448 HydrophobicContact CD1-CG2 3.95Å; I415-V448 HydrophobicContact CG1-CG2 4.13Å; G444-V448 PolarHBondContact O-N 3.41Å; V445-V448 PolarHBondContact O-N 2.85Å; V445-V448 VanDerWaalsContact O-N 3.14Å; V448-M451 PolarHBondContact O-N 3.17Å; V448-A452 WeakPolarHBondContact O-CB 3.33Å; V448-A452 PolarHBondContact O-N 3Å |
| 449 | L | 94.4 | Very high | 91.9 | Very high | 94 Ų | 94 | 55.8 Ų | 55.8 | 49% | 0.492 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -62.1 | -46.7 | 175.2 | -69.6 | 174.1 | 0 | 0 | 0 | 111 | V445 L446 M451 A452 I453 | V445-L449 HydrophobicContact CG1-CD1 4.07Å; V445-L449 HydrophobicContact CG1-CG 4.35Å; V445-L449 WeakPolarHBondContact O-CG 3.43Å; V445-L449 PolarHBondContact O-N 3.36Å; L446-L449 PolarHBondContact O-N 3.24Å; L449-M451 VanDerWaalsContact C-N 3.34Å; L449-M451 PolarHBondContact O-N 2.91Å; L449-A452 PolarHBondContact O-N 3.42Å; L449-I453 HydrophobicContact CB-CD1 4.46Å; L449-I453 VanDerWaalsContact O-CB 3.29Å; L449-I453 WeakPolarHBondContact O-CB 3.31Å; L449-I453 WeakPolarHBondContact O-CD1 3.31Å; L449-I453 WeakPolarHBondContact O-CG1 3.37Å; L449-I453 PolarHBondContact O-N 2.98Å |
| 450 | F | 92.9 | Very high | 91.6 | Very high | 31 Ų | 31 | 54.1 Ų | 54.1 | 14% | 0.136 | 31% | 0.311 | C | S | . | . | H | α-helix | trans | -58.7 | -45 | 177.5 | 176 | -124.1 | 0 | 0 | 0 | 111.9 | V262 A266 P410 F414 L446 G447 S454 | V262-F450 HydrophobicContact CB-CE2 3.83Å; V262-F450 HydrophobicContact CB-CZ 4.32Å; V262-F450 HydrophobicContact CG1-CD2 4.14Å; V262-F450 HydrophobicContact CG1-CE2 3.25Å; V262-F450 HydrophobicContact CG1-CZ 3.7Å; A266-F450 HydrophobicContact CB-CE1 3.79Å; A266-F450 HydrophobicContact CB-CZ 3.9Å; P410-F450 HydrophobicContact CB-CD1 3.69Å; P410-F450 HydrophobicContact CB-CE1 4.19Å; P410-F450 HydrophobicContact CG-CD1 3.65Å; P410-F450 HydrophobicContact CG-CE1 3.72Å; F414-F450 HydrophobicContact CE2-CD1 4.35Å; L446-F450 VanDerWaalsContact O-CB 3.27Å; L446-F450 WeakPolarHBondContact O-CB 3.34Å; L446-F450 PolarHBondContact O-N 2.9Å; G447-F450 PolarHBondContact O-N 2.94Å; F450-S454 WeakPolarHBondContact CD2-OG 3.39Å; F450-S454 WeakPolarHBondContact CE2-OG 3.45Å; F450-S454 VanDerWaalsContact O-CB 3.23Å; F450-S454 WeakPolarHBondContact O-CB 3.34Å; F450-S454 PolarHBondContact O-N 3.46Å; F450-S454 PolarHBondContact O-OG 2.96Å |
| 451 | M | 94.4 | Very high | 91.2 | Very high | 51 Ų | 51 | 54.9 Ų | 54.9 | 25% | 0.251 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -62.7 | -48.5 | 176.1 | -177.5 | 170.8 | 68.8 | 0 | 0 | 112 | S406 P410 I415 G447 V448 L449 L455 | S406-M451 WeakPolarHBondContact O-CG 3.29Å; P410-M451 HydrophobicContact CB-CB 3.94Å; P410-M451 HydrophobicContact CG-CB 4Å; P410-M451 HydrophobicContact CG-CG 4.43Å; I415-M451 HydrophobicContact CD1-CE 3.84Å; I415-M451 HydrophobicContact CD1-SD 4.16Å; G447-M451 WeakPolarHBondContact O-CB 3.35Å; G447-M451 PolarHBondContact O-N 3.34Å; V448-M451 PolarHBondContact O-N 3.17Å; L449-M451 VanDerWaalsContact C-N 3.34Å; L449-M451 PolarHBondContact O-N 2.91Å; M451-L455 HydrophobicContact CG-CD1 3.83Å; M451-L455 VanDerWaalsContact O-CB 3.25Å; M451-L455 WeakPolarHBondContact O-CB 3.09Å; M451-L455 WeakPolarHBondContact O-CG 2.85Å; M451-L455 PolarHBondContact O-N 3.43Å |
| 452 | A | 93.4 | Very high | 90.6 | Very high | 59 Ų | 59 | 55 Ų | 55 | 49% | 0.488 | 31% | 0.309 | S | S | . | . | H | α-helix | trans | -64.7 | -44 | -178.5 | 0 | 0 | 0 | 0 | 0 | 112.3 | V448 L449 G456 | V448-A452 WeakPolarHBondContact O-CB 3.33Å; V448-A452 PolarHBondContact O-N 3Å; L449-A452 PolarHBondContact O-N 3.42Å; A452-G456 PolarHBondContact O-N 3.49Å |
| 453 | I | 91.7 | Very high | 90.1 | Very high | 94 Ų | 94 | 55.1 Ų | 55.1 | 48% | 0.482 | 32% | 0.316 | S | S | . | . | H | α-helix | trans | -64.9 | -50.1 | 178.6 | -68.3 | 167.9 | 0 | 0 | 0 | 110.1 | L449 G456 F457 | L449-I453 HydrophobicContact CB-CD1 4.46Å; L449-I453 VanDerWaalsContact O-CB 3.29Å; L449-I453 WeakPolarHBondContact O-CB 3.31Å; L449-I453 WeakPolarHBondContact O-CD1 3.31Å; L449-I453 WeakPolarHBondContact O-CG1 3.37Å; L449-I453 PolarHBondContact O-N 2.98Å; I453-G456 PolarHBondContact O-N 3.19Å; I453-F457 HydrophobicContact CG2-CD2 3.63Å; I453-F457 HydrophobicContact CG2-CE2 3.5Å; I453-F457 WeakPolarHBondContact O-CD2 2.97Å; I453-F457 PolarHBondContact O-N 3.13Å |
| 454 | S | 90.7 | Very high | 89.4 | Confident | 7 Ų | 7 | 59 Ų | 59 | 5% | 0.049 | 34% | 0.341 | C | S | . | . | H | α-helix | trans | -65 | -44.3 | -176.9 | -55.7 | 0 | 0 | 0 | 0 | 112 | F450 F457 M458 | F450-S454 WeakPolarHBondContact CD2-OG 3.39Å; F450-S454 WeakPolarHBondContact CE2-OG 3.45Å; F450-S454 VanDerWaalsContact O-CB 3.23Å; F450-S454 WeakPolarHBondContact O-CB 3.34Å; F450-S454 PolarHBondContact O-N 3.46Å; F450-S454 PolarHBondContact O-OG 2.96Å; S454-F457 PolarHBondContact O-N 2.01Å; S454-M458 WeakPolarHBondContact O-CG 3.13Å; S454-M458 PolarHBondContact O-N 3.3Å |
| 455 | L | 90.3 | Very high | 87.9 | Confident | 39 Ų | 39 | 59.7 Ų | 59.7 | 20% | 0.204 | 35% | 0.348 | C | S | . | . | H | α-helix | trans | -63.2 | -43.6 | 174.7 | -79.4 | 173.2 | 0 | 0 | 0 | 111.9 | T407 M451 F457 M458 F459 | T407-L455 HydrophobicContact CG2-CD1 4.13Å; T407-L455 HydrophobicContact CG2-CD2 3.64Å; T407-L455 HydrophobicContact CG2-CG 4.22Å; M451-L455 HydrophobicContact CG-CD1 3.83Å; M451-L455 VanDerWaalsContact O-CB 3.25Å; M451-L455 WeakPolarHBondContact O-CB 3.09Å; M451-L455 WeakPolarHBondContact O-CG 2.85Å; M451-L455 PolarHBondContact O-N 3.43Å; L455-F457 VanDerWaalsContact C-N 3.34Å; L455-F457 PolarHBondContact O-N 2.94Å; L455-M458 HydrophobicContact CD2-CE 4.27Å; L455-M458 PolarHBondContact O-N 3.47Å; L455-F459 HydrophobicContact CB-CD2 4.32Å; L455-F459 HydrophobicContact CB-CE2 4.2Å; L455-F459 HydrophobicContact CD2-CE2 3.99Å; L455-F459 WeakPolarHBondContact O-CD2 3.45Å; L455-F459 PolarHBondContact O-N 3.28Å |
| 456 | G | 89.3 | Confident | 86 | Confident | 42 Ų | 42 | 60.2 Ų | 60.2 | 43% | 0.433 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -57.4 | -46.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 112.1 | A452 I453 A460 | A452-G456 PolarHBondContact O-N 3.49Å; I453-G456 PolarHBondContact O-N 3.19Å; G456-A460 WeakPolarHBondContact O-CB 3.25Å; G456-A460 PolarHBondContact O-N 3.25Å |
| 457 | F | 87 | Confident | 83.8 | Confident | 116 Ų | 116 | 58.8 Ų | 58.8 | 51% | 0.509 | 34% | 0.342 | S | S | . | . | H | α-helix | trans | -65.2 | -42 | 176.4 | -80.1 | -62.2 | 0 | 0 | 0 | 113 | I453 S454 L455 A460 N461 | I453-F457 HydrophobicContact CG2-CD2 3.63Å; I453-F457 HydrophobicContact CG2-CE2 3.5Å; I453-F457 WeakPolarHBondContact O-CD2 2.97Å; I453-F457 PolarHBondContact O-N 3.13Å; S454-F457 PolarHBondContact O-N 2.01Å; L455-F457 VanDerWaalsContact C-N 3.34Å; L455-F457 PolarHBondContact O-N 2.94Å; F457-A460 PolarHBondContact O-N 3.14Å; F457-N461 VanDerWaalsContact O-CG 3.3Å; F457-N461 PolarHBondContact O-N 3.11Å |
| 458 | M | 84.3 | Confident | 81.3 | Confident | 1 Ų | 1 | 68.9 Ų | 68.9 | 1% | 0.005 | 38% | 0.38 | C | S | . | . | H | α-helix | trans | -64.5 | -44.7 | 177.7 | -72.5 | -149 | -44.1 | 0 | 0 | 112.8 | Y260 G402 V403 S406 S454 L455 A460 N461 W462 | Y260-M458 HydrophobicContact CD1-CG 4.47Å; Y260-M458 HydrophobicContact CD1-SD 4.14Å; Y260-M458 HydrophobicContact CE1-CG 3.99Å; Y260-M458 HydrophobicContact CE1-SD 3.71Å; G402-M458 VanDerWaalsContact CA-SD 3.52Å; V403-M458 HydrophobicContact CB-CE 4.22Å; V403-M458 HydrophobicContact CG2-CE 3.71Å; S406-M458 WeakPolarHBondContact OG-CE 3.5Å; S454-M458 WeakPolarHBondContact O-CG 3.13Å; S454-M458 PolarHBondContact O-N 3.3Å; L455-M458 HydrophobicContact CD2-CE 4.27Å; L455-M458 PolarHBondContact O-N 3.47Å; M458-A460 VanDerWaalsContact C-N 3.27Å; M458-A460 PolarHBondContact O-N 3.27Å; M458-N461 PolarHBondContact O-N 3.12Å; M458-W462 PolarHBondContact O-N 3.4Å |
| 459 | F | 86.3 | Confident | 78.5 | Confident | 120 Ų | 120 | 72.3 Ų | 72.3 | 53% | 0.526 | 40% | 0.395 | S | S | . | . | H | α-helix | trans | -63.1 | -37.1 | 176.4 | -74.8 | -58 | 0 | 0 | 0 | 111.4 | L455 W462 A463 | L455-F459 HydrophobicContact CB-CD2 4.32Å; L455-F459 HydrophobicContact CB-CE2 4.2Å; L455-F459 HydrophobicContact CD2-CE2 3.99Å; L455-F459 WeakPolarHBondContact O-CD2 3.45Å; L455-F459 PolarHBondContact O-N 3.28Å; F459-W462 AromaticContact CD1-CE3 4Å; F459-W462 HydrophobicContact CD1-CE3 4Å; F459-W462 HydrophobicContact CD1-CZ3 4.24Å; F459-W462 HydrophobicContact CE1-CE3 4.23Å; F459-W462 HydrophobicContact CE1-CZ3 4.01Å; F459-A463 VanDerWaalsContact O-CB 3.28Å; F459-A463 WeakPolarHBondContact O-CB 3.48Å; F459-A463 PolarHBondContact O-N 3.29Å |
| 460 | A | 85.4 | Confident | 75.7 | Confident | 46 Ų | 46 | 72.1 Ų | 72.1 | 38% | 0.38 | 40% | 0.402 | S | S | . | . | H | α-helix | trans | -62.3 | -47.6 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.7 | G456 F457 M458 W462 A463 T464 | G456-A460 WeakPolarHBondContact O-CB 3.25Å; G456-A460 PolarHBondContact O-N 3.25Å; F457-A460 PolarHBondContact O-N 3.14Å; M458-A460 VanDerWaalsContact C-N 3.27Å; M458-A460 PolarHBondContact O-N 3.27Å; A460-W462 VanDerWaalsContact C-N 3.33Å; A460-W462 PolarHBondContact O-N 3.34Å; A460-A463 PolarHBondContact O-N 2.89Å; A460-A463 VanDerWaalsContact O-N 3.15Å; A460-T464 WeakPolarHBondContact O-CG2 3.13Å; A460-T464 PolarHBondContact O-N 3.35Å; A460-T464 PolarHBondContact O-OG1 3.3Å; A460-T464 VanDerWaalsContact O-OG1 3.09Å |
| 461 | N | 80.6 | Confident | 72.8 | Confident | 15 Ų | 15 | 73.4 Ų | 73.4 | 8% | 0.08 | 42% | 0.424 | C | S | . | . | H | α-helix | trans | -62 | -38.2 | 178.7 | -72.9 | -11.1 | 0 | 0 | 0 | 113 | S259 Y260 F457 M458 T464 G465 Q466 | S259-N461 PolarHBondContact OG-ND2 3.24Å; Y260-N461 WeakPolarHBondContact CE2-ND2 3.46Å; F457-N461 VanDerWaalsContact O-CG 3.3Å; F457-N461 PolarHBondContact O-N 3.11Å; M458-N461 PolarHBondContact O-N 3.12Å; N461-T464 PolarHBondContact O-OG1 2.87Å; N461-G465 PolarHBondContact O-N 3.06Å; N461-Q466 PolarHBondContact O-N 3.24Å |
| 462 | W | 81.3 | Confident | 69.5 | Low | 101 Ų | 101 | 82.7 Ų | 82.7 | 38% | 0.383 | 47% | 0.466 | S | S | . | . | H | α-helix | trans | -69 | -38.2 | 174.4 | -71.8 | -11.2 | 0 | 0 | 0 | 112.1 | D399 V403 M458 F459 A460 G465 | D399-W462 PolarHBondContact OD1-NE1 2.53Å; V403-W462 HydrophobicContact CG2-CH2 3.54Å; V403-W462 HydrophobicContact CG2-CZ2 3.76Å; M458-W462 PolarHBondContact O-N 3.4Å; F459-W462 AromaticContact CD1-CE3 4Å; F459-W462 HydrophobicContact CD1-CE3 4Å; F459-W462 HydrophobicContact CD1-CZ3 4.24Å; F459-W462 HydrophobicContact CE1-CE3 4.23Å; F459-W462 HydrophobicContact CE1-CZ3 4.01Å; A460-W462 VanDerWaalsContact C-N 3.33Å; A460-W462 PolarHBondContact O-N 3.34Å; W462-G465 PolarHBondContact O-N 3.05Å |
| 463 | A | 83.3 | Confident | 68.3 | Low | 88 Ų | 88 | 83.9 Ų | 83.9 | 73% | 0.727 | 47% | 0.465 | S | S | * | . | H | α-helix | trans | -70.7 | -35.9 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.9 | F459 A460 G465 | F459-A463 VanDerWaalsContact O-CB 3.28Å; F459-A463 WeakPolarHBondContact O-CB 3.48Å; F459-A463 PolarHBondContact O-N 3.29Å; A460-A463 PolarHBondContact O-N 2.89Å; A460-A463 VanDerWaalsContact O-N 3.15Å; A463-G465 VanDerWaalsContact C-N 3.27Å; A463-G465 PolarHBondContact O-N 3.41Å |
| 464 | T | 78.8 | Confident | 67.1 | Low | 93 Ų | 93 | 83.3 Ų | 83.3 | 57% | 0.571 | 46% | 0.464 | S | S | * | . | H | α-helix | trans | -79.4 | -8.7 | 177.5 | 57.8 | 0 | 0 | 0 | 0 | 113.2 | A460 N461 Q466 | A460-T464 WeakPolarHBondContact O-CG2 3.13Å; A460-T464 PolarHBondContact O-N 3.35Å; A460-T464 PolarHBondContact O-OG1 3.3Å; A460-T464 VanDerWaalsContact O-OG1 3.09Å; N461-T464 PolarHBondContact O-OG1 2.87Å; T464-Q466 PolarHBondContact O-N 3.18Å |
| 465 | G | 63.5 | Low | 65.8 | Low | 25 Ų | 25 | 87.6 Ų | 87.6 | 26% | 0.258 | 49% | 0.487 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 73.2 | 8.7 | 176.9 | 0 | 0 | 0 | 0 | 0 | 114.8 | N461 W462 A463 S467 R468 | N461-G465 PolarHBondContact O-N 3.06Å; W462-G465 PolarHBondContact O-N 3.05Å; A463-G465 VanDerWaalsContact C-N 3.27Å; A463-G465 PolarHBondContact O-N 3.41Å; G465-S467 PolarHBondContact O-N 3.07Å; G465-R468 PolarHBondContact O-N 3.37Å; G465-R468 VanDerWaalsContact O-N 3.08Å |
| 466 | Q | 55.1 | Low | 64.3 | Low | 87 Ų | 87 | 90.4 Ų | 90.4 | 41% | 0.407 | 50% | 0.504 | S | S | . | . | G | 310 helix | trans | -61.8 | -26 | 179.1 | -82.3 | -179.5 | -34.8 | 0 | 0 | 112.9 | N461 T464 R468 L469 | N461-Q466 PolarHBondContact O-N 3.24Å; T464-Q466 PolarHBondContact O-N 3.18Å; Q466-R468 PolarHBondContact O-N 3.44Å; Q466-L469 PolarHBondContact O-N 2.85Å |
| 467 | S | 48.3 | Very low | 62.8 | Low | 50 Ų | 50 | 93.4 Ų | 93.4 | 35% | 0.35 | 51% | 0.509 | S | S | . | . | G | 310 helix | trans | -65.9 | -21.1 | 175.2 | 61.7 | 0 | 0 | 0 | 0 | 114.1 | G465 | G465-S467 PolarHBondContact O-N 3.07Š|
| 468 | R | 40.1 | Very low | 61.1 | Low | 212 Ų | 212 | 91.9 Ų | 91.9 | 80% | 0.8 | 51% | 0.508 | S | S | * | . | G | 310 helix | trans | -81.7 | -15.5 | 177.9 | -69.3 | -172.2 | 177.7 | -173 | -0.3 | 113.8 | G465 Q466 | G465-R468 PolarHBondContact O-N 3.37Å; G465-R468 VanDerWaalsContact O-N 3.08Å; Q466-R468 PolarHBondContact O-N 3.44Å |
| 469 | L | 37 | Very low | 59.5 | Low | 147 Ų | 147 | 98.4 Ų | 98.4 | 77% | 0.77 | 54% | 0.544 | S | S | * | . | S | Bend | trans | -90.8 | -14.1 | -176.4 | -79.6 | 153.9 | 0 | 0 | 0 | 113.6 | Q466 | Q466-L469 PolarHBondContact O-N 2.85Š|
| 470 | S | 36.2 | Very low | 57.4 | Low | 90 Ų | 90 | 96.8 Ų | 96.8 | 63% | 0.629 | 55% | 0.546 | S | S | * | . | S | Bend | trans | -96.1 | 5.3 | -177.9 | -167.3 | 0 | 0 | 0 | 0 | 114.1 | ||
| 471 | G | 31.3 | Very low | 55.1 | Low | 59 Ų | 59 | 101 Ų | 101 | 61% | 0.608 | 56% | 0.56 | S | S | * | * | trans | -121.2 | 24.2 | -172.7 | 0 | 0 | 0 | 0 | 0 | 115 | ||||
| 472 | H | 25.8 | Very low | 52.8 | Low | 245 Ų | 245 | 108.8 Ų | 108.8 | 100% | 1.134 | 60% | 0.603 | S | S | * | * | trans | -116.8 | 0 | 172.4 | -84.7 | -49.6 | 0 | 0 | 0 | 111.4 |
Retrieved 472 of 472 residues in 165.5 ms
(Link to these results)