| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 30.2 | Very low | 25.5 | Very low | 250 Ų | 250 | 169.1 Ų | 169.1 | 100% | 1.232 | 87% | 0.87 | S | S | * | * | 0 | 122.1 | 0 | -103.2 | 168.3 | 166.7 | 0 | 0 | 107.3 | |||||
| 2 | L | 23.5 | Very low | 25.5 | Very low | 162 Ų | 162 | 160.7 Ų | 160.7 | 85% | 0.848 | 86% | 0.856 | S | S | * | * | trans | -65.9 | 159.4 | -178.4 | -84.3 | 135.1 | 0 | 0 | 0 | 112.8 | ||||
| 3 | M | 22.4 | Very low | 25.6 | Very low | 173 Ų | 173 | 163.7 Ų | 163.7 | 85% | 0.852 | 86% | 0.862 | S | S | * | * | trans | 86.4 | 131.4 | 162.7 | -47.2 | -147.2 | 175.5 | 0 | 0 | 115.5 | ||||
| 4 | S | 22.8 | Very low | 26.3 | Very low | 103 Ų | 103 | 157.7 Ų | 157.7 | 72% | 0.72 | 86% | 0.86 | S | S | * | * | cis | -171.1 | 122.1 | -7.3 | 44 | 0 | 0 | 0 | 0 | 105.4 | ||||
| 5 | W | 23 | Very low | 26.1 | Very low | 259 Ų | 259 | 157.2 Ų | 157.2 | 98% | 0.981 | 85% | 0.849 | S | S | * | * | trans | -100 | 124.2 | 168.4 | -80.1 | 8.4 | 0 | 0 | 0 | 107.8 | ||||
| 6 | S | 23.1 | Very low | 26.1 | Very low | 102 Ų | 102 | 154.7 Ų | 154.7 | 71% | 0.713 | 84% | 0.843 | S | S | * | * | trans | -118.7 | 119.7 | 166.4 | 46.9 | 0 | 0 | 0 | 0 | 108.3 | E8 | S6-E8 PolarHBondContact O-N 3.07Š| ||
| 7 | P | 27 | Very low | 26.3 | Very low | 129 Ų | 129 | 156.4 Ų | 156.4 | 84% | 0.838 | 85% | 0.85 | S | S | * | * | trans | -81.6 | 99.5 | 179.5 | 30.8 | -29.1 | 0 | 0 | 0 | 109.8 | ||||
| 8 | E | 28.4 | Very low | 26.5 | Very low | 180 Ų | 180 | 154.8 Ų | 154.8 | 84% | 0.841 | 84% | 0.841 | S | S | * | * | trans | -101.3 | 79.4 | 164.2 | -83.4 | -92.7 | 163.1 | 0 | 0 | 107.3 | S6 | S6-E8 PolarHBondContact O-N 3.07Š| ||
| 9 | E | 27.9 | Very low | 27.2 | Very low | 183 Ų | 183 | 154 Ų | 154 | 86% | 0.855 | 84% | 0.836 | S | S | * | * | trans | -165.2 | 125.3 | 160.5 | -108.6 | 165 | -157 | 0 | 0 | 108.2 | ||||
| 10 | C | 26.1 | Very low | 27.6 | Very low | 127 Ų | 127 | 157 Ų | 157 | 86% | 0.858 | 83% | 0.834 | S | S | * | * | trans | 86.1 | 81.8 | 177.9 | -56 | 0 | 0 | 0 | 0 | 117.9 | ||||
| 11 | K | 26.3 | Very low | 28.4 | Very low | 192 Ų | 192 | 155.4 Ų | 155.4 | 84% | 0.835 | 82% | 0.822 | S | S | * | * | trans | -140.1 | 99.2 | 132.2 | -84.9 | -165.8 | 177.6 | -175.4 | 0 | 110.2 | ||||
| 12 | G | 25.1 | Very low | 28.7 | Very low | 68 Ų | 68 | 146.9 Ų | 146.9 | 70% | 0.701 | 79% | 0.785 | S | S | * | * | trans | -85.2 | 159.4 | 151.8 | 0 | 0 | 0 | 0 | 0 | 109.9 | ||||
| 13 | Q | 27 | Very low | 29.5 | Very low | 200 Ų | 200 | 145 Ų | 145 | 94% | 0.935 | 78% | 0.776 | S | S | * | * | S | Bend | trans | 81.6 | 110.4 | 171.6 | -54.4 | -176.7 | 1.5 | 0 | 0 | 117 | ||
| 14 | G | 35.4 | Very low | 30.9 | Very low | 80 Ų | 80 | 139 Ų | 139 | 83% | 0.825 | 75% | 0.75 | S | S | * | * | trans | 61.1 | 83.2 | 135.5 | 0 | 0 | 0 | 0 | 0 | 117.5 | ||||
| 15 | E | 22.9 | Very low | 32.6 | Very low | 150 Ų | 150 | 134.4 Ų | 134.4 | 70% | 0.701 | 72% | 0.718 | S | S | * | * | trans | -122.6 | 133.9 | 148.8 | -75.3 | -179.3 | -179.1 | 0 | 0 | 107.5 | ||||
| 16 | P | 26.7 | Very low | 34.5 | Very low | 117 Ų | 117 | 125 Ų | 125 | 76% | 0.76 | 68% | 0.683 | S | S | * | * | trans | -60.1 | 147.8 | 171.6 | 28.6 | -31.1 | 0 | 0 | 0 | 107.8 | D18 | P16-D18 VanDerWaalsContact C-N 3.34Å; P16-D18 PolarHBondContact O-N 2.88Å | ||
| 17 | L | 29.6 | Very low | 36.6 | Very low | 184 Ų | 184 | 121.5 Ų | 121.5 | 96% | 0.963 | 66% | 0.656 | S | S | * | * | trans | -46.3 | 100.6 | 173.9 | -79.2 | 155.7 | 0 | 0 | 0 | 109.5 | ||||
| 18 | D | 28.8 | Very low | 38.2 | Very low | 127 Ų | 127 | 116.5 Ų | 116.5 | 68% | 0.679 | 62% | 0.623 | S | S | * | * | trans | -64.7 | 140.7 | -175.2 | -168 | 25.5 | 0 | 0 | 0 | 109.7 | P16 R20 | P16-D18 VanDerWaalsContact C-N 3.34Å; P16-D18 PolarHBondContact O-N 2.88Å; D18-R20 PolarHBondContact O-N 2.92Å | ||
| 19 | D | 39.8 | Very low | 39.8 | Very low | 140 Ų | 140 | 111.8 Ų | 111.8 | 75% | 0.749 | 60% | 0.601 | S | S | * | * | trans | -42 | 96.4 | -173.8 | -78.2 | -46 | 0 | 0 | 0 | 114.4 | ||||
| 20 | R | 35.7 | Very low | 40.8 | Very low | 213 Ų | 213 | 110.5 Ų | 110.5 | 80% | 0.804 | 59% | 0.592 | S | S | * | * | trans | -127.4 | 108.7 | 164.9 | -65.2 | -168.4 | -177.9 | -168.1 | 2.6 | 111.2 | D18 | D18-R20 PolarHBondContact O-N 2.92Š| ||
| 21 | H | 44.7 | Very low | 41.3 | Very low | 124 Ų | 124 | 108.9 Ų | 108.9 | 57% | 0.574 | 58% | 0.58 | S | S | * | * | trans | 98.5 | 56.2 | 170.1 | -48.6 | -54.9 | 0 | 0 | 0 | 119.2 | L23 | H21-L23 PolarHBondContact O-N 3.36Š| ||
| 22 | P | 37.3 | Very low | 41.8 | Very low | 71 Ų | 71 | 105 Ų | 105 | 46% | 0.461 | 58% | 0.577 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -71.9 | 5 | 166 | 28.8 | -32.1 | 0 | 0 | 0 | 115.1 | ||
| 23 | L | 40.3 | Very low | 42.4 | Very low | 124 Ų | 124 | 114.2 Ų | 114.2 | 65% | 0.649 | 59% | 0.591 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -126.8 | -0.2 | -163.5 | -70.6 | 171.1 | 0 | 0 | 0 | 116.9 | H21 | H21-L23 PolarHBondContact O-N 3.36Š|
| 24 | C | 50.4 | Low | 42.5 | Very low | 47 Ų | 47 | 107.9 Ų | 107.9 | 32% | 0.318 | 58% | 0.579 | S | S | . | * | trans | -119.2 | 27.8 | -167.2 | -60.3 | 0 | 0 | 0 | 0 | 115.1 | R26 | C24-R26 PolarHBondContact O-N 3.17Š| ||
| 25 | A | 58.3 | Low | 42.1 | Very low | 5 Ų | 5 | 109.4 Ų | 109.4 | 4% | 0.041 | 58% | 0.577 | C | S | . | * | P | Polyproline II helix | trans | -74.5 | 128.1 | 173.1 | 0 | 0 | 0 | 0 | 0 | 110.5 | A51 W59 F87 D88 | A25-A51 WeakPolarHBondContact O-CB 3.32Å; A25-A51 PolarHBondContact O-N 3.09Å; A25-W59 HydrophobicContact CB-CD2 4.04Å; A25-W59 HydrophobicContact CB-CG 3.89Å; A25-F87 HydrophobicContact CB-CB 4.43Å; A25-F87 HydrophobicContact CB-CD1 3.94Å; A25-D88 WeakPolarHBondContact CA-O 3.3Å |
| 26 | R | 63.8 | Low | 43 | Very low | 62 Ų | 62 | 111.6 Ų | 111.6 | 23% | 0.234 | 59% | 0.587 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -103.9 | 129.1 | 170.1 | -69.3 | 176 | 167.3 | 166.3 | -0.6 | 109.4 | C24 R49 T50 F87 D88 | C24-R26 PolarHBondContact O-N 3.17Å; R26-R49 CarbonylContact C-O 3.35Å; R26-R49 WeakPolarHBondContact CA-O 3.27Å; R26-R49 WeakPolarHBondContact CB-O 3.35Å; R26-T50 HydrophobicContact CG-CG2 4.45Å; R26-F87 CarbonylContact O-C 3.5Å; R26-F87 VanDerWaalsContact O-CA 3.25Å; R26-F87 WeakPolarHBondContact O-CA 3.47Å; R26-D88 HydrophobicContact CB-CB 4.19Å; R26-D88 PolarHBondContact N-O 3.02Å; R26-D88 PolarHBondContact O-N 2.99Å |
| 27 | L | 67.1 | Low | 43.3 | Very low | 29 Ų | 29 | 114.1 Ų | 114.1 | 15% | 0.152 | 59% | 0.589 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -77.2 | 128 | 173.9 | -178.1 | 67.3 | 0 | 0 | 0 | 109.3 | R49 A55 L81 F87 | L27-R49 PolarHBondContact N-O 3.33Å; L27-R49 PolarHBondContact O-N 3.02Å; L27-A55 HydrophobicContact CD2-CB 4.45Å; L27-L81 HydrophobicContact CD1-CD2 4.24Å; L27-L81 HydrophobicContact CD2-CD2 3.97Å; L27-F87 HydrophobicContact CB-CE1 4.33Å; L27-F87 HydrophobicContact CD1-CD1 4.4Å; L27-F87 HydrophobicContact CD1-CE1 3.96Å; L27-F87 HydrophobicContact CD1-CE2 4.33Å; L27-F87 HydrophobicContact CD1-CZ 3.91Å |
| 28 | V | 61.3 | Low | 43.4 | Very low | 24 Ų | 24 | 113.2 Ų | 113.2 | 15% | 0.145 | 58% | 0.579 | C | S | . | * | E | Extended strand (participates in β ladder) | trans | -86.8 | 116.1 | 173.4 | -179.3 | 0 | 0 | 0 | 0 | 109.1 | I46 T48 V86 D88 L116 | V28-I46 HydrophobicContact CG1-CG2 3.48Å; V28-I46 VanDerWaalsContact CG1-CG2 3.48Å; V28-T48 HydrophobicContact CG2-CG2 4.15Å; V28-V86 HydrophobicContact CB-CB 4.12Å; V28-V86 HydrophobicContact CB-CG1 4.38Å; V28-V86 HydrophobicContact CG2-CB 4.31Å; V28-V86 HydrophobicContact CG2-CG1 4.05Å; V28-V86 PolarHBondContact N-O 3.03Å; V28-D88 HydrophobicContact CG2-CB 4.36Å; V28-L116 HydrophobicContact CG2-CD2 3.88Å |
| 29 | E | 61.6 | Low | 43.7 | Very low | 81 Ų | 81 | 115.4 Ų | 115.4 | 38% | 0.379 | 59% | 0.59 | S | S | . | * | E | Extended strand (participates in β ladder) | trans | -85 | 125.3 | 174.5 | -70.4 | -179.3 | 177.7 | 0 | 0 | 109.8 | V47 R49 | E29-V47 PolarHBondContact N-O 2.98Å; E29-R49 VanDerWaalsContact CD-CD 3.45Å; E29-R49 WeakPolarHBondContact OE1-CD 3.46Å; E29-R49 IonicContact OE1-CZ 3.71Å; E29-R49 IonicContact OE1-NE 2.9Å; E29-R49 IonicContact OE1-NH1 2.71Å; E29-R49 PolarHBondContact OE1-NH1 3.26Å; E29-R49 IonicContact OE2-NH1 2.87Å |
| 30 | K | 48.3 | Very low | 43.4 | Very low | 156 Ų | 156 | 118.6 Ų | 118.6 | 68% | 0.678 | 60% | 0.597 | S | S | * | * | P | Polyproline II helix | trans | -74.5 | 134.9 | 169.4 | -71.9 | 179 | -179.8 | 170.7 | 0 | 108.4 | S32 | K30-S32 PolarHBondContact O-N 3.39Š|
| 31 | P | 38.1 | Very low | 43.2 | Very low | 93 Ų | 93 | 113.8 Ų | 113.8 | 60% | 0.604 | 60% | 0.596 | S | S | * | * | P | Polyproline II helix | trans | -57.6 | 125.1 | 178.6 | 20.7 | -30.1 | 0 | 0 | 0 | 109.9 | R33 | P31-R33 PolarHBondContact O-N 3.06Š|
| 32 | S | 35.7 | Very low | 42.8 | Very low | 110 Ų | 110 | 110.6 Ų | 110.6 | 77% | 0.769 | 60% | 0.597 | S | S | * | * | P | Polyproline II helix | trans | -63 | 120.4 | -179.7 | 45.7 | 0 | 0 | 0 | 0 | 110.1 | K30 G34 | K30-S32 PolarHBondContact O-N 3.39Å; S32-G34 VanDerWaalsContact C-N 3.33Å; S32-G34 PolarHBondContact O-N 3.43Å |
| 33 | R | 37 | Very low | 42.8 | Very low | 262 Ų | 262 | 113.7 Ų | 113.7 | 99% | 0.989 | 62% | 0.617 | S | S | * | * | trans | -73.9 | 91.7 | 160.9 | -80.5 | -170.5 | 177.3 | -174.3 | -0.2 | 108.5 | P31 | P31-R33 PolarHBondContact O-N 3.06Š| ||
| 34 | G | 29.1 | Very low | 42.6 | Very low | 66 Ų | 66 | 109.6 Ų | 109.6 | 68% | 0.68 | 61% | 0.605 | S | S | * | * | trans | -171.7 | 127.2 | 164.9 | 0 | 0 | 0 | 0 | 0 | 106.8 | S32 | S32-G34 VanDerWaalsContact C-N 3.33Å; S32-G34 PolarHBondContact O-N 3.43Å | ||
| 35 | S | 28.2 | Very low | 42.3 | Very low | 112 Ų | 112 | 112.8 Ų | 112.8 | 78% | 0.783 | 63% | 0.625 | S | S | * | * | cis | -124 | 167.3 | 12.5 | 41.9 | 0 | 0 | 0 | 0 | 110.2 | E37 | S35-E37 PolarHBondContact O-N 3.05Š| ||
| 36 | E | 40.3 | Very low | 41.9 | Very low | 197 Ų | 197 | 117.7 Ų | 117.7 | 92% | 0.921 | 65% | 0.649 | S | S | * | * | trans | -50.3 | 102.2 | 166.3 | -69.8 | -177.7 | 152.3 | 0 | 0 | 110.3 | ||||
| 37 | E | 33.7 | Very low | 41.6 | Very low | 169 Ų | 169 | 118.3 Ų | 118.3 | 79% | 0.79 | 66% | 0.66 | S | S | * | * | trans | -170.9 | 131.7 | 140.8 | -104.7 | 172.4 | -169.4 | 0 | 0 | 108.3 | S35 | S35-E37 PolarHBondContact O-N 3.05Š| ||
| 38 | H | 31.1 | Very low | 41.1 | Very low | 165 Ų | 165 | 119.4 Ų | 119.4 | 76% | 0.764 | 67% | 0.668 | S | S | * | * | trans | 82.6 | 80.8 | 179.9 | -51.7 | -32.5 | 0 | 0 | 0 | 116.9 | K40 | H38-K40 VanDerWaalsContact C-N 3.3Å; H38-K40 PolarHBondContact O-N 2.93Å | ||
| 39 | L | 36.2 | Very low | 41.1 | Very low | 173 Ų | 173 | 125.5 Ų | 125.5 | 91% | 0.906 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -52.7 | 97.2 | 142.2 | -93 | 81.4 | 0 | 0 | 0 | 108.7 | ||
| 40 | K | 33.8 | Very low | 41.3 | Very low | 208 Ų | 208 | 126.3 Ų | 126.3 | 90% | 0.904 | 70% | 0.699 | S | S | * | * | trans | 160.7 | 68 | 153.1 | -88.5 | 165.5 | -172.7 | -175.4 | 0 | 109.6 | H38 | H38-K40 VanDerWaalsContact C-N 3.3Å; H38-K40 PolarHBondContact O-N 2.93Å | ||
| 41 | S | 31 | Very low | 42.1 | Very low | 112 Ų | 112 | 119.6 Ų | 119.6 | 78% | 0.783 | 67% | 0.672 | S | S | * | * | trans | -145.7 | 131.4 | 155.9 | 65.7 | 0 | 0 | 0 | 0 | 109 | ||||
| 42 | G | 36.1 | Very low | 43.7 | Very low | 57 Ų | 57 | 119.2 Ų | 119.2 | 59% | 0.588 | 67% | 0.672 | S | S | * | * | trans | -60.3 | 174.9 | 166.7 | 0 | 0 | 0 | 0 | 0 | 110.7 | G44 | G42-G44 PolarHBondContact O-N 3.46Š| ||
| 43 | P | 37.6 | Very low | 46 | Very low | 135 Ų | 135 | 116.5 Ų | 116.5 | 88% | 0.877 | 66% | 0.662 | S | S | * | * | S | Bend | trans | -52.2 | 120.6 | 177.2 | 22.7 | -31.7 | 0 | 0 | 0 | 109.5 | ||
| 44 | G | 35.8 | Very low | 48 | Very low | 38 Ų | 38 | 107 Ų | 107 | 39% | 0.392 | 63% | 0.634 | S | S | . | * | P | Polyproline II helix | trans | -60.8 | 162.7 | 176.8 | 0 | 0 | 0 | 0 | 0 | 111.7 | G42 | G42-G44 PolarHBondContact O-N 3.46Š|
| 45 | P | 44.4 | Very low | 50.4 | Low | 115 Ų | 115 | 104.2 Ų | 104.2 | 75% | 0.747 | 60% | 0.604 | S | S | * | * | P | Polyproline II helix | trans | -59.3 | 142.2 | -177.7 | 25.3 | -33.8 | 0 | 0 | 0 | 111.6 | V47 | P45-V47 PolarHBondContact O-N 3.25Š|
| 46 | I | 50.1 | Low | 52.8 | Low | 108 Ų | 108 | 100.8 Ų | 100.8 | 55% | 0.554 | 58% | 0.577 | S | S | * | * | P | Polyproline II helix | trans | -63 | 122.8 | 173.7 | -60.3 | 176.5 | 0 | 0 | 0 | 108.3 | V28 | V28-I46 HydrophobicContact CG1-CG2 3.48Å; V28-I46 VanDerWaalsContact CG1-CG2 3.48Å |
| 47 | V | 56.7 | Low | 54.8 | Low | 74 Ų | 74 | 93.4 Ų | 93.4 | 45% | 0.448 | 55% | 0.55 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -104.7 | 114.2 | 177.6 | -176.8 | 0 | 0 | 0 | 0 | 109 | E29 P45 R49 | E29-V47 PolarHBondContact N-O 2.98Å; P45-V47 PolarHBondContact O-N 3.25Å; V47-R49 HydrophobicContact CG1-CG 4.48Å |
| 48 | T | 57.5 | Low | 57.2 | Low | 52 Ų | 52 | 85.4 Ų | 85.4 | 32% | 0.319 | 51% | 0.512 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -96.7 | 130.6 | 173.5 | 57.9 | 0 | 0 | 0 | 0 | 110.2 | V28 D88 | V28-T48 HydrophobicContact CG2-CG2 4.15Å; T48-D88 HydrophobicContact CG2-CB 4.48Å |
| 49 | R | 60.2 | Low | 59.7 | Low | 152 Ų | 152 | 78.2 Ų | 78.2 | 57% | 0.574 | 48% | 0.478 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -117.1 | 141 | 171.6 | -62 | 179.6 | 96.7 | 173.3 | 6.8 | 109.8 | R26 L27 E29 V47 A51 | R26-R49 CarbonylContact C-O 3.35Å; R26-R49 WeakPolarHBondContact CA-O 3.27Å; R26-R49 WeakPolarHBondContact CB-O 3.35Å; L27-R49 PolarHBondContact N-O 3.33Å; L27-R49 PolarHBondContact O-N 3.02Å; E29-R49 VanDerWaalsContact CD-CD 3.45Å; E29-R49 WeakPolarHBondContact OE1-CD 3.46Å; E29-R49 IonicContact OE1-CZ 3.71Å; E29-R49 IonicContact OE1-NE 2.9Å; E29-R49 IonicContact OE1-NH1 2.71Å; E29-R49 PolarHBondContact OE1-NH1 3.26Å; E29-R49 IonicContact OE2-NH1 2.87Å; V47-R49 HydrophobicContact CG1-CG 4.48Å; R49-A51 PolarHBondContact O-N 2.84Å |
| 50 | T | 66.1 | Low | 61.9 | Low | 99 Ų | 99 | 74 Ų | 74 | 61% | 0.607 | 45% | 0.454 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -57.3 | 123.3 | 173.4 | 47.5 | 0 | 0 | 0 | 0 | 109.6 | R26 S52 | R26-T50 HydrophobicContact CG-CG2 4.45Å; T50-S52 PolarHBondContact O-N 3.33Å |
| 51 | A | 66.4 | Low | 64.4 | Low | 15 Ų | 15 | 64.4 Ų | 64.4 | 12% | 0.124 | 41% | 0.414 | C | S | . | . | trans | -60.9 | 123.2 | 179.8 | 0 | 0 | 0 | 0 | 0 | 109 | A25 R49 A55 L56 F87 | A25-A51 WeakPolarHBondContact O-CB 3.32Å; A25-A51 PolarHBondContact O-N 3.09Å; R49-A51 PolarHBondContact O-N 2.84Å; A51-A55 HydrophobicContact CB-CB 4.07Å; A51-L56 HydrophobicContact CB-CB 4.45Å; A51-F87 HydrophobicContact CB-CE1 4.39Å | ||
| 52 | S | 71.5 | Confident | 67 | Low | 84 Ų | 84 | 59.1 Ų | 59.1 | 59% | 0.587 | 38% | 0.376 | S | S | * | . | trans | -139.3 | 153 | 179.9 | 55.7 | 0 | 0 | 0 | 0 | 109.8 | T50 P54 A55 | T50-S52 PolarHBondContact O-N 3.33Å; S52-P54 WeakPolarHBondContact O-CD 3.46Å; S52-A55 PolarHBondContact O-N 3.17Å | ||
| 53 | G | 82.2 | Confident | 69.3 | Low | 54 Ų | 54 | 57.7 Ų | 57.7 | 56% | 0.557 | 36% | 0.355 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 58.7 | -122.1 | -178.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | A55 L56 A57 | G53-A55 VanDerWaalsContact C-N 3.3Å; G53-A55 PolarHBondContact O-N 3.24Å; G53-L56 PolarHBondContact O-N 3.27Å; G53-A57 PolarHBondContact O-N 3.28Å; G53-A57 VanDerWaalsContact O-N 3.15Å |
| 54 | P | 80.7 | Confident | 71.7 | Confident | 62 Ų | 62 | 54.8 Ų | 54.8 | 40% | 0.403 | 34% | 0.343 | S | S | . | . | H | α-helix | trans | -64.4 | -30.2 | -174.4 | 25.7 | -33.2 | 0 | 0 | 0 | 113.6 | S52 F58 T79 L81 | S52-P54 WeakPolarHBondContact O-CD 3.46Å; P54-F58 VanDerWaalsContact O-CB 3.22Å; P54-F58 WeakPolarHBondContact O-CB 3.33Å; P54-F58 PolarHBondContact O-N 3.14Å; P54-T79 HydrophobicContact CB-CG2 3.7Å; P54-T79 HydrophobicContact CG-CG2 4.19Å; P54-L81 HydrophobicContact CB-CD1 4.42Å |
| 55 | A | 78.5 | Confident | 74.1 | Confident | 8 Ų | 8 | 54 Ų | 54 | 7% | 0.066 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -68.9 | -39.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | L27 A51 S52 G53 W59 L81 | L27-A55 HydrophobicContact CD2-CB 4.45Å; A51-A55 HydrophobicContact CB-CB 4.07Å; S52-A55 PolarHBondContact O-N 3.17Å; G53-A55 VanDerWaalsContact C-N 3.3Å; G53-A55 PolarHBondContact O-N 3.24Å; A55-W59 WeakPolarHBondContact O-CB 3.4Å; A55-W59 PolarHBondContact O-N 3.43Å; A55-L81 HydrophobicContact CB-CD1 4.45Å; A55-L81 HydrophobicContact CB-CD2 4.08Å |
| 56 | L | 79.5 | Confident | 76.3 | Confident | 40 Ų | 40 | 51.9 Ų | 51.9 | 21% | 0.209 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -70.1 | -44.4 | 176.2 | -175.8 | 69.4 | 0 | 0 | 0 | 110.9 | A51 G53 F58 W59 Q60 | A51-L56 HydrophobicContact CB-CB 4.45Å; G53-L56 PolarHBondContact O-N 3.27Å; L56-F58 VanDerWaalsContact C-N 3.28Å; L56-F58 PolarHBondContact O-N 3Å; L56-W59 PolarHBondContact O-N 2.83Å; L56-Q60 WeakPolarHBondContact O-CB 3.21Å; L56-Q60 WeakPolarHBondContact O-CG 3.41Å; L56-Q60 PolarHBondContact O-N 3.23Å |
| 57 | A | 82.4 | Confident | 78.2 | Confident | 42 Ų | 42 | 49.2 Ų | 49.2 | 35% | 0.347 | 31% | 0.305 | S | S | . | . | H | α-helix | trans | -61.3 | -39 | 177 | 0 | 0 | 0 | 0 | 0 | 111.7 | G53 A61 I73 | G53-A57 PolarHBondContact O-N 3.28Å; G53-A57 VanDerWaalsContact O-N 3.15Å; A57-A61 VanDerWaalsContact O-CB 3.28Å; A57-A61 WeakPolarHBondContact O-CB 3.45Å; A57-A61 PolarHBondContact O-N 3.25Å; A57-I73 HydrophobicContact CB-CD1 4.15Å |
| 58 | F | 84 | Confident | 79.7 | Confident | 0 Ų | 0 | 47.4 Ų | 47.4 | 0% | 0 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -62.7 | -48.8 | 174.3 | -179.7 | -115.8 | 0 | 0 | 0 | 111.8 | P54 L56 Q60 A61 V62 V70 I73 L74 L81 F87 P119 L135 | P54-F58 VanDerWaalsContact O-CB 3.22Å; P54-F58 WeakPolarHBondContact O-CB 3.33Å; P54-F58 PolarHBondContact O-N 3.14Å; L56-F58 VanDerWaalsContact C-N 3.28Å; L56-F58 PolarHBondContact O-N 3Å; F58-Q60 PolarHBondContact O-N 2.6Å; F58-A61 PolarHBondContact O-N 2.85Å; F58-V62 HydrophobicContact CD2-CG2 4.49Å; F58-V62 HydrophobicContact CE1-CG2 4.44Å; F58-V62 HydrophobicContact CE2-CG2 4.2Å; F58-V62 HydrophobicContact CZ-CG2 4.17Å; F58-V62 WeakPolarHBondContact O-CG2 3.47Å; F58-V62 PolarHBondContact O-N 3.39Å; F58-V70 HydrophobicContact CE2-CG1 3.99Å; F58-I73 HydrophobicContact CB-CD1 4.09Å; F58-I73 HydrophobicContact CB-CG2 4.01Å; F58-I73 HydrophobicContact CD2-CB 4.23Å; F58-I73 HydrophobicContact CD2-CG2 4.04Å; F58-I73 HydrophobicContact CG-CG2 4.32Å; F58-L74 HydrophobicContact CD2-CG 4.49Å; F58-L74 HydrophobicContact CE2-CD1 3.92Å; F58-L74 HydrophobicContact CE2-CD2 3.82Å; F58-L74 HydrophobicContact CE2-CG 3.64Å; F58-L74 HydrophobicContact CZ-CD1 4.26Å; F58-L74 HydrophobicContact CZ-CD2 3.89Å; F58-L74 HydrophobicContact CZ-CG 4.16Å; F58-L81 HydrophobicContact CB-CD1 3.9Å; F58-L81 HydrophobicContact CD1-CD1 4.36Å; F58-L81 HydrophobicContact CG-CD1 4.18Å; F58-F87 HydrophobicContact CD1-CE2 4.13Å; F58-F87 AromaticContact CD1-CZ 3.96Å; F58-F87 HydrophobicContact CD1-CZ 3.96Å; F58-F87 HydrophobicContact CE1-CE2 4.18Å; F58-F87 HydrophobicContact CE1-CZ 4.44Å; F58-P119 HydrophobicContact CD1-CG 4.47Å; F58-P119 HydrophobicContact CE1-CB 4.17Å; F58-P119 HydrophobicContact CE1-CG 3.38Å; F58-P119 HydrophobicContact CZ-CB 4.13Å; F58-P119 HydrophobicContact CZ-CG 3.76Å; F58-L135 HydrophobicContact CZ-CD2 4.45Å |
| 59 | W | 82.3 | Confident | 81.1 | Confident | 14 Ų | 14 | 46.4 Ų | 46.4 | 5% | 0.053 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -59.3 | -46.8 | 177.8 | -175.6 | -111.6 | 0 | 0 | 0 | 112 | A25 A55 L56 A61 V62 L63 F87 T89 T117 V122 | A25-W59 HydrophobicContact CB-CD2 4.04Å; A25-W59 HydrophobicContact CB-CG 3.89Å; A55-W59 WeakPolarHBondContact O-CB 3.4Å; A55-W59 PolarHBondContact O-N 3.43Å; L56-W59 PolarHBondContact O-N 2.83Å; W59-A61 VanDerWaalsContact C-N 3.34Å; W59-A61 PolarHBondContact O-N 2.98Å; W59-V62 PolarHBondContact O-N 3.26Å; W59-L63 HydrophobicContact CG-CD1 4.38Å; W59-L63 HydrophobicContact CZ2-CD2 4.36Å; W59-L63 WeakPolarHBondContact O-CB 3.21Å; W59-L63 VanDerWaalsContact O-CG 3.3Å; W59-L63 WeakPolarHBondContact O-CG 3.47Å; W59-L63 PolarHBondContact O-N 3.27Å; W59-F87 HydrophobicContact CB-CE1 4.38Å; W59-F87 HydrophobicContact CD2-CD1 4.45Å; W59-F87 HydrophobicContact CD2-CG 4.34Å; W59-F87 HydrophobicContact CE3-CB 4.09Å; W59-F87 HydrophobicContact CE3-CD1 4.14Å; W59-F87 AromaticContact CE3-CD2 3.6Å; W59-F87 HydrophobicContact CE3-CD2 3.6Å; W59-F87 HydrophobicContact CE3-CE1 4.49Å; W59-F87 HydrophobicContact CE3-CE2 4.02Å; W59-F87 AromaticContact CE3-CG 3.67Å; W59-F87 HydrophobicContact CE3-CG 3.67Å; W59-F87 HydrophobicContact CE3-CZ 4.44Å; W59-F87 HydrophobicContact CH2-CB 4.13Å; W59-F87 HydrophobicContact CZ3-CB 3.8Å; W59-F87 AromaticContact CZ3-CD2 3.69Å; W59-F87 HydrophobicContact CZ3-CD2 3.69Å; W59-F87 HydrophobicContact CZ3-CE2 4.46Å; W59-F87 AromaticContact CZ3-CG 3.81Å; W59-F87 HydrophobicContact CZ3-CG 3.81Å; W59-T89 HydrophobicContact CH2-CG2 4.05Å; W59-T89 HydrophobicContact CZ2-CG2 3.59Å; W59-T117 WeakPolarHBondContact CH2-OG1 3.22Å; W59-V122 HydrophobicContact CH2-CG2 3.24Å; W59-V122 HydrophobicContact CZ2-CG2 3.97Å; W59-V122 HydrophobicContact CZ3-CG2 3.66Å |
| 60 | Q | 83.8 | Confident | 82.4 | Confident | 85 Ų | 85 | 39.1 Ų | 39.1 | 40% | 0.397 | 27% | 0.269 | S | S | . | . | H | α-helix | trans | -61.8 | -39.8 | 176.3 | -72.4 | 175.8 | -18.1 | 0 | 0 | 112.5 | L56 F58 L63 A64 | L56-Q60 WeakPolarHBondContact O-CB 3.21Å; L56-Q60 WeakPolarHBondContact O-CG 3.41Å; L56-Q60 PolarHBondContact O-N 3.23Å; F58-Q60 PolarHBondContact O-N 2.6Å; Q60-L63 PolarHBondContact O-N 3.44Å; Q60-A64 WeakPolarHBondContact O-CB 3.25Å; Q60-A64 PolarHBondContact O-N 2.98Å |
| 61 | A | 86.4 | Confident | 83.5 | Confident | 7 Ų | 7 | 36.5 Ų | 36.5 | 6% | 0.058 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -64.5 | -40.8 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112 | A57 F58 W59 A64 G65 D66 C69 V70 | A57-A61 VanDerWaalsContact O-CB 3.28Å; A57-A61 WeakPolarHBondContact O-CB 3.45Å; A57-A61 PolarHBondContact O-N 3.25Å; F58-A61 PolarHBondContact O-N 2.85Å; W59-A61 VanDerWaalsContact C-N 3.34Å; W59-A61 PolarHBondContact O-N 2.98Å; A61-A64 PolarHBondContact O-N 3.44Å; A61-G65 PolarHBondContact O-N 2.93Å; A61-D66 HydrophobicContact CB-CB 4.43Å; A61-D66 PolarHBondContact O-N 3.02Å; A61-C69 HydrophobicContact CB-CB 3.53Å; A61-V70 HydrophobicContact CB-CG2 3.82Å |
| 62 | V | 85.9 | Confident | 84.5 | Confident | 0 Ų | 0 | 43.8 Ų | 43.8 | 0% | 0 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -65.3 | -42.8 | 175.1 | 175.6 | 0 | 0 | 0 | 0 | 110.8 | F58 W59 A64 G65 V70 P119 V122 H128 | F58-V62 HydrophobicContact CD2-CG2 4.49Å; F58-V62 HydrophobicContact CE1-CG2 4.44Å; F58-V62 HydrophobicContact CE2-CG2 4.2Å; F58-V62 HydrophobicContact CZ-CG2 4.17Å; F58-V62 WeakPolarHBondContact O-CG2 3.47Å; F58-V62 PolarHBondContact O-N 3.39Å; W59-V62 PolarHBondContact O-N 3.26Å; V62-A64 VanDerWaalsContact C-N 3.33Å; V62-A64 PolarHBondContact O-N 3.11Å; V62-G65 PolarHBondContact O-N 3.33Å; V62-V70 HydrophobicContact CG2-CG2 3.79Å; V62-P119 HydrophobicContact CG1-CB 4.21Å; V62-P119 HydrophobicContact CG2-CB 4.03Å; V62-V122 HydrophobicContact CG1-CB 3.88Å; V62-V122 HydrophobicContact CG1-CG1 3.87Å; V62-H128 PolarHBondContact O-CD2 3.07Å; V62-H128 VanDerWaalsContact O-CD2 3.24Å |
| 63 | L | 84.3 | Confident | 85.2 | Confident | 27 Ų | 27 | 41 Ų | 41 | 14% | 0.141 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -59.7 | -43.5 | 175.7 | -73.9 | 175.7 | 0 | 0 | 0 | 111.9 | W59 Q60 G65 V122 R126 H128 | W59-L63 HydrophobicContact CG-CD1 4.38Å; W59-L63 HydrophobicContact CZ2-CD2 4.36Å; W59-L63 WeakPolarHBondContact O-CB 3.21Å; W59-L63 VanDerWaalsContact O-CG 3.3Å; W59-L63 WeakPolarHBondContact O-CG 3.47Å; W59-L63 PolarHBondContact O-N 3.27Å; Q60-L63 PolarHBondContact O-N 3.44Å; L63-G65 VanDerWaalsContact C-N 3.32Å; L63-V122 HydrophobicContact CD2-CG1 3.67Å; L63-V122 HydrophobicContact CG-CG1 4.46Å; L63-R126 VanDerWaalsContact C-NH1 3.31Å; L63-R126 VanDerWaalsContact CB-NH1 3.27Å; L63-R126 PolarHBondContact O-NH1 3.2Å; L63-H128 PolarHBondContact O-NE2 2.98Å |
| 64 | A | 86.1 | Confident | 85.3 | Confident | 75 Ų | 75 | 39.3 Ų | 39.3 | 62% | 0.62 | 24% | 0.236 | S | C | * | . | H | α-helix | trans | -77.4 | -14.1 | 179.8 | 0 | 0 | 0 | 0 | 0 | 113.9 | Q60 A61 V62 D66 | Q60-A64 WeakPolarHBondContact O-CB 3.25Å; Q60-A64 PolarHBondContact O-N 2.98Å; A61-A64 PolarHBondContact O-N 3.44Å; V62-A64 VanDerWaalsContact C-N 3.33Å; V62-A64 PolarHBondContact O-N 3.11Å; A64-D66 VanDerWaalsContact C-N 3.34Å |
| 65 | G | 86.4 | Confident | 85.5 | Confident | 20 Ų | 20 | 39.6 Ų | 39.6 | 21% | 0.206 | 24% | 0.243 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 76.3 | 18.2 | -174.3 | 0 | 0 | 0 | 0 | 0 | 114 | A61 V62 L63 V67 H128 | A61-G65 PolarHBondContact O-N 2.93Å; V62-G65 PolarHBondContact O-N 3.33Å; L63-G65 VanDerWaalsContact C-N 3.32Å; G65-V67 PolarHBondContact O-N 3.05Å; G65-H128 PolarHBondContact N-NE2 3.49Å |
| 66 | D | 90.4 | Very high | 85.8 | Confident | 72 Ų | 72 | 42.9 Ų | 42.9 | 39% | 0.385 | 26% | 0.26 | S | S | . | . | trans | -78.2 | 92.3 | -178.4 | -174.2 | -16.2 | 0 | 0 | 0 | 111.5 | A61 A64 G68 C69 V70 | A61-D66 HydrophobicContact CB-CB 4.43Å; A61-D66 PolarHBondContact O-N 3.02Å; A64-D66 VanDerWaalsContact C-N 3.34Å; D66-G68 PolarHBondContact O-N 3.32Å; D66-G68 WeakPolarHBondContact OD1-CA 3.3Å; D66-G68 PolarHBondContact OD1-N 3.41Å; D66-C69 HydrophobicContact CB-CB 4.12Å; D66-C69 PolarHBondContact O-N 3.32Å; D66-C69 PolarHBondContact OD1-N 3.49Å; D66-C69 PolarHBondContact OD2-SG 2.99Å; D66-V70 WeakPolarHBondContact O-CB 3.32Å; D66-V70 VanDerWaalsContact O-CG2 3.26Å; D66-V70 WeakPolarHBondContact O-CG2 3.41Å; D66-V70 PolarHBondContact O-N 3.42Å | ||
| 67 | V | 90.6 | Very high | 85.3 | Confident | 51 Ų | 51 | 46.8 Ų | 46.8 | 31% | 0.309 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -57.5 | -35.8 | 177.8 | -171.9 | 0 | 0 | 0 | 0 | 112.1 | G65 S71 E130 V131 L134 | G65-V67 PolarHBondContact O-N 3.05Å; V67-S71 VanDerWaalsContact O-CB 3.26Å; V67-S71 WeakPolarHBondContact O-CB 3.46Å; V67-S71 PolarHBondContact O-N 3.19Å; V67-E130 HydrophobicContact CG2-CB 3.56Å; V67-V131 HydrophobicContact CG2-CG2 3.81Å; V67-L134 HydrophobicContact CG1-CD1 3.72Å |
| 68 | G | 88 | Confident | 84.8 | Confident | 37 Ų | 37 | 49.4 Ų | 49.4 | 38% | 0.381 | 31% | 0.306 | S | S | . | . | H | α-helix | trans | -69.9 | -45.1 | -177 | 0 | 0 | 0 | 0 | 0 | 111.9 | D66 R72 | D66-G68 PolarHBondContact O-N 3.32Å; D66-G68 WeakPolarHBondContact OD1-CA 3.3Å; D66-G68 PolarHBondContact OD1-N 3.41Å; G68-R72 WeakPolarHBondContact O-CG 3.15Å; G68-R72 PolarHBondContact O-N 3.34Å; G68-R72 VanDerWaalsContact O-N 3.15Å; G68-R72 PolarHBondContact O-NE 3.22Å |
| 69 | C | 87.1 | Confident | 84.2 | Confident | 30 Ų | 30 | 50.8 Ų | 50.8 | 20% | 0.203 | 32% | 0.315 | C | S | . | . | H | α-helix | trans | -63 | -48 | 172.4 | -78.7 | 0 | 0 | 0 | 0 | 111.7 | A61 D66 S71 R72 I73 | A61-C69 HydrophobicContact CB-CB 3.53Å; D66-C69 HydrophobicContact CB-CB 4.12Å; D66-C69 PolarHBondContact O-N 3.32Å; D66-C69 PolarHBondContact OD1-N 3.49Å; D66-C69 PolarHBondContact OD2-SG 2.99Å; C69-S71 VanDerWaalsContact C-N 3.33Å; C69-S71 PolarHBondContact O-N 3.49Å; C69-R72 PolarHBondContact O-N 2.93Å; C69-R72 PolarHBondContact SG-NH2 2.88Å; C69-I73 WeakPolarHBondContact O-CG1 3.48Å; C69-I73 PolarHBondContact O-N 2.95Å |
| 70 | V | 87.4 | Confident | 83.8 | Confident | 0 Ų | 0 | 53.4 Ų | 53.4 | 0% | 0 | 35% | 0.346 | C | S | . | . | H | α-helix | trans | -57.4 | -45.8 | 178.4 | 170.1 | 0 | 0 | 0 | 0 | 111.1 | F58 A61 V62 D66 R72 L74 V131 L134 | F58-V70 HydrophobicContact CE2-CG1 3.99Å; A61-V70 HydrophobicContact CB-CG2 3.82Å; V62-V70 HydrophobicContact CG2-CG2 3.79Å; D66-V70 WeakPolarHBondContact O-CB 3.32Å; D66-V70 VanDerWaalsContact O-CG2 3.26Å; D66-V70 WeakPolarHBondContact O-CG2 3.41Å; D66-V70 PolarHBondContact O-N 3.42Å; V70-R72 PolarHBondContact O-N 3.09Å; V70-L74 HydrophobicContact CG1-CD1 3.86Å; V70-L74 WeakPolarHBondContact O-CB 3.31Å; V70-L74 WeakPolarHBondContact O-CG 3.28Å; V70-L74 PolarHBondContact O-N 3.15Å; V70-V131 HydrophobicContact CG1-CG1 4.39Å; V70-V131 HydrophobicContact CG2-CG1 4.38Å; V70-L134 HydrophobicContact CG1-CD2 3.85Å |
| 71 | S | 89.3 | Confident | 83.5 | Confident | 44 Ų | 44 | 50.3 Ų | 50.3 | 31% | 0.308 | 33% | 0.332 | S | S | . | . | H | α-helix | trans | -62.9 | -42.5 | 179.6 | -170.3 | 0 | 0 | 0 | 0 | 112.8 | V67 C69 A75 | V67-S71 VanDerWaalsContact O-CB 3.26Å; V67-S71 WeakPolarHBondContact O-CB 3.46Å; V67-S71 PolarHBondContact O-N 3.19Å; C69-S71 VanDerWaalsContact C-N 3.33Å; C69-S71 PolarHBondContact O-N 3.49Å; S71-A75 WeakPolarHBondContact O-CB 3.49Å; S71-A75 PolarHBondContact O-N 3.04Å; S71-A75 VanDerWaalsContact O-N 3.09Å |
| 72 | R | 87.6 | Confident | 83.3 | Confident | 168 Ų | 168 | 52 Ų | 52 | 63% | 0.634 | 35% | 0.346 | S | S | * | . | H | α-helix | trans | -66.2 | -46.4 | -179.8 | -77.3 | -175.8 | -67.1 | 128.9 | -7.3 | 111.2 | G68 C69 V70 A75 D76 | G68-R72 WeakPolarHBondContact O-CG 3.15Å; G68-R72 PolarHBondContact O-N 3.34Å; G68-R72 VanDerWaalsContact O-N 3.15Å; G68-R72 PolarHBondContact O-NE 3.22Å; C69-R72 PolarHBondContact O-N 2.93Å; C69-R72 PolarHBondContact SG-NH2 2.88Å; V70-R72 PolarHBondContact O-N 3.09Å; R72-A75 PolarHBondContact O-N 3.26Å; R72-D76 PolarHBondContact O-N 2.88Å |
| 73 | I | 85.6 | Confident | 82.9 | Confident | 25 Ų | 25 | 53 Ų | 53 | 13% | 0.128 | 35% | 0.352 | C | S | . | . | H | α-helix | trans | -66.3 | -42.3 | -178.3 | -63.1 | 166.2 | 0 | 0 | 0 | 110.9 | A57 F58 C69 A75 D76 T79 L81 | A57-I73 HydrophobicContact CB-CD1 4.15Å; F58-I73 HydrophobicContact CB-CD1 4.09Å; F58-I73 HydrophobicContact CB-CG2 4.01Å; F58-I73 HydrophobicContact CD2-CB 4.23Å; F58-I73 HydrophobicContact CD2-CG2 4.04Å; F58-I73 HydrophobicContact CG-CG2 4.32Å; C69-I73 WeakPolarHBondContact O-CG1 3.48Å; C69-I73 PolarHBondContact O-N 2.95Å; I73-A75 PolarHBondContact O-N 3.48Å; I73-D76 PolarHBondContact O-N 3.26Å; I73-T79 HydrophobicContact CG2-CG2 4.37Å; I73-T79 PolarHBondContact O-OG1 3.38Å; I73-L81 HydrophobicContact CG2-CD1 3.78Å |
| 74 | L | 84.8 | Confident | 82.7 | Confident | 19 Ų | 19 | 53 Ų | 53 | 10% | 0.099 | 35% | 0.353 | C | S | . | . | H | α-helix | trans | -72.1 | -14.5 | 176 | -70.1 | 173.3 | 0 | 0 | 0 | 114 | F58 V70 L134 L135 R138 | F58-L74 HydrophobicContact CD2-CG 4.49Å; F58-L74 HydrophobicContact CE2-CD1 3.92Å; F58-L74 HydrophobicContact CE2-CD2 3.82Å; F58-L74 HydrophobicContact CE2-CG 3.64Å; F58-L74 HydrophobicContact CZ-CD1 4.26Å; F58-L74 HydrophobicContact CZ-CD2 3.89Å; F58-L74 HydrophobicContact CZ-CG 4.16Å; V70-L74 HydrophobicContact CG1-CD1 3.86Å; V70-L74 WeakPolarHBondContact O-CB 3.31Å; V70-L74 WeakPolarHBondContact O-CG 3.28Å; V70-L74 PolarHBondContact O-N 3.15Å; L74-L134 HydrophobicContact CD1-CD2 3.75Å; L74-L135 HydrophobicContact CD1-CD2 3.82Å; L74-R138 PolarHBondContact O-NH1 3.23Å |
| 75 | A | 85.2 | Confident | 82.5 | Confident | 68 Ų | 68 | 50.2 Ų | 50.2 | 56% | 0.562 | 33% | 0.328 | S | S | * | . | H | α-helix | trans | -83.3 | -24.1 | 173.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | S71 R72 I73 S77 | S71-A75 WeakPolarHBondContact O-CB 3.49Å; S71-A75 PolarHBondContact O-N 3.04Å; S71-A75 VanDerWaalsContact O-N 3.09Å; R72-A75 PolarHBondContact O-N 3.26Å; I73-A75 PolarHBondContact O-N 3.48Å; A75-S77 PolarHBondContact O-N 3.36Å |
| 76 | D | 83.8 | Confident | 82.1 | Confident | 77 Ų | 77 | 50.1 Ų | 50.1 | 41% | 0.412 | 32% | 0.323 | S | S | . | . | trans | -83.4 | 100.8 | -179.9 | -169.7 | -9.6 | 0 | 0 | 0 | 110.8 | R72 I73 S78 T79 | R72-D76 PolarHBondContact O-N 2.88Å; I73-D76 PolarHBondContact O-N 3.26Å; D76-S78 PolarHBondContact O-N 3.19Å; D76-S78 VanDerWaalsContact O-N 3.14Å; D76-S78 VanDerWaalsContact OD1-CB 3.25Å; D76-S78 WeakPolarHBondContact OD1-CB 3.21Å; D76-S78 PolarHBondContact OD1-N 2.87Å; D76-S78 PolarHBondContact OD1-OG 2.92Å; D76-S78 PolarHBondContact OD2-OG 3.04Å; D76-T79 HydrophobicContact CB-CG2 4.01Å; D76-T79 PolarHBondContact O-N 3.07Å; D76-T79 PolarHBondContact O-OG1 3.17Å | ||
| 77 | S | 70.6 | Confident | 81.3 | Confident | 121 Ų | 121 | 46.7 Ų | 46.7 | 85% | 0.846 | 31% | 0.305 | S | S | * | . | G | 310 helix | trans | -63.3 | -15.4 | 178.5 | 55.1 | 0 | 0 | 0 | 0 | 113.6 | A75 T79 | A75-S77 PolarHBondContact O-N 3.36Å; S77-T79 PolarHBondContact O-N 3.47Å |
| 78 | S | 71.3 | Confident | 80.5 | Confident | 97 Ų | 97 | 44.9 Ų | 44.9 | 68% | 0.678 | 29% | 0.294 | S | S | * | . | G | 310 helix | trans | -73.3 | -17.3 | 178.5 | 73.6 | 0 | 0 | 0 | 0 | 113.3 | D76 | D76-S78 PolarHBondContact O-N 3.19Å; D76-S78 VanDerWaalsContact O-N 3.14Å; D76-S78 VanDerWaalsContact OD1-CB 3.25Å; D76-S78 WeakPolarHBondContact OD1-CB 3.21Å; D76-S78 PolarHBondContact OD1-N 2.87Å; D76-S78 PolarHBondContact OD1-OG 2.92Å; D76-S78 PolarHBondContact OD2-OG 3.04Å |
| 79 | T | 72.2 | Confident | 79.6 | Confident | 30 Ų | 30 | 45 Ų | 45 | 18% | 0.184 | 29% | 0.287 | C | S | . | . | G | 310 helix | trans | -80.2 | -18.8 | -176.4 | 64.1 | 0 | 0 | 0 | 0 | 113.7 | P54 I73 D76 S77 L81 | P54-T79 HydrophobicContact CB-CG2 3.7Å; P54-T79 HydrophobicContact CG-CG2 4.19Å; I73-T79 HydrophobicContact CG2-CG2 4.37Å; I73-T79 PolarHBondContact O-OG1 3.38Å; D76-T79 HydrophobicContact CB-CG2 4.01Å; D76-T79 PolarHBondContact O-N 3.07Å; D76-T79 PolarHBondContact O-OG1 3.17Å; S77-T79 PolarHBondContact O-N 3.47Å; T79-L81 PolarHBondContact O-N 3.33Å; T79-L81 VanDerWaalsContact O-N 3.15Å |
| 80 | G | 73 | Confident | 78.5 | Confident | 69 Ų | 69 | 44.3 Ų | 44.3 | 71% | 0.711 | 28% | 0.283 | S | S | * | . | trans | 65.4 | 9.1 | -177 | 0 | 0 | 0 | 0 | 0 | 114.8 | ||||
| 81 | L | 78 | Confident | 77 | Confident | 20 Ų | 20 | 47.3 Ų | 47.3 | 11% | 0.105 | 30% | 0.299 | C | S | . | . | trans | -86.5 | 132 | -178.3 | -67 | 167 | 0 | 0 | 0 | 110.9 | L27 P54 A55 F58 I73 T79 | L27-L81 HydrophobicContact CD1-CD2 4.24Å; L27-L81 HydrophobicContact CD2-CD2 3.97Å; P54-L81 HydrophobicContact CB-CD1 4.42Å; A55-L81 HydrophobicContact CB-CD1 4.45Å; A55-L81 HydrophobicContact CB-CD2 4.08Å; F58-L81 HydrophobicContact CB-CD1 3.9Å; F58-L81 HydrophobicContact CD1-CD1 4.36Å; F58-L81 HydrophobicContact CG-CD1 4.18Å; I73-L81 HydrophobicContact CG2-CD1 3.78Å; T79-L81 PolarHBondContact O-N 3.33Å; T79-L81 VanDerWaalsContact O-N 3.15Å | ||
| 82 | A | 80.8 | Confident | 75.3 | Confident | 42 Ų | 42 | 47.6 Ų | 47.6 | 35% | 0.347 | 30% | 0.299 | S | S | . | . | trans | -106.3 | 155.6 | 173.5 | 0 | 0 | 0 | 0 | 0 | 109.5 | D84 S85 | A82-D84 PolarHBondContact O-N 3.47Å; A82-S85 PolarHBondContact N-OG 2.85Å; A82-S85 WeakPolarHBondContact O-CB 3.32Å; A82-S85 PolarHBondContact O-N 3.42Å; A82-S85 PolarHBondContact O-OG 3.03Å | ||
| 83 | P | 79.6 | Confident | 73.6 | Confident | 20 Ų | 20 | 44.6 Ų | 44.6 | 13% | 0.13 | 29% | 0.293 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62.1 | -22 | 171.3 | 27.7 | -35.3 | 0 | 0 | 0 | 112.6 | L135 R138 A140 | P83-L135 HydrophobicContact CB-CD2 3.83Å; P83-R138 HydrophobicContact CB-CB 4.39Å; P83-R138 HydrophobicContact CG-CB 4.1Å; P83-R138 WeakPolarHBondContact CG-O 3.43Å; P83-A140 HydrophobicContact CB-CB 4.05Å |
| 84 | D | 79.8 | Confident | 71.9 | Confident | 29 Ų | 29 | 51.1 Ų | 51.1 | 16% | 0.155 | 32% | 0.316 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -92.1 | 11.7 | 174.2 | -68.4 | -23.7 | 0 | 0 | 0 | 113.5 | A82 V86 A140 R141 | A82-D84 PolarHBondContact O-N 3.47Å; D84-V86 PolarHBondContact O-N 3.37Å; D84-A140 WeakPolarHBondContact OD1-CA 3.43Å; D84-R141 PolarHBondContact OD1-N 3.01Å |
| 85 | S | 81.8 | Confident | 70 | Confident | 15 Ų | 15 | 56.3 Ų | 56.3 | 11% | 0.105 | 33% | 0.334 | C | S | . | . | trans | -57.9 | 132.1 | 175.2 | -76.7 | 0 | 0 | 0 | 0 | 110.2 | A82 P119 | A82-S85 PolarHBondContact N-OG 2.85Å; A82-S85 WeakPolarHBondContact O-CB 3.32Å; A82-S85 PolarHBondContact O-N 3.42Å; A82-S85 PolarHBondContact O-OG 3.03Å; S85-P119 WeakPolarHBondContact O-CD 3.15Å | ||
| 86 | V | 78.4 | Confident | 68 | Low | 18 Ų | 18 | 59.5 Ų | 59.5 | 11% | 0.109 | 33% | 0.332 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -98.7 | 130.1 | -179.2 | -178.8 | 0 | 0 | 0 | 0 | 108.5 | V28 D84 L116 T118 P146 | V28-V86 HydrophobicContact CB-CB 4.12Å; V28-V86 HydrophobicContact CB-CG1 4.38Å; V28-V86 HydrophobicContact CG2-CB 4.31Å; V28-V86 HydrophobicContact CG2-CG1 4.05Å; V28-V86 PolarHBondContact N-O 3.03Å; D84-V86 PolarHBondContact O-N 3.37Å; V86-L116 HydrophobicContact CG1-CB 3.79Å; V86-L116 HydrophobicContact CG1-CD2 3.95Å; V86-L116 HydrophobicContact CG1-CG 4.31Å; V86-T118 HydrophobicContact CG2-CG2 4.21Å; V86-P146 HydrophobicContact CG1-CB 3.93Å; V86-P146 HydrophobicContact CG1-CG 4.2Å; V86-P146 HydrophobicContact CG2-CB 4.08Å; V86-P146 HydrophobicContact CG2-CG 4.3Å |
| 87 | F | 73.5 | Confident | 66.2 | Low | 0 Ų | 0 | 62 Ų | 62 | 0% | 0 | 35% | 0.345 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -111.9 | 131.2 | 175.8 | -68.3 | -89.9 | 0 | 0 | 0 | 109.1 | A25 R26 L27 A51 F58 W59 T117 P119 | A25-F87 HydrophobicContact CB-CB 4.43Å; A25-F87 HydrophobicContact CB-CD1 3.94Å; R26-F87 CarbonylContact O-C 3.5Å; R26-F87 VanDerWaalsContact O-CA 3.25Å; R26-F87 WeakPolarHBondContact O-CA 3.47Å; L27-F87 HydrophobicContact CB-CE1 4.33Å; L27-F87 HydrophobicContact CD1-CD1 4.4Å; L27-F87 HydrophobicContact CD1-CE1 3.96Å; L27-F87 HydrophobicContact CD1-CE2 4.33Å; L27-F87 HydrophobicContact CD1-CZ 3.91Å; A51-F87 HydrophobicContact CB-CE1 4.39Å; F58-F87 HydrophobicContact CD1-CE2 4.13Å; F58-F87 AromaticContact CD1-CZ 3.96Å; F58-F87 HydrophobicContact CD1-CZ 3.96Å; F58-F87 HydrophobicContact CE1-CE2 4.18Å; F58-F87 HydrophobicContact CE1-CZ 4.44Å; W59-F87 HydrophobicContact CB-CE1 4.38Å; W59-F87 HydrophobicContact CD2-CD1 4.45Å; W59-F87 HydrophobicContact CD2-CG 4.34Å; W59-F87 HydrophobicContact CE3-CB 4.09Å; W59-F87 HydrophobicContact CE3-CD1 4.14Å; W59-F87 AromaticContact CE3-CD2 3.6Å; W59-F87 HydrophobicContact CE3-CD2 3.6Å; W59-F87 HydrophobicContact CE3-CE1 4.49Å; W59-F87 HydrophobicContact CE3-CE2 4.02Å; W59-F87 AromaticContact CE3-CG 3.67Å; W59-F87 HydrophobicContact CE3-CG 3.67Å; W59-F87 HydrophobicContact CE3-CZ 4.44Å; W59-F87 HydrophobicContact CH2-CB 4.13Å; W59-F87 HydrophobicContact CZ3-CB 3.8Å; W59-F87 AromaticContact CZ3-CD2 3.69Å; W59-F87 HydrophobicContact CZ3-CD2 3.69Å; W59-F87 HydrophobicContact CZ3-CE2 4.46Å; W59-F87 AromaticContact CZ3-CG 3.81Å; W59-F87 HydrophobicContact CZ3-CG 3.81Å; F87-T117 PolarHBondContact N-O 3.25Å; F87-T117 PolarHBondContact O-N 2.99Å; F87-T117 PolarHBondContact O-OG1 2.95Å; F87-P119 HydrophobicContact CE2-CG 4.13Å |
| 88 | D | 72.9 | Confident | 65 | Low | 13 Ų | 13 | 60.9 Ų | 60.9 | 7% | 0.07 | 33% | 0.325 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -91.2 | 117.9 | 169.2 | 169.9 | 17.3 | 0 | 0 | 0 | 108.1 | A25 R26 V28 T48 S90 L116 | A25-D88 WeakPolarHBondContact CA-O 3.3Å; R26-D88 HydrophobicContact CB-CB 4.19Å; R26-D88 PolarHBondContact N-O 3.02Å; R26-D88 PolarHBondContact O-N 2.99Å; V28-D88 HydrophobicContact CG2-CB 4.36Å; T48-D88 HydrophobicContact CG2-CB 4.48Å; D88-S90 VanDerWaalsContact CG-OG 3.31Å; D88-S90 WeakPolarHBondContact OD1-CB 3.26Å; D88-S90 PolarHBondContact OD1-N 3.18Å; D88-S90 PolarHBondContact OD1-OG 3.15Å; D88-S90 PolarHBondContact OD2-OG 3.37Å; D88-L116 HydrophobicContact CB-CD2 3.92Å |
| 89 | T | 68.2 | Low | 63.7 | Low | 41 Ų | 41 | 65 Ų | 65 | 25% | 0.252 | 33% | 0.325 | S | S | . | . | trans | -100.3 | 6.9 | 179.3 | 53.1 | 0 | 0 | 0 | 0 | 113.5 | W59 E115 | W59-T89 HydrophobicContact CH2-CG2 4.05Å; W59-T89 HydrophobicContact CZ2-CG2 3.59Å; T89-E115 PolarHBondContact N-O 3.28Å; T89-E115 VanDerWaalsContact N-O 3.14Å; T89-E115 VanDerWaalsContact OG1-CB 3.28Å; T89-E115 WeakPolarHBondContact OG1-CB 3.46Å; T89-E115 PolarHBondContact OG1-O 3.04Å; T89-E115 PolarHBondContact OG1-OE2 2.96Å | ||
| 90 | S | 64.7 | Low | 62.2 | Low | 15 Ų | 15 | 72.6 Ų | 72.6 | 11% | 0.105 | 36% | 0.356 | C | S | . | . | trans | -61 | 144.7 | -176.3 | 63.7 | 0 | 0 | 0 | 0 | 113.7 | D88 P92 | D88-S90 VanDerWaalsContact CG-OG 3.31Å; D88-S90 WeakPolarHBondContact OD1-CB 3.26Å; D88-S90 PolarHBondContact OD1-N 3.18Å; D88-S90 PolarHBondContact OD1-OG 3.15Å; D88-S90 PolarHBondContact OD2-OG 3.37Å; S90-P92 WeakPolarHBondContact O-CD 3.39Å | ||
| 91 | D | 56.8 | Low | 60.5 | Low | 63 Ų | 63 | 74.1 Ų | 74.1 | 34% | 0.337 | 35% | 0.348 | S | S | . | . | trans | -68.1 | 121.1 | -178.9 | -174.1 | -6.2 | 0 | 0 | 0 | 111.8 | E93 R94 | D91-E93 VanDerWaalsContact C-N 3.26Å; D91-E93 PolarHBondContact O-N 3.18Å; D91-E93 PolarHBondContact OD1-N 2.62Å; D91-R94 PolarHBondContact O-N 3.05Å | ||
| 92 | P | 53.1 | Low | 58.6 | Low | 49 Ų | 49 | 79.5 Ų | 79.5 | 32% | 0.318 | 38% | 0.376 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.2 | -19.5 | 177 | 25.5 | -34.3 | 0 | 0 | 0 | 114.9 | S90 W95 | S90-P92 WeakPolarHBondContact O-CD 3.39Å; P92-W95 WeakPolarHBondContact O-CB 3.35Å; P92-W95 PolarHBondContact O-N 3.1Å |
| 93 | E | 52.8 | Low | 56.5 | Low | 106 Ų | 106 | 88.6 Ų | 88.6 | 50% | 0.495 | 40% | 0.401 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -70.6 | -38.4 | 175.9 | -70.4 | -107.2 | 145.7 | 0 | 0 | 111.6 | D91 W95 R96 | D91-E93 VanDerWaalsContact C-N 3.26Å; D91-E93 PolarHBondContact O-N 3.18Å; D91-E93 PolarHBondContact OD1-N 2.62Å; E93-W95 PolarHBondContact O-N 3.2Å; E93-W95 VanDerWaalsContact O-N 3.16Å; E93-R96 WeakPolarHBondContact O-CB 3.36Å; E93-R96 PolarHBondContact O-N 3.08Å; E93-R96 IonicContact OE1-CZ 3.94Å; E93-R96 IonicContact OE1-NH1 3.17Å; E93-R96 PolarHBondContact OE1-NH1 2.98Å; E93-R96 IonicContact OE1-NH2 3.86Å; E93-R96 PolarHBondContact OE1-NH2 3.32Å; E93-R96 IonicContact OE2-NH1 3.9Å |
| 94 | R | 48.4 | Very low | 54.7 | Low | 161 Ų | 161 | 90.7 Ų | 90.7 | 61% | 0.608 | 42% | 0.42 | S | S | * | . | H | α-helix | trans | -56.6 | -31.9 | 173.3 | -93.6 | -179.9 | 170.5 | 178 | -2.7 | 112.2 | D91 R96 D97 F98 | D91-R94 PolarHBondContact O-N 3.05Å; R94-R96 VanDerWaalsContact C-N 3.28Å; R94-R96 PolarHBondContact O-N 2.95Å; R94-D97 PolarHBondContact O-N 2.86Å; R94-F98 HydrophobicContact CB-CE2 4.45Å; R94-F98 WeakPolarHBondContact O-CD2 3.4Å; R94-F98 WeakPolarHBondContact O-CE2 3.42Å |
| 95 | W | 44.9 | Very low | 52.8 | Low | 128 Ų | 128 | 95.2 Ų | 95.2 | 49% | 0.485 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -64.6 | -26 | 176.3 | -113.3 | 65.2 | 0 | 0 | 0 | 114.1 | P92 E93 Y112 | P92-W95 WeakPolarHBondContact O-CB 3.35Å; P92-W95 PolarHBondContact O-N 3.1Å; E93-W95 PolarHBondContact O-N 3.2Å; E93-W95 VanDerWaalsContact O-N 3.16Å; W95-Y112 AromaticContact NE1-CZ 3.92Å; W95-Y112 PolarHBondContact NE1-OH 3.41Å |
| 96 | R | 44.5 | Very low | 50.4 | Low | 136 Ų | 136 | 105.4 Ų | 105.4 | 51% | 0.513 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -70.3 | -33.8 | 177.4 | -71 | -175.5 | -149.5 | 147.3 | 14.3 | 112 | E93 R94 F98 R99 | E93-R96 WeakPolarHBondContact O-CB 3.36Å; E93-R96 PolarHBondContact O-N 3.08Å; E93-R96 IonicContact OE1-CZ 3.94Å; E93-R96 IonicContact OE1-NH1 3.17Å; E93-R96 PolarHBondContact OE1-NH1 2.98Å; E93-R96 IonicContact OE1-NH2 3.86Å; E93-R96 PolarHBondContact OE1-NH2 3.32Å; E93-R96 IonicContact OE2-NH1 3.9Å; R94-R96 VanDerWaalsContact C-N 3.28Å; R94-R96 PolarHBondContact O-N 2.95Å; R96-F98 VanDerWaalsContact C-N 3.3Å; R96-F98 PolarHBondContact O-N 3.44Å; R96-R99 WeakPolarHBondContact O-CB 3.3Å; R96-R99 PolarHBondContact O-N 3.43Å |
| 97 | D | 45.9 | Very low | 48.1 | Very low | 129 Ų | 129 | 110.2 Ų | 110.2 | 69% | 0.69 | 50% | 0.504 | S | S | * | . | H | α-helix | trans | -70.1 | -30 | 179.9 | -66.7 | -23 | 0 | 0 | 0 | 111.9 | R94 | R94-D97 PolarHBondContact O-N 2.86Å |
| 98 | F | 45.4 | Very low | 46.3 | Very low | 97 Ų | 97 | 122.4 Ų | 122.4 | 43% | 0.425 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -80.8 | -13.1 | 177.4 | -62.2 | -69 | 0 | 0 | 0 | 114.2 | R94 R96 F100 N101 Y112 | R94-F98 HydrophobicContact CB-CE2 4.45Å; R94-F98 WeakPolarHBondContact O-CD2 3.4Å; R94-F98 WeakPolarHBondContact O-CE2 3.42Å; R96-F98 VanDerWaalsContact C-N 3.3Å; R96-F98 PolarHBondContact O-N 3.44Å; F98-F100 PolarHBondContact O-N 3.2Å; F98-N101 PolarHBondContact O-N 2.92Å; F98-Y112 HydrophobicContact CE2-CE2 4.26Å |
| 99 | R | 43.4 | Very low | 44.8 | Very low | 183 Ų | 183 | 126.8 Ų | 126.8 | 69% | 0.691 | 58% | 0.582 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -63 | -23.7 | -178.7 | -102.7 | -176.9 | 176.3 | 153.5 | 0.3 | 114.4 | R96 | R96-R99 WeakPolarHBondContact O-CB 3.3Å; R96-R99 PolarHBondContact O-N 3.43Å |
| 100 | F | 40.2 | Very low | 43 | Very low | 190 Ų | 190 | 131.6 Ų | 131.6 | 83% | 0.833 | 61% | 0.605 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -105.2 | -3.1 | -174.2 | -69.7 | -75.6 | 0 | 0 | 0 | 114.8 | F98 | F98-F100 PolarHBondContact O-N 3.2Š|
| 101 | N | 37.8 | Very low | 41.6 | Very low | 102 Ų | 102 | 137.3 Ų | 137.3 | 55% | 0.545 | 64% | 0.64 | S | S | . | * | trans | -117.4 | 62.6 | -172.7 | -130.9 | -17.9 | 0 | 0 | 0 | 112.3 | F98 R103 A104 | F98-N101 PolarHBondContact O-N 2.92Å; N101-R103 PolarHBondContact O-N 3.33Å; N101-A104 HydrophobicContact CB-CB 4.44Å; N101-A104 WeakPolarHBondContact O-CB 3.36Å; N101-A104 PolarHBondContact O-N 3.48Å | ||
| 102 | I | 37 | Very low | 40.7 | Very low | 133 Ų | 133 | 139.3 Ų | 139.3 | 68% | 0.682 | 64% | 0.644 | S | S | * | * | G | 310 helix | trans | -58.5 | -22.2 | -178.2 | -65.1 | 168.2 | 0 | 0 | 0 | 112.6 | A104 L105 | I102-A104 VanDerWaalsContact C-N 3.34Å; I102-L105 PolarHBondContact O-N 3.17Å |
| 103 | R | 37.8 | Very low | 40.4 | Very low | 232 Ų | 232 | 143.1 Ų | 143.1 | 88% | 0.875 | 66% | 0.657 | S | S | * | * | G | 310 helix | trans | -73.7 | -21.5 | 174.3 | -73.9 | -174 | 177.2 | 179.6 | -0.1 | 113.9 | N101 L105 | N101-R103 PolarHBondContact O-N 3.33Å; R103-L105 VanDerWaalsContact C-N 3.28Å |
| 104 | A | 41.1 | Very low | 40.4 | Very low | 64 Ų | 64 | 142.4 Ų | 142.4 | 53% | 0.529 | 65% | 0.654 | S | S | . | * | G | 310 helix | trans | -75.9 | -17.5 | 172.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | N101 I102 R106 | N101-A104 HydrophobicContact CB-CB 4.44Å; N101-A104 WeakPolarHBondContact O-CB 3.36Å; N101-A104 PolarHBondContact O-N 3.48Å; I102-A104 VanDerWaalsContact C-N 3.34Å; A104-R106 PolarHBondContact O-N 2.97Å |
| 105 | L | 41 | Very low | 41 | Very low | 124 Ų | 124 | 139.6 Ų | 139.6 | 65% | 0.649 | 65% | 0.648 | S | S | * | * | G | 310 helix | trans | -79.4 | 9.4 | 178.4 | -64.7 | 170.8 | 0 | 0 | 0 | 113.9 | I102 R103 | I102-L105 PolarHBondContact O-N 3.17Å; R103-L105 VanDerWaalsContact C-N 3.28Å |
| 106 | R | 30.7 | Very low | 42.2 | Very low | 230 Ų | 230 | 134.6 Ų | 134.6 | 87% | 0.868 | 63% | 0.63 | S | S | * | * | G | 310 helix | trans | -96.2 | 14.3 | 176.7 | -106.2 | -171.5 | -176 | -162 | 1.2 | 115 | A104 | A104-R106 PolarHBondContact O-N 2.97Š|
| 107 | L | 29.5 | Very low | 43.8 | Very low | 118 Ų | 118 | 129.6 Ų | 129.6 | 62% | 0.618 | 62% | 0.615 | S | S | * | * | trans | -126.4 | 110.3 | 163.3 | -101.4 | 84.8 | 0 | 0 | 0 | 108.3 | S109 L110 | L107-S109 PolarHBondContact O-N 3.25Å; L107-L110 HydrophobicContact CD2-CB 4.48Å; L107-L110 HydrophobicContact CD2-CD1 3.82Å | ||
| 108 | W | 36.2 | Very low | 45.6 | Very low | 257 Ų | 257 | 123.5 Ų | 123.5 | 97% | 0.973 | 58% | 0.582 | S | S | * | * | S | Bend | trans | -60.8 | 123 | 151.9 | -72.8 | 10 | 0 | 0 | 0 | 106.9 | ||
| 109 | S | 40.8 | Very low | 47.5 | Very low | 104 Ų | 104 | 118.9 Ų | 118.9 | 73% | 0.727 | 56% | 0.562 | S | S | * | * | S | Bend | trans | 67.2 | 110.9 | 175.7 | -170.8 | 0 | 0 | 0 | 0 | 116 | L107 | L107-S109 PolarHBondContact O-N 3.25Š|
| 110 | L | 30.6 | Very low | 49.7 | Very low | 142 Ų | 142 | 110.1 Ų | 110.1 | 74% | 0.743 | 53% | 0.529 | S | S | * | . | S | Bend | trans | -176.6 | -7.5 | 139.3 | -98.3 | 157.4 | 0 | 0 | 0 | 114.5 | L107 | L107-L110 HydrophobicContact CD2-CB 4.48Å; L107-L110 HydrophobicContact CD2-CD1 3.82Å |
| 111 | T | 35.7 | Very low | 51.9 | Low | 136 Ų | 136 | 101.5 Ų | 101.5 | 83% | 0.834 | 49% | 0.491 | S | S | * | . | S | Bend | trans | -144.4 | 7 | 178 | 56.3 | 0 | 0 | 0 | 0 | 115.9 | ||
| 112 | Y | 37.7 | Very low | 54.2 | Low | 105 Ų | 105 | 97.1 Ų | 97.1 | 41% | 0.412 | 47% | 0.468 | S | S | . | . | trans | -102.6 | 98.6 | 179.9 | -158.8 | -111.4 | 0 | 0 | 0 | 109.4 | W95 F98 E114 | W95-Y112 AromaticContact NE1-CZ 3.92Å; W95-Y112 PolarHBondContact NE1-OH 3.41Å; F98-Y112 HydrophobicContact CE2-CE2 4.26Å; Y112-E114 HydrophobicContact CD1-CG 3.48Å; Y112-E114 VanDerWaalsContact CD1-CG 3.48Å; Y112-E114 HydrophobicContact CE1-CG 3.63Å; Y112-E114 PolarHBondContact O-N 2.92Å; Y112-E114 VanDerWaalsContact O-N 3.17Å | ||
| 113 | E | 46.1 | Very low | 56.7 | Low | 128 Ų | 128 | 90.8 Ų | 90.8 | 60% | 0.598 | 44% | 0.436 | S | S | * | . | trans | -74.4 | 94.2 | 167.7 | -69.4 | 178.6 | 160.3 | 0 | 0 | 107.7 | E115 | E113-E115 PolarHBondContact O-N 2.91Š| ||
| 114 | E | 52.7 | Low | 59.2 | Low | 91 Ų | 91 | 79.8 Ų | 79.8 | 43% | 0.425 | 39% | 0.394 | S | S | . | . | trans | -69.5 | 109.7 | 163.9 | -60.1 | -174.4 | 164.3 | 0 | 0 | 107.3 | Y112 L116 | Y112-E114 HydrophobicContact CD1-CG 3.48Å; Y112-E114 VanDerWaalsContact CD1-CG 3.48Å; Y112-E114 HydrophobicContact CE1-CG 3.63Å; Y112-E114 PolarHBondContact O-N 2.92Å; Y112-E114 VanDerWaalsContact O-N 3.17Å; E114-L116 HydrophobicContact CB-CD1 4.34Å; E114-L116 HydrophobicContact CB-CG 3.87Å; E114-L116 PolarHBondContact O-N 2.86Å | ||
| 115 | E | 61.5 | Low | 61.4 | Low | 103 Ų | 103 | 78.8 Ų | 78.8 | 48% | 0.481 | 38% | 0.383 | S | S | . | . | trans | -74.4 | 63.9 | 171.1 | -67.8 | -173.7 | 178.4 | 0 | 0 | 110.1 | T89 E113 T117 | T89-E115 PolarHBondContact N-O 3.28Å; T89-E115 VanDerWaalsContact N-O 3.14Å; T89-E115 VanDerWaalsContact OG1-CB 3.28Å; T89-E115 WeakPolarHBondContact OG1-CB 3.46Å; T89-E115 PolarHBondContact OG1-O 3.04Å; T89-E115 PolarHBondContact OG1-OE2 2.96Å; E113-E115 PolarHBondContact O-N 2.91Å; E115-T117 PolarHBondContact O-N 2.98Å | ||
| 116 | L | 70.9 | Confident | 63.6 | Low | 23 Ų | 23 | 79 Ų | 79 | 12% | 0.12 | 38% | 0.375 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -76.3 | 118 | 171.8 | -62.4 | -179.4 | 0 | 0 | 0 | 108.7 | V28 V86 D88 E114 P146 G147 | V28-L116 HydrophobicContact CG2-CD2 3.88Å; V86-L116 HydrophobicContact CG1-CB 3.79Å; V86-L116 HydrophobicContact CG1-CD2 3.95Å; V86-L116 HydrophobicContact CG1-CG 4.31Å; D88-L116 HydrophobicContact CB-CD2 3.92Å; E114-L116 HydrophobicContact CB-CD1 4.34Å; E114-L116 HydrophobicContact CB-CG 3.87Å; E114-L116 PolarHBondContact O-N 2.86Å; L116-P146 HydrophobicContact CB-CB 3.83Å; L116-P146 HydrophobicContact CB-CG 4.3Å; L116-P146 HydrophobicContact CD1-CB 4.46Å; L116-G147 WeakPolarHBondContact O-CA 3.46Å; L116-G147 PolarHBondContact O-N 3.37Å |
| 117 | T | 76.8 | Confident | 66.4 | Low | 31 Ų | 31 | 69.1 Ų | 69.1 | 19% | 0.19 | 35% | 0.346 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -128.6 | 150.8 | -177.8 | 61.3 | 0 | 0 | 0 | 0 | 110.4 | W59 F87 E115 | W59-T117 WeakPolarHBondContact CH2-OG1 3.22Å; F87-T117 PolarHBondContact N-O 3.25Å; F87-T117 PolarHBondContact O-N 2.99Å; F87-T117 PolarHBondContact O-OG1 2.95Å; E115-T117 PolarHBondContact O-N 2.98Å |
| 118 | T | 85.4 | Confident | 69.4 | Low | 0 Ų | 0 | 65.8 Ų | 65.8 | 0% | 0 | 33% | 0.327 | C | S | . | . | trans | -108.5 | 162.1 | 170.3 | 77.4 | 0 | 0 | 0 | 0 | 110.3 | V86 L120 H121 V122 P146 | V86-T118 HydrophobicContact CG2-CG2 4.21Å; T118-L120 PolarHBondContact O-N 3.42Å; T118-L120 WeakPolarHBondContact OG1-CB 3.38Å; T118-L120 PolarHBondContact OG1-N 3.03Å; T118-H121 PolarHBondContact N-ND1 3.38Å; T118-H121 WeakPolarHBondContact O-CB 3.46Å; T118-H121 PolarHBondContact O-N 3.2Å; T118-H121 PolarHBondContact OG1-CE1 3.01Å; T118-H121 PolarHBondContact OG1-ND1 3.02Å; T118-V122 PolarHBondContact O-N 3.27Å; T118-P146 HydrophobicContact CG2-CG 3.71Å | ||
| 119 | P | 85.5 | Confident | 72.1 | Confident | 0 Ų | 0 | 55.1 Ų | 55.1 | 0% | 0 | 29% | 0.29 | C | S | . | . | H | α-helix | trans | -50.3 | -33.3 | 171.3 | -30.2 | 35.4 | 0 | 0 | 0 | 113.6 | F58 V62 S85 F87 V122 A123 L135 | F58-P119 HydrophobicContact CD1-CG 4.47Å; F58-P119 HydrophobicContact CE1-CB 4.17Å; F58-P119 HydrophobicContact CE1-CG 3.38Å; F58-P119 HydrophobicContact CZ-CB 4.13Å; F58-P119 HydrophobicContact CZ-CG 3.76Å; V62-P119 HydrophobicContact CG1-CB 4.21Å; V62-P119 HydrophobicContact CG2-CB 4.03Å; S85-P119 WeakPolarHBondContact O-CD 3.15Å; F87-P119 HydrophobicContact CE2-CG 4.13Å; P119-V122 PolarHBondContact O-N 3.37Å; P119-A123 WeakPolarHBondContact O-CB 3.28Å; P119-A123 PolarHBondContact O-N 2.94Å; P119-L135 HydrophobicContact CB-CD1 3.72Å; P119-L135 HydrophobicContact CB-CD2 4.13Å |
| 120 | L | 88.8 | Confident | 74.6 | Confident | 0 Ų | 0 | 55 Ų | 55 | 0% | 0 | 28% | 0.278 | C | S | . | . | H | α-helix | trans | -66.2 | -38.3 | 178 | -165.7 | 71.6 | 0 | 0 | 0 | 111.9 | T118 A124 L132 L135 L136 A140 A151 L167 | T118-L120 PolarHBondContact O-N 3.42Å; T118-L120 WeakPolarHBondContact OG1-CB 3.38Å; T118-L120 PolarHBondContact OG1-N 3.03Å; L120-A124 VanDerWaalsContact O-CB 3.24Å; L120-A124 WeakPolarHBondContact O-CB 3.46Å; L120-A124 PolarHBondContact O-N 2.97Å; L120-L132 HydrophobicContact CD1-CD1 3.78Å; L120-L132 HydrophobicContact CD1-CG 3.83Å; L120-L132 HydrophobicContact CG-CD1 4.29Å; L120-L135 HydrophobicContact CB-CD1 4.48Å; L120-L135 HydrophobicContact CD1-CB 4.08Å; L120-L135 HydrophobicContact CD1-CD1 4.33Å; L120-L136 HydrophobicContact CD1-CD2 4.08Å; L120-L136 HydrophobicContact CD1-CG 3.97Å; L120-L136 HydrophobicContact CD2-CD2 4.23Å; L120-A140 HydrophobicContact CD2-CB 4.49Å; L120-A151 HydrophobicContact CB-CB 4.36Å; L120-A151 HydrophobicContact CD2-CB 3.88Å; L120-A151 HydrophobicContact CG-CB 3.76Å; L120-L167 HydrophobicContact CD1-CD2 4.38Å; L120-L167 HydrophobicContact CD2-CD2 4.15Å; L120-L167 HydrophobicContact CG-CD2 4.33Å |
| 121 | H | 86.5 | Confident | 77.5 | Confident | 8 Ų | 8 | 48.3 Ų | 48.3 | 4% | 0.037 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -65.9 | -44.7 | 176.6 | -65.7 | 77.8 | 0 | 0 | 0 | 111.4 | T118 A124 S125 S144 R149 T150 A151 E154 | T118-H121 PolarHBondContact N-ND1 3.38Å; T118-H121 WeakPolarHBondContact O-CB 3.46Å; T118-H121 PolarHBondContact O-N 3.2Å; T118-H121 PolarHBondContact OG1-CE1 3.01Å; T118-H121 PolarHBondContact OG1-ND1 3.02Å; H121-A124 WeakPolarHBondContact O-CB 3.48Å; H121-A124 PolarHBondContact O-N 3.11Å; H121-S125 PolarHBondContact O-N 3.38Å; H121-S125 PolarHBondContact O-OG 3.02Å; H121-S144 PolarHBondContact CE1-O 3.35Å; H121-S144 PolarHBondContact NE2-O 2.74Å; H121-S144 VanDerWaalsContact NE2-O 3.14Å; H121-R149 PolarHBondContact CD2-O 2.99Å; H121-R149 PolarHBondContact NE2-O 3.35Å; H121-T150 VanDerWaalsContact CD2-C 3.46Å; H121-T150 VanDerWaalsContact NE2-C 3.28Å; H121-T150 WeakPolarHBondContact NE2-CA 3.22Å; H121-A151 PolarHBondContact CD2-N 3.26Å; H121-A151 PolarHBondContact NE2-N 3.48Å; H121-A151 VanDerWaalsContact NE2-N 3.17Å; H121-E154 HydrophobicContact CB-CG 4.41Å |
| 122 | V | 86.1 | Confident | 80.3 | Confident | 11 Ų | 11 | 41.9 Ų | 41.9 | 7% | 0.067 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -65.5 | -43.4 | 178.3 | 178.5 | 0 | 0 | 0 | 0 | 111.6 | W59 V62 L63 T118 P119 A124 S125 R126 | W59-V122 HydrophobicContact CH2-CG2 3.24Å; W59-V122 HydrophobicContact CZ2-CG2 3.97Å; W59-V122 HydrophobicContact CZ3-CG2 3.66Å; V62-V122 HydrophobicContact CG1-CB 3.88Å; V62-V122 HydrophobicContact CG1-CG1 3.87Å; L63-V122 HydrophobicContact CD2-CG1 3.67Å; L63-V122 HydrophobicContact CG-CG1 4.46Å; T118-V122 PolarHBondContact O-N 3.27Å; P119-V122 PolarHBondContact O-N 3.37Å; V122-A124 PolarHBondContact O-N 3.48Å; V122-S125 PolarHBondContact O-N 3.12Å; V122-S125 PolarHBondContact O-OG 3.45Å; V122-R126 WeakPolarHBondContact O-CB 3.43Å; V122-R126 PolarHBondContact O-N 3.06Å |
| 123 | A | 89.7 | Confident | 82.9 | Confident | 0 Ų | 0 | 40.9 Ų | 40.9 | 0% | 0 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -62.5 | -36.9 | 176 | 0 | 0 | 0 | 0 | 0 | 111.4 | P119 G127 H128 V131 L132 L135 | P119-A123 WeakPolarHBondContact O-CB 3.28Å; P119-A123 PolarHBondContact O-N 2.94Å; A123-G127 PolarHBondContact O-N 3.48Å; A123-H128 HydrophobicContact CB-CB 4.24Å; A123-H128 PolarHBondContact O-N 2.97Å; A123-V131 HydrophobicContact CB-CB 4.26Å; A123-V131 HydrophobicContact CB-CG1 3.99Å; A123-L132 HydrophobicContact CB-CB 4.15Å; A123-L132 HydrophobicContact CB-CD1 4.17Å; A123-L135 HydrophobicContact CB-CD1 4.43Å |
| 124 | A | 90 | Very high | 85.1 | Confident | 0 Ų | 0 | 35.9 Ų | 35.9 | 0% | 0 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -68.4 | -45.4 | 175.7 | 0 | 0 | 0 | 0 | 0 | 113 | L120 H121 V122 R126 G127 L132 A151 E154 A155 H160 L167 | L120-A124 VanDerWaalsContact O-CB 3.24Å; L120-A124 WeakPolarHBondContact O-CB 3.46Å; L120-A124 PolarHBondContact O-N 2.97Å; H121-A124 WeakPolarHBondContact O-CB 3.48Å; H121-A124 PolarHBondContact O-N 3.11Å; V122-A124 PolarHBondContact O-N 3.48Å; A124-R126 VanDerWaalsContact C-N 3.35Å; A124-R126 PolarHBondContact O-N 3.01Å; A124-G127 PolarHBondContact O-N 3.47Å; A124-L132 HydrophobicContact CB-CD1 3.86Å; A124-A151 HydrophobicContact CB-CB 3.99Å; A124-A151 WeakPolarHBondContact CB-O 3.35Å; A124-E154 HydrophobicContact CB-CB 4.33Å; A124-A155 HydrophobicContact CB-CB 4.1Å; A124-H160 PolarHBondContact O-CD2 3.14Å; A124-L167 HydrophobicContact CB-CD1 4.36Å |
| 125 | S | 88.1 | Confident | 86.9 | Confident | 43 Ų | 43 | 31.6 Ų | 31.6 | 30% | 0.301 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -70.6 | -28 | -178.1 | 73.4 | 0 | 0 | 0 | 0 | 113.6 | H121 V122 H160 | H121-S125 PolarHBondContact O-N 3.38Å; H121-S125 PolarHBondContact O-OG 3.02Å; V122-S125 PolarHBondContact O-N 3.12Å; V122-S125 PolarHBondContact O-OG 3.45Å; S125-H160 PolarHBondContact O-CD2 3.49Å; S125-H160 PolarHBondContact O-NE2 2.88Å |
| 126 | R | 86.8 | Confident | 88.4 | Confident | 128 Ų | 128 | 28 Ų | 28 | 48% | 0.483 | 14% | 0.14 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -96.7 | -4.9 | 178.8 | -64.8 | -170.3 | 173.2 | -163.6 | -6.7 | 114.7 | L63 V122 A124 | L63-R126 VanDerWaalsContact C-NH1 3.31Å; L63-R126 VanDerWaalsContact CB-NH1 3.27Å; L63-R126 PolarHBondContact O-NH1 3.2Å; V122-R126 WeakPolarHBondContact O-CB 3.43Å; V122-R126 PolarHBondContact O-N 3.06Å; A124-R126 VanDerWaalsContact C-N 3.35Å; A124-R126 PolarHBondContact O-N 3.01Å |
| 127 | G | 88.4 | Confident | 89.4 | Confident | 24 Ų | 24 | 37 Ų | 37 | 25% | 0.247 | 17% | 0.172 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 78.7 | 19 | 179 | 0 | 0 | 0 | 0 | 0 | 114.5 | A123 A124 T129 H160 | A123-G127 PolarHBondContact O-N 3.48Å; A124-G127 PolarHBondContact O-N 3.47Å; G127-T129 PolarHBondContact O-N 3.4Å; G127-H160 WeakPolarHBondContact CA-CD2 3.22Å; G127-H160 PolarHBondContact N-CD2 3.48Å; G127-H160 PolarHBondContact N-NE2 2.92Å |
| 128 | H | 92.6 | Very high | 89.9 | Confident | 48 Ų | 48 | 40.2 Ų | 40.2 | 22% | 0.222 | 18% | 0.181 | C | C | . | . | trans | -77.8 | 70.6 | -179 | -64 | -36.2 | 0 | 0 | 0 | 111.8 | V62 L63 G65 A123 E130 V131 L132 | V62-H128 PolarHBondContact O-CD2 3.07Å; V62-H128 VanDerWaalsContact O-CD2 3.24Å; L63-H128 PolarHBondContact O-NE2 2.98Å; G65-H128 PolarHBondContact N-NE2 3.49Å; A123-H128 HydrophobicContact CB-CB 4.24Å; A123-H128 PolarHBondContact O-N 2.97Å; H128-E130 VanDerWaalsContact C-N 3.32Å; H128-E130 PolarHBondContact O-N 3.33Å; H128-V131 HydrophobicContact CB-CB 4.06Å; H128-V131 HydrophobicContact CB-CG2 4.17Å; H128-V131 PolarHBondContact O-N 3.31Å; H128-L132 WeakPolarHBondContact O-CB 3.32Å; H128-L132 PolarHBondContact O-N 3.44Å | ||
| 129 | T | 93.9 | Very high | 90 | Very high | 32 Ų | 32 | 50.9 Ų | 50.9 | 20% | 0.196 | 22% | 0.221 | C | C | . | . | H | α-helix | trans | -55.7 | -39.2 | -173.6 | 56 | 0 | 0 | 0 | 0 | 114.3 | G127 L132 R133 A162 | G127-T129 PolarHBondContact O-N 3.4Å; T129-L132 WeakPolarHBondContact O-CB 3.49Å; T129-L132 PolarHBondContact O-N 2.91Å; T129-R133 WeakPolarHBondContact O-CG 3.41Å; T129-R133 PolarHBondContact O-N 3.08Å; T129-A162 HydrophobicContact CG2-CB 3.48Å; T129-A162 VanDerWaalsContact CG2-CB 3.48Å |
| 130 | E | 93.4 | Very high | 90.1 | Very high | 103 Ų | 103 | 51.2 Ų | 51.2 | 48% | 0.481 | 22% | 0.224 | S | C | . | . | H | α-helix | trans | -71.7 | -39.6 | -179.8 | -59.7 | -54.2 | 156.7 | 0 | 0 | 112.6 | V67 H128 L132 R133 L134 | V67-E130 HydrophobicContact CG2-CB 3.56Å; H128-E130 VanDerWaalsContact C-N 3.32Å; H128-E130 PolarHBondContact O-N 3.33Å; E130-L132 VanDerWaalsContact C-N 3.3Å; E130-R133 PolarHBondContact O-N 3.19Å; E130-R133 IonicContact OE1-CZ 3.26Å; E130-R133 IonicContact OE1-NH1 2.66Å; E130-R133 PolarHBondContact OE1-NH1 3.19Å; E130-R133 IonicContact OE2-CZ 3.98Å; E130-R133 IonicContact OE2-NH1 2.85Å; E130-R133 PolarHBondContact OE2-NH1 3.17Å; E130-L134 WeakPolarHBondContact O-CB 3.21Å; E130-L134 PolarHBondContact O-N 3.09Å |
| 131 | V | 91.8 | Very high | 90.1 | Very high | 1 Ų | 1 | 59.4 Ų | 59.4 | 1% | 0.006 | 26% | 0.255 | C | S | . | . | H | α-helix | trans | -61.9 | -44.2 | 172.7 | 175.8 | 0 | 0 | 0 | 0 | 109.4 | V67 V70 A123 H128 R133 L134 L135 | V67-V131 HydrophobicContact CG2-CG2 3.81Å; V70-V131 HydrophobicContact CG1-CG1 4.39Å; V70-V131 HydrophobicContact CG2-CG1 4.38Å; A123-V131 HydrophobicContact CB-CB 4.26Å; A123-V131 HydrophobicContact CB-CG1 3.99Å; H128-V131 HydrophobicContact CB-CB 4.06Å; H128-V131 HydrophobicContact CB-CG2 4.17Å; H128-V131 PolarHBondContact O-N 3.31Å; V131-R133 PolarHBondContact O-N 3.22Å; V131-L134 WeakPolarHBondContact O-CB 3.47Å; V131-L134 PolarHBondContact O-N 3.37Å; V131-L135 HydrophobicContact CG1-CD1 3.94Å; V131-L135 HydrophobicContact CG1-CG 4.33Å; V131-L135 VanDerWaalsContact O-CG 3.3Å; V131-L135 WeakPolarHBondContact O-CG 3.39Å; V131-L135 PolarHBondContact O-N 3.04Å |
| 132 | L | 93.1 | Very high | 90.2 | Very high | 0 Ų | 0 | 60.1 Ų | 60.1 | 0% | 0 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -60.1 | -46.4 | 177.7 | -167.8 | 115 | 0 | 0 | 0 | 111.9 | L120 A123 A124 H128 T129 E130 L134 L135 L136 V166 L167 | L120-L132 HydrophobicContact CD1-CD1 3.78Å; L120-L132 HydrophobicContact CD1-CG 3.83Å; L120-L132 HydrophobicContact CG-CD1 4.29Å; A123-L132 HydrophobicContact CB-CB 4.15Å; A123-L132 HydrophobicContact CB-CD1 4.17Å; A124-L132 HydrophobicContact CB-CD1 3.86Å; H128-L132 WeakPolarHBondContact O-CB 3.32Å; H128-L132 PolarHBondContact O-N 3.44Å; T129-L132 WeakPolarHBondContact O-CB 3.49Å; T129-L132 PolarHBondContact O-N 2.91Å; E130-L132 VanDerWaalsContact C-N 3.3Å; L132-L134 VanDerWaalsContact C-N 3.32Å; L132-L134 PolarHBondContact O-N 2.87Å; L132-L135 PolarHBondContact O-N 3.18Å; L132-L136 HydrophobicContact CD2-CD1 3.92Å; L132-L136 HydrophobicContact CG-CD1 4.21Å; L132-L136 VanDerWaalsContact O-CG 3.32Å; L132-L136 WeakPolarHBondContact O-CG 3.37Å; L132-L136 PolarHBondContact O-N 2.79Å; L132-V166 HydrophobicContact CD2-CB 3.71Å; L132-V166 HydrophobicContact CD2-CG1 3.51Å; L132-L167 HydrophobicContact CD1-CD1 4.43Å; L132-L167 HydrophobicContact CD1-CD2 4.14Å; L132-L167 HydrophobicContact CD1-CG 4.3Å; L132-L167 HydrophobicContact CD2-CD2 4.12Å; L132-L167 HydrophobicContact CD2-CG 3.91Å; L132-L167 HydrophobicContact CG-CD2 4.39Å |
| 133 | R | 93.7 | Very high | 90.3 | Very high | 84 Ų | 84 | 62.8 Ų | 62.8 | 32% | 0.317 | 27% | 0.274 | S | S | . | . | H | α-helix | trans | -60 | -41.1 | 174.2 | -75.2 | -176.1 | -163.6 | 122.1 | 5.6 | 112.3 | T129 E130 V131 R137 V166 | T129-R133 WeakPolarHBondContact O-CG 3.41Å; T129-R133 PolarHBondContact O-N 3.08Å; E130-R133 PolarHBondContact O-N 3.19Å; E130-R133 IonicContact OE1-CZ 3.26Å; E130-R133 IonicContact OE1-NH1 2.66Å; E130-R133 PolarHBondContact OE1-NH1 3.19Å; E130-R133 IonicContact OE2-CZ 3.98Å; E130-R133 IonicContact OE2-NH1 2.85Å; E130-R133 PolarHBondContact OE2-NH1 3.17Å; V131-R133 PolarHBondContact O-N 3.22Å; R133-R137 WeakPolarHBondContact O-CB 3.32Å; R133-R137 VanDerWaalsContact O-CG 3.32Å; R133-R137 WeakPolarHBondContact O-CG 3.27Å; R133-R137 PolarHBondContact O-N 3.34Å; R133-V166 HydrophobicContact CG-CG1 3.7Å; R133-V166 HydrophobicContact CG-CG2 4.06Å |
| 134 | L | 92.1 | Very high | 90 | Very high | 24 Ų | 24 | 64.2 Ų | 64.2 | 13% | 0.126 | 28% | 0.284 | C | S | . | . | H | α-helix | trans | -62.8 | -48.9 | 178.1 | -176.2 | 156.1 | 0 | 0 | 0 | 111 | V67 V70 L74 E130 V131 L132 L136 R137 R138 | V67-L134 HydrophobicContact CG1-CD1 3.72Å; V70-L134 HydrophobicContact CG1-CD2 3.85Å; L74-L134 HydrophobicContact CD1-CD2 3.75Å; E130-L134 WeakPolarHBondContact O-CB 3.21Å; E130-L134 PolarHBondContact O-N 3.09Å; V131-L134 WeakPolarHBondContact O-CB 3.47Å; V131-L134 PolarHBondContact O-N 3.37Å; L132-L134 VanDerWaalsContact C-N 3.32Å; L132-L134 PolarHBondContact O-N 2.87Å; L134-L136 VanDerWaalsContact C-N 3.34Å; L134-L136 PolarHBondContact O-N 3.47Å; L134-R137 PolarHBondContact O-N 3.32Å; L134-R138 HydrophobicContact CD2-CG 4.18Å; L134-R138 WeakPolarHBondContact O-CG 3.36Å; L134-R138 PolarHBondContact O-N 3.14Å |
| 135 | L | 90.8 | Very high | 89.7 | Confident | 0 Ų | 0 | 66.2 Ų | 66.2 | 0% | 0 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -59 | -45.3 | 179.5 | -69.2 | 170.8 | 0 | 0 | 0 | 111.3 | F58 L74 P83 P119 L120 A123 V131 L132 R138 R139 A140 | F58-L135 HydrophobicContact CZ-CD2 4.45Å; L74-L135 HydrophobicContact CD1-CD2 3.82Å; P83-L135 HydrophobicContact CB-CD2 3.83Å; P119-L135 HydrophobicContact CB-CD1 3.72Å; P119-L135 HydrophobicContact CB-CD2 4.13Å; L120-L135 HydrophobicContact CB-CD1 4.48Å; L120-L135 HydrophobicContact CD1-CB 4.08Å; L120-L135 HydrophobicContact CD1-CD1 4.33Å; A123-L135 HydrophobicContact CB-CD1 4.43Å; V131-L135 HydrophobicContact CG1-CD1 3.94Å; V131-L135 HydrophobicContact CG1-CG 4.33Å; V131-L135 VanDerWaalsContact O-CG 3.3Å; V131-L135 WeakPolarHBondContact O-CG 3.39Å; V131-L135 PolarHBondContact O-N 3.04Å; L132-L135 PolarHBondContact O-N 3.18Å; L135-R138 CarbonylContact O-C 3.46Å; L135-R138 WeakPolarHBondContact O-CA 3.26Å; L135-R138 PolarHBondContact O-N 3.46Å; L135-R138 VanDerWaalsContact O-N 3.09Å; L135-R139 PolarHBondContact O-N 3.43Å; L135-A140 HydrophobicContact CB-CB 4.1Å; L135-A140 WeakPolarHBondContact O-CB 3.49Å; L135-A140 PolarHBondContact O-N 2.98Å |
| 136 | L | 91.8 | Very high | 89 | Confident | 27 Ų | 27 | 66 Ų | 66 | 14% | 0.141 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -65 | -40.5 | 177.7 | -67.8 | 164.9 | 0 | 0 | 0 | 112.5 | L120 L132 L134 R138 R139 P142 V166 L167 A170 | L120-L136 HydrophobicContact CD1-CD2 4.08Å; L120-L136 HydrophobicContact CD1-CG 3.97Å; L120-L136 HydrophobicContact CD2-CD2 4.23Å; L132-L136 HydrophobicContact CD2-CD1 3.92Å; L132-L136 HydrophobicContact CG-CD1 4.21Å; L132-L136 VanDerWaalsContact O-CG 3.32Å; L132-L136 WeakPolarHBondContact O-CG 3.37Å; L132-L136 PolarHBondContact O-N 2.79Å; L134-L136 VanDerWaalsContact C-N 3.34Å; L134-L136 PolarHBondContact O-N 3.47Å; L136-R138 PolarHBondContact O-N 2.77Å; L136-R139 WeakPolarHBondContact O-CA 3.32Å; L136-R139 PolarHBondContact O-N 2.9Å; L136-P142 HydrophobicContact CD2-CB 4.24Å; L136-V166 HydrophobicContact CD1-CG1 3.63Å; L136-L167 HydrophobicContact CD1-CD2 4.3Å; L136-A170 HydrophobicContact CD1-CB 3.81Å; L136-A170 HydrophobicContact CD2-CB 3.95Å; L136-A170 HydrophobicContact CG-CB 4.31Å |
| 137 | R | 91.4 | Very high | 88.2 | Confident | 212 Ų | 212 | 60.9 Ų | 60.9 | 80% | 0.8 | 29% | 0.285 | S | S | * | . | H | α-helix | trans | -60.8 | -28.9 | 172.6 | -77.1 | 177.3 | -178.8 | 176.5 | 2.3 | 112.6 | R133 L134 R139 | R133-R137 WeakPolarHBondContact O-CB 3.32Å; R133-R137 VanDerWaalsContact O-CG 3.32Å; R133-R137 WeakPolarHBondContact O-CG 3.27Å; R133-R137 PolarHBondContact O-N 3.34Å; L134-R137 PolarHBondContact O-N 3.32Å; R137-R139 PolarHBondContact O-N 3.42Å |
| 138 | R | 88.4 | Confident | 87.7 | Confident | 100 Ų | 100 | 60.9 Ų | 60.9 | 38% | 0.377 | 29% | 0.285 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -84.6 | 16.3 | 173.4 | -62.7 | -60.3 | -166 | 84.6 | 6.6 | 113.3 | L74 P83 L134 L135 L136 | L74-R138 PolarHBondContact O-NH1 3.23Å; P83-R138 HydrophobicContact CB-CB 4.39Å; P83-R138 HydrophobicContact CG-CB 4.1Å; P83-R138 WeakPolarHBondContact CG-O 3.43Å; L134-R138 HydrophobicContact CD2-CG 4.18Å; L134-R138 WeakPolarHBondContact O-CG 3.36Å; L134-R138 PolarHBondContact O-N 3.14Å; L135-R138 CarbonylContact O-C 3.46Å; L135-R138 WeakPolarHBondContact O-CA 3.26Å; L135-R138 PolarHBondContact O-N 3.46Å; L135-R138 VanDerWaalsContact O-N 3.09Å; L136-R138 PolarHBondContact O-N 2.77Å |
| 139 | R | 87.2 | Confident | 87.3 | Confident | 224 Ų | 224 | 62.2 Ų | 62.2 | 85% | 0.845 | 29% | 0.288 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 66.3 | 32.1 | 178.9 | -53.2 | -176.5 | 175.3 | -135.9 | 0.5 | 114.3 | L135 L136 R137 | L135-R139 PolarHBondContact O-N 3.43Å; L136-R139 WeakPolarHBondContact O-CA 3.32Å; L136-R139 PolarHBondContact O-N 2.9Å; R137-R139 PolarHBondContact O-N 3.42Å |
| 140 | A | 87.7 | Confident | 87.2 | Confident | 6 Ų | 6 | 60.7 Ų | 60.7 | 5% | 0.05 | 28% | 0.279 | C | S | . | . | trans | -56.9 | 139.2 | 164.4 | 0 | 0 | 0 | 0 | 0 | 110.1 | P83 D84 L120 L135 P142 | P83-A140 HydrophobicContact CB-CB 4.05Å; D84-A140 WeakPolarHBondContact OD1-CA 3.43Å; L120-A140 HydrophobicContact CD2-CB 4.49Å; L135-A140 HydrophobicContact CB-CB 4.1Å; L135-A140 WeakPolarHBondContact O-CB 3.49Å; L135-A140 PolarHBondContact O-N 2.98Å; A140-P142 WeakPolarHBondContact O-CD 3.5Å | ||
| 141 | R | 88.4 | Confident | 87 | Confident | 173 Ų | 173 | 55.8 Ų | 55.8 | 65% | 0.653 | 26% | 0.256 | S | S | * | . | trans | -80.3 | 117.1 | 177.6 | -67.6 | 179.5 | -175.1 | -162.4 | -1.7 | 110.1 | D84 D143 S144 | D84-R141 PolarHBondContact OD1-N 3.01Å; R141-D143 VanDerWaalsContact C-N 3.31Å; R141-D143 PolarHBondContact O-N 2.91Å; R141-S144 WeakPolarHBondContact O-CB 3.18Å; R141-S144 PolarHBondContact O-N 3.31Å | ||
| 142 | P | 88.3 | Confident | 87.1 | Confident | 22 Ų | 22 | 55.8 Ų | 55.8 | 14% | 0.143 | 26% | 0.255 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -66.2 | -33.3 | -178.4 | 25.7 | -32.9 | 0 | 0 | 0 | 113 | L136 A140 S144 A172 | L136-P142 HydrophobicContact CD2-CB 4.24Å; A140-P142 WeakPolarHBondContact O-CD 3.5Å; P142-S144 VanDerWaalsContact C-N 3.32Å; P142-S144 PolarHBondContact O-N 2.97Å; P142-A172 HydrophobicContact CB-CB 3.88Å |
| 143 | D | 88.8 | Confident | 87 | Confident | 68 Ų | 68 | 55.8 Ų | 55.8 | 36% | 0.364 | 26% | 0.256 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.3 | 12.3 | -177.8 | -57.2 | -35.5 | 0 | 0 | 0 | 113.5 | R141 A145 A172 D173 I176 | R141-D143 VanDerWaalsContact C-N 3.31Å; R141-D143 PolarHBondContact O-N 2.91Å; D143-A145 PolarHBondContact O-N 3.33Å; D143-A172 VanDerWaalsContact OD1-CA 3.3Å; D143-A172 WeakPolarHBondContact OD1-CA 3.36Å; D143-D173 PolarHBondContact OD1-N 2.89Å; D143-I176 HydrophobicContact CB-CD1 3.64Å |
| 144 | S | 83.9 | Confident | 86.8 | Confident | 30 Ų | 30 | 54.1 Ų | 54.1 | 21% | 0.21 | 25% | 0.251 | C | S | . | . | trans | -65.8 | 126.7 | 173.7 | -168.1 | 0 | 0 | 0 | 0 | 109.3 | H121 R141 P142 | H121-S144 PolarHBondContact CE1-O 3.35Å; H121-S144 PolarHBondContact NE2-O 2.74Å; H121-S144 VanDerWaalsContact NE2-O 3.14Å; R141-S144 WeakPolarHBondContact O-CB 3.18Å; R141-S144 PolarHBondContact O-N 3.31Å; P142-S144 VanDerWaalsContact C-N 3.32Å; P142-S144 PolarHBondContact O-N 2.97Å | ||
| 145 | A | 82.5 | Confident | 86.8 | Confident | 41 Ų | 41 | 53 Ų | 53 | 34% | 0.339 | 25% | 0.245 | S | C | . | . | trans | -133.2 | 67.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 111.2 | D143 G147 G148 R149 T150 | D143-A145 PolarHBondContact O-N 3.33Å; A145-G147 VanDerWaalsContact C-N 3.32Å; A145-G147 PolarHBondContact O-N 2.93Å; A145-G148 PolarHBondContact O-N 3.39Å; A145-R149 VanDerWaalsContact CA-O 3.22Å; A145-R149 WeakPolarHBondContact CA-O 3.24Å; A145-R149 WeakPolarHBondContact CB-O 3.47Å; A145-T150 HydrophobicContact CB-CG2 3.88Å | ||
| 146 | P | 73.2 | Confident | 86.9 | Confident | 39 Ų | 39 | 53 Ų | 53 | 25% | 0.253 | 25% | 0.245 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -67.4 | -32.5 | -174.7 | 29.7 | -35.1 | 0 | 0 | 0 | 112.6 | V86 L116 T118 | V86-P146 HydrophobicContact CG1-CB 3.93Å; V86-P146 HydrophobicContact CG1-CG 4.2Å; V86-P146 HydrophobicContact CG2-CB 4.08Å; V86-P146 HydrophobicContact CG2-CG 4.3Å; L116-P146 HydrophobicContact CB-CB 3.83Å; L116-P146 HydrophobicContact CB-CG 4.3Å; L116-P146 HydrophobicContact CD1-CB 4.46Å; T118-P146 HydrophobicContact CG2-CG 3.71Å |
| 147 | G | 70.3 | Confident | 86.8 | Confident | 20 Ų | 20 | 53.7 Ų | 53.7 | 21% | 0.206 | 26% | 0.255 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -101.1 | 29.3 | 173.2 | 0 | 0 | 0 | 0 | 0 | 112.9 | L116 A145 R149 Q179 | L116-G147 WeakPolarHBondContact O-CA 3.46Å; L116-G147 PolarHBondContact O-N 3.37Å; A145-G147 VanDerWaalsContact C-N 3.32Å; A145-G147 PolarHBondContact O-N 2.93Å; G147-R149 PolarHBondContact O-N 3.45Å; G147-Q179 PolarHBondContact O-OE1 3.5Å |
| 148 | G | 78.9 | Confident | 86.6 | Confident | 24 Ų | 24 | 45.3 Ų | 45.3 | 25% | 0.247 | 23% | 0.231 | C | C | . | . | S | Bend | trans | 76.8 | -11.2 | 176.9 | 0 | 0 | 0 | 0 | 0 | 116.1 | A145 D178 Q179 | A145-G148 PolarHBondContact O-N 3.39Å; G148-D178 CarbonylContact O-C 3.43Å; G148-D178 WeakPolarHBondContact O-CA 3.38Å; G148-D178 WeakPolarHBondContact O-CB 3.48Å; G148-Q179 PolarHBondContact O-N 3.26Å; G148-Q179 VanDerWaalsContact O-N 3.08Å |
| 149 | R | 84.8 | Confident | 86.6 | Confident | 76 Ų | 76 | 41 Ų | 41 | 29% | 0.287 | 22% | 0.217 | S | C | . | . | trans | -110.7 | 146.3 | 169.4 | -77.1 | 178.5 | 177.5 | 159.8 | 12.4 | 110.9 | H121 A145 G147 H153 E154 D178 D180 | H121-R149 PolarHBondContact CD2-O 2.99Å; H121-R149 PolarHBondContact NE2-O 3.35Å; A145-R149 VanDerWaalsContact CA-O 3.22Å; A145-R149 WeakPolarHBondContact CA-O 3.24Å; A145-R149 WeakPolarHBondContact CB-O 3.47Å; G147-R149 PolarHBondContact O-N 3.45Å; R149-H153 HydrophobicContact CB-CB 4.16Å; R149-H153 HydrophobicContact CG-CB 4.28Å; R149-E154 WeakPolarHBondContact CD-OE1 3.34Å; R149-D178 HydrophobicContact CG-CB 3.66Å; R149-D178 IonicContact CZ-OD2 3.52Å; R149-D178 IonicContact NE-OD2 2.65Å; R149-D178 PolarHBondContact NE-OD2 3.23Å; R149-D178 VanDerWaalsContact NE-OD2 3.17Å; R149-D178 IonicContact NH2-OD2 3.9Å; R149-D180 IonicContact NH2-OD2 3.31Å | ||
| 150 | T | 90.4 | Very high | 86.8 | Confident | 1 Ų | 1 | 33.3 Ų | 33.3 | 1% | 0.006 | 19% | 0.191 | C | C | . | . | trans | -88.9 | 163.9 | 169.7 | 69.3 | 0 | 0 | 0 | 0 | 111 | H121 A145 L152 H153 E154 I176 | H121-T150 VanDerWaalsContact CD2-C 3.46Å; H121-T150 VanDerWaalsContact NE2-C 3.28Å; H121-T150 WeakPolarHBondContact NE2-CA 3.22Å; A145-T150 HydrophobicContact CB-CG2 3.88Å; T150-L152 PolarHBondContact O-N 3.48Å; T150-L152 VanDerWaalsContact O-N 3.12Å; T150-L152 PolarHBondContact OG1-N 3.34Å; T150-H153 PolarHBondContact N-ND1 3.02Å; T150-H153 WeakPolarHBondContact O-CB 3.41Å; T150-H153 PolarHBondContact O-N 3.3Å; T150-H153 PolarHBondContact OG1-N 3.08Å; T150-H153 PolarHBondContact OG1-ND1 2.99Å; T150-E154 PolarHBondContact O-N 2.95Å; T150-I176 HydrophobicContact CG2-CB 4.39Å; T150-I176 HydrophobicContact CG2-CD1 4.11Å; T150-I176 HydrophobicContact CG2-CG2 3.88Å | ||
| 151 | A | 90.2 | Very high | 87.1 | Confident | 0 Ų | 0 | 35.3 Ų | 35.3 | 0% | 0 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -57.7 | -27.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | L120 H121 A124 E154 A155 L167 | L120-A151 HydrophobicContact CB-CB 4.36Å; L120-A151 HydrophobicContact CD2-CB 3.88Å; L120-A151 HydrophobicContact CG-CB 3.76Å; H121-A151 PolarHBondContact CD2-N 3.26Å; H121-A151 PolarHBondContact NE2-N 3.48Å; H121-A151 VanDerWaalsContact NE2-N 3.17Å; A124-A151 HydrophobicContact CB-CB 3.99Å; A124-A151 WeakPolarHBondContact CB-O 3.35Å; A151-E154 PolarHBondContact O-N 3.49Å; A151-A155 PolarHBondContact O-N 3.03Å; A151-L167 HydrophobicContact CB-CD1 4.08Å; A151-L167 HydrophobicContact CB-CD2 4.13Å; A151-L167 WeakPolarHBondContact O-CD1 3.27Å |
| 152 | L | 93.9 | Very high | 87.4 | Confident | 0 Ų | 0 | 29.2 Ų | 29.2 | 0% | 0 | 19% | 0.19 | C | C | . | . | H | α-helix | trans | -68.6 | -37.9 | 176 | -173.7 | 64.3 | 0 | 0 | 0 | 112 | T150 A155 C156 V164 L167 L168 A172 P174 P184 L200 | T150-L152 PolarHBondContact O-N 3.48Å; T150-L152 VanDerWaalsContact O-N 3.12Å; T150-L152 PolarHBondContact OG1-N 3.34Å; L152-A155 PolarHBondContact O-N 2.91Å; L152-C156 WeakPolarHBondContact O-CB 3.28Å; L152-C156 PolarHBondContact O-N 3.1Å; L152-C156 PolarHBondContact O-SG 3.23Å; L152-V164 HydrophobicContact CD1-CB 4.4Å; L152-V164 HydrophobicContact CD1-CG1 4.03Å; L152-V164 HydrophobicContact CD1-CG2 4.37Å; L152-L167 HydrophobicContact CB-CD1 4.26Å; L152-L167 HydrophobicContact CD1-CB 4.13Å; L152-L167 HydrophobicContact CD1-CD1 4.26Å; L152-L168 HydrophobicContact CD1-CD2 4.27Å; L152-L168 HydrophobicContact CD1-CG 4.2Å; L152-L168 HydrophobicContact CD2-CD2 3.9Å; L152-A172 HydrophobicContact CD2-CB 4.31Å; L152-P174 HydrophobicContact CD2-CB 4.32Å; L152-P184 HydrophobicContact CD2-CB 4.24Å; L152-P184 HydrophobicContact CD2-CG 3.9Å; L152-P184 HydrophobicContact CG-CB 4.15Å; L152-P184 HydrophobicContact CG-CG 4.12Å; L152-L200 HydrophobicContact CD1-CD2 4.27Å; L152-L200 HydrophobicContact CD2-CD2 3.98Å; L152-L200 HydrophobicContact CG-CD2 4.31Å |
| 153 | H | 91.1 | Very high | 87.7 | Confident | 1 Ų | 1 | 28.2 Ų | 28.2 | 1% | 0.005 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -60.5 | -47.3 | 174.3 | -69.4 | 93.8 | 0 | 0 | 0 | 110.9 | R149 T150 C156 A157 I176 K182 P184 L187 | R149-H153 HydrophobicContact CB-CB 4.16Å; R149-H153 HydrophobicContact CG-CB 4.28Å; T150-H153 PolarHBondContact N-ND1 3.02Å; T150-H153 WeakPolarHBondContact O-CB 3.41Å; T150-H153 PolarHBondContact O-N 3.3Å; T150-H153 PolarHBondContact OG1-N 3.08Å; T150-H153 PolarHBondContact OG1-ND1 2.99Å; H153-C156 PolarHBondContact O-N 2.94Å; H153-A157 WeakPolarHBondContact O-CB 3.36Å; H153-A157 PolarHBondContact O-N 3.02Å; H153-I176 PolarHBondContact CE1-O 3.4Å; H153-I176 PolarHBondContact NE2-O 3.23Å; H153-I176 VanDerWaalsContact NE2-O 3.09Å; H153-K182 PolarHBondContact NE2-O 3.37Å; H153-P184 VanDerWaalsContact NE2-CD 3.28Å; H153-P184 WeakPolarHBondContact NE2-CD 3.47Å; H153-L187 HydrophobicContact CB-CD1 3.66Å; H153-L187 VanDerWaalsContact CD2-CD1 3.49Å; H153-L187 WeakPolarHBondContact CD2-CD1 3.3Å |
| 154 | E | 89.3 | Confident | 88 | Confident | 49 Ų | 49 | 25 Ų | 25 | 23% | 0.229 | 17% | 0.165 | C | C | . | . | H | α-helix | trans | -61.8 | -45 | 178.8 | -64 | -57.6 | 151.9 | 0 | 0 | 112.4 | H121 A124 R149 T150 A151 C156 A157 A158 | H121-E154 HydrophobicContact CB-CG 4.41Å; A124-E154 HydrophobicContact CB-CB 4.33Å; R149-E154 WeakPolarHBondContact CD-OE1 3.34Å; T150-E154 PolarHBondContact O-N 2.95Å; A151-E154 PolarHBondContact O-N 3.49Å; E154-C156 VanDerWaalsContact C-N 3.3Å; E154-C156 PolarHBondContact O-N 3.24Å; E154-A157 PolarHBondContact O-N 3.11Å; E154-A158 WeakPolarHBondContact O-CB 3.45Å; E154-A158 PolarHBondContact O-N 3.35Å |
| 155 | A | 92.1 | Very high | 88.6 | Confident | 0 Ų | 0 | 27.6 Ų | 27.6 | 0% | 0 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -62.8 | -37.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 112.5 | A124 A151 L152 G159 H160 C163 V164 L167 | A124-A155 HydrophobicContact CB-CB 4.1Å; A151-A155 PolarHBondContact O-N 3.03Å; L152-A155 PolarHBondContact O-N 2.91Å; A155-G159 PolarHBondContact O-N 3.44Å; A155-G159 VanDerWaalsContact O-N 3.11Å; A155-H160 PolarHBondContact O-N 3.39Å; A155-C163 HydrophobicContact CB-CB 3.91Å; A155-V164 HydrophobicContact CB-CG2 3.69Å; A155-L167 HydrophobicContact CB-CD1 4.18Å |
| 156 | C | 92.2 | Very high | 89.2 | Confident | 0 Ų | 0 | 26.5 Ų | 26.5 | 0% | 0 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -71.5 | -42 | 178 | -67.8 | 0 | 0 | 0 | 0 | 112 | L152 H153 E154 A158 G159 | L152-C156 WeakPolarHBondContact O-CB 3.28Å; L152-C156 PolarHBondContact O-N 3.1Å; L152-C156 PolarHBondContact O-SG 3.23Å; H153-C156 PolarHBondContact O-N 2.94Å; E154-C156 VanDerWaalsContact C-N 3.3Å; E154-C156 PolarHBondContact O-N 3.24Å; C156-A158 VanDerWaalsContact C-N 3.29Å; C156-A158 PolarHBondContact O-N 3.44Å; C156-G159 PolarHBondContact O-N 3.4Å |
| 157 | A | 89.5 | Confident | 90.2 | Very high | 42 Ų | 42 | 24.6 Ų | 24.6 | 35% | 0.347 | 15% | 0.151 | S | C | . | . | H | α-helix | trans | -63.1 | -35.1 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.7 | H153 E154 L187 | H153-A157 WeakPolarHBondContact O-CB 3.36Å; H153-A157 PolarHBondContact O-N 3.02Å; E154-A157 PolarHBondContact O-N 3.11Å; A157-L187 WeakPolarHBondContact CA-O 3.49Å; A157-L187 HydrophobicContact CB-CB 4.41Å |
| 158 | A | 87.1 | Confident | 91.4 | Very high | 36 Ų | 36 | 24 Ų | 24 | 30% | 0.298 | 14% | 0.143 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -86.2 | -9.1 | 177.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | E154 C156 H160 | E154-A158 WeakPolarHBondContact O-CB 3.45Å; E154-A158 PolarHBondContact O-N 3.35Å; C156-A158 VanDerWaalsContact C-N 3.29Å; C156-A158 PolarHBondContact O-N 3.44Å; A158-H160 VanDerWaalsContact CB-CD2 3.45Å; A158-H160 WeakPolarHBondContact CB-CD2 3.34Å |
| 159 | G | 88.9 | Confident | 92.2 | Very high | 8 Ų | 8 | 27.4 Ų | 27.4 | 8% | 0.082 | 16% | 0.159 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 73.5 | 22.1 | -178.5 | 0 | 0 | 0 | 0 | 0 | 114.6 | A155 C156 T161 P191 | A155-G159 PolarHBondContact O-N 3.44Å; A155-G159 VanDerWaalsContact O-N 3.11Å; C156-G159 PolarHBondContact O-N 3.4Å; G159-T161 PolarHBondContact O-N 3.18Å; G159-T161 VanDerWaalsContact O-N 3.08Å; G159-P191 WeakPolarHBondContact CA-O 3.3Å |
| 160 | H | 92.1 | Very high | 92.6 | Very high | 63 Ų | 63 | 26 Ų | 26 | 29% | 0.292 | 16% | 0.163 | S | C | . | . | trans | -85.9 | 79.7 | -176.2 | -66.7 | -32.1 | 0 | 0 | 0 | 112.4 | A124 S125 G127 A155 A158 A162 C163 V164 | A124-H160 PolarHBondContact O-CD2 3.14Å; S125-H160 PolarHBondContact O-CD2 3.49Å; S125-H160 PolarHBondContact O-NE2 2.88Å; G127-H160 WeakPolarHBondContact CA-CD2 3.22Å; G127-H160 PolarHBondContact N-CD2 3.48Å; G127-H160 PolarHBondContact N-NE2 2.92Å; A155-H160 PolarHBondContact O-N 3.39Å; A158-H160 VanDerWaalsContact CB-CD2 3.45Å; A158-H160 WeakPolarHBondContact CB-CD2 3.34Å; H160-A162 VanDerWaalsContact C-N 3.3Å; H160-A162 PolarHBondContact O-N 3.05Å; H160-C163 HydrophobicContact CB-CB 4.07Å; H160-C163 WeakPolarHBondContact O-CB 3.41Å; H160-C163 PolarHBondContact O-N 3.24Å; H160-V164 PolarHBondContact O-N 2.97Å | ||
| 161 | T | 93.6 | Very high | 92.6 | Very high | 49 Ų | 49 | 28.4 Ų | 28.4 | 30% | 0.301 | 19% | 0.189 | S | C | . | . | H | α-helix | trans | -50.8 | -42.9 | -176.2 | 60.9 | 0 | 0 | 0 | 0 | 114 | G159 C163 V164 H165 G192 E195 | G159-T161 PolarHBondContact O-N 3.18Å; G159-T161 VanDerWaalsContact O-N 3.08Å; T161-C163 PolarHBondContact O-N 3.38Å; T161-V164 PolarHBondContact O-N 3.06Å; T161-H165 PolarHBondContact O-N 3.37Å; T161-G192 WeakPolarHBondContact CG2-O 3.35Å; T161-E195 HydrophobicContact CG2-CB 3.66Å |
| 162 | A | 94.3 | Very high | 92.8 | Very high | 45 Ų | 45 | 28.7 Ų | 28.7 | 37% | 0.372 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -67.1 | -35.2 | 179.4 | 0 | 0 | 0 | 0 | 0 | 112.5 | T129 H160 V166 | T129-A162 HydrophobicContact CG2-CB 3.48Å; T129-A162 VanDerWaalsContact CG2-CB 3.48Å; H160-A162 VanDerWaalsContact C-N 3.3Å; H160-A162 PolarHBondContact O-N 3.05Å; A162-V166 VanDerWaalsContact O-CG2 3.32Å; A162-V166 WeakPolarHBondContact O-CG2 3.07Å; A162-V166 PolarHBondContact O-N 3.24Å |
| 163 | C | 94.3 | Very high | 92.8 | Very high | 0 Ų | 0 | 32 Ų | 32 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -69 | -44.6 | 173.4 | -70.9 | 0 | 0 | 0 | 0 | 110.9 | A155 H160 T161 H165 V166 L167 | A155-C163 HydrophobicContact CB-CB 3.91Å; H160-C163 HydrophobicContact CB-CB 4.07Å; H160-C163 WeakPolarHBondContact O-CB 3.41Å; H160-C163 PolarHBondContact O-N 3.24Å; T161-C163 PolarHBondContact O-N 3.38Å; C163-H165 VanDerWaalsContact C-N 3.33Å; C163-H165 PolarHBondContact O-N 2.9Å; C163-V166 PolarHBondContact O-N 3.4Å; C163-L167 WeakPolarHBondContact O-CG 2.97Å; C163-L167 PolarHBondContact O-N 3.32Å |
| 164 | V | 95.2 | Very high | 93 | Very high | 0 Ų | 0 | 32.5 Ų | 32.5 | 0% | 0 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -54.9 | -49.2 | 175 | 171.8 | 0 | 0 | 0 | 0 | 110.6 | L152 A155 H160 T161 V166 L167 L168 L199 L200 | L152-V164 HydrophobicContact CD1-CB 4.4Å; L152-V164 HydrophobicContact CD1-CG1 4.03Å; L152-V164 HydrophobicContact CD1-CG2 4.37Å; A155-V164 HydrophobicContact CB-CG2 3.69Å; H160-V164 PolarHBondContact O-N 2.97Å; T161-V164 PolarHBondContact O-N 3.06Å; V164-V166 PolarHBondContact O-N 2.9Å; V164-L167 PolarHBondContact O-N 3.45Å; V164-L168 HydrophobicContact CG1-CD1 3.66Å; V164-L168 HydrophobicContact CG1-CG 4.34Å; V164-L168 WeakPolarHBondContact O-CB 3.47Å; V164-L168 VanDerWaalsContact O-CG 3.28Å; V164-L168 WeakPolarHBondContact O-CG 3.48Å; V164-L168 PolarHBondContact O-N 3.08Å; V164-L199 HydrophobicContact CG1-CB 4.23Å; V164-L199 HydrophobicContact CG1-CD1 4.3Å; V164-L200 HydrophobicContact CG1-CD2 4.5Å |
| 165 | H | 96.1 | Very high | 93.2 | Very high | 86 Ų | 86 | 31.7 Ų | 31.7 | 40% | 0.398 | 21% | 0.209 | S | C | . | . | H | α-helix | trans | -58.6 | -46.1 | 178.4 | -176.5 | -91.4 | 0 | 0 | 0 | 112.5 | T161 C163 L168 V169 L199 | T161-H165 PolarHBondContact O-N 3.37Å; C163-H165 VanDerWaalsContact C-N 3.33Å; C163-H165 PolarHBondContact O-N 2.9Å; H165-L168 PolarHBondContact O-N 2.82Å; H165-V169 WeakPolarHBondContact O-CB 3.22Å; H165-V169 VanDerWaalsContact O-CG2 3.27Å; H165-V169 WeakPolarHBondContact O-CG2 3.34Å; H165-V169 PolarHBondContact O-N 3.29Å; H165-L199 HydrophobicContact CB-CD1 3.88Å |
| 166 | V | 95.9 | Very high | 93 | Very high | 17 Ų | 17 | 33.9 Ų | 33.9 | 10% | 0.103 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -65.8 | -40.6 | -179.5 | 173.8 | 0 | 0 | 0 | 0 | 111.6 | L132 R133 L136 A162 C163 V164 A170 | L132-V166 HydrophobicContact CD2-CB 3.71Å; L132-V166 HydrophobicContact CD2-CG1 3.51Å; R133-V166 HydrophobicContact CG-CG1 3.7Å; R133-V166 HydrophobicContact CG-CG2 4.06Å; L136-V166 HydrophobicContact CD1-CG1 3.63Å; A162-V166 VanDerWaalsContact O-CG2 3.32Å; A162-V166 WeakPolarHBondContact O-CG2 3.07Å; A162-V166 PolarHBondContact O-N 3.24Å; C163-V166 PolarHBondContact O-N 3.4Å; V164-V166 PolarHBondContact O-N 2.9Å; V166-A170 WeakPolarHBondContact O-CB 3.43Å; V166-A170 PolarHBondContact O-N 3.07Å |
| 167 | L | 95.1 | Very high | 92.9 | Very high | 0 Ų | 0 | 35.2 Ų | 35.2 | 0% | 0 | 23% | 0.232 | C | C | . | . | H | α-helix | trans | -63.9 | -45.6 | 177.6 | -72.8 | 169.1 | 0 | 0 | 0 | 111.8 | L120 A124 L132 L136 A151 L152 A155 C163 V164 A170 G171 A172 | L120-L167 HydrophobicContact CD1-CD2 4.38Å; L120-L167 HydrophobicContact CD2-CD2 4.15Å; L120-L167 HydrophobicContact CG-CD2 4.33Å; A124-L167 HydrophobicContact CB-CD1 4.36Å; L132-L167 HydrophobicContact CD1-CD1 4.43Å; L132-L167 HydrophobicContact CD1-CD2 4.14Å; L132-L167 HydrophobicContact CD1-CG 4.3Å; L132-L167 HydrophobicContact CD2-CD2 4.12Å; L132-L167 HydrophobicContact CD2-CG 3.91Å; L132-L167 HydrophobicContact CG-CD2 4.39Å; L136-L167 HydrophobicContact CD1-CD2 4.3Å; A151-L167 HydrophobicContact CB-CD1 4.08Å; A151-L167 HydrophobicContact CB-CD2 4.13Å; A151-L167 WeakPolarHBondContact O-CD1 3.27Å; L152-L167 HydrophobicContact CB-CD1 4.26Å; L152-L167 HydrophobicContact CD1-CB 4.13Å; L152-L167 HydrophobicContact CD1-CD1 4.26Å; A155-L167 HydrophobicContact CB-CD1 4.18Å; C163-L167 WeakPolarHBondContact O-CG 2.97Å; C163-L167 PolarHBondContact O-N 3.32Å; V164-L167 PolarHBondContact O-N 3.45Å; L167-A170 CarbonylContact O-C 3.54Å; L167-A170 PolarHBondContact O-N 3.45Å; L167-A170 VanDerWaalsContact O-N 3.17Å; L167-G171 PolarHBondContact O-N 3.35Å; L167-A172 HydrophobicContact CB-CB 4.13Å; L167-A172 WeakPolarHBondContact O-CB 3.47Å; L167-A172 PolarHBondContact O-N 3.04Å |
| 168 | L | 95.5 | Very high | 92.6 | Very high | 7 Ų | 7 | 33.6 Ų | 33.6 | 4% | 0.037 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -64.8 | -41.9 | 178.8 | -68.4 | 170.9 | 0 | 0 | 0 | 112.1 | L152 V164 H165 A170 G171 P174 L199 L200 F203 | L152-L168 HydrophobicContact CD1-CD2 4.27Å; L152-L168 HydrophobicContact CD1-CG 4.2Å; L152-L168 HydrophobicContact CD2-CD2 3.9Å; V164-L168 HydrophobicContact CG1-CD1 3.66Å; V164-L168 HydrophobicContact CG1-CG 4.34Å; V164-L168 WeakPolarHBondContact O-CB 3.47Å; V164-L168 VanDerWaalsContact O-CG 3.28Å; V164-L168 WeakPolarHBondContact O-CG 3.48Å; V164-L168 PolarHBondContact O-N 3.08Å; H165-L168 PolarHBondContact O-N 2.82Å; L168-A170 PolarHBondContact O-N 3.39Å; L168-G171 PolarHBondContact O-N 2.9Å; L168-P174 HydrophobicContact CD2-CB 4.01Å; L168-P174 HydrophobicContact CD2-CG 4.46Å; L168-L199 HydrophobicContact CD1-CB 4.07Å; L168-L200 HydrophobicContact CD1-CD2 4.29Å; L168-L200 HydrophobicContact CD2-CD2 4.26Å; L168-F203 HydrophobicContact CB-CB 4.35Å; L168-F203 HydrophobicContact CB-CD1 3.83Å; L168-F203 HydrophobicContact CB-CD2 3.95Å; L168-F203 HydrophobicContact CB-CE1 4.02Å; L168-F203 HydrophobicContact CB-CE2 4.13Å; L168-F203 HydrophobicContact CB-CG 3.79Å; L168-F203 HydrophobicContact CB-CZ 4.17Å; L168-F203 HydrophobicContact CD1-CB 4.1Å; L168-F203 HydrophobicContact CD1-CD2 3.73Å; L168-F203 HydrophobicContact CD1-CE2 4.37Å; L168-F203 HydrophobicContact CD1-CG 4.01Å; L168-F203 HydrophobicContact CD2-CB 4.01Å; L168-F203 HydrophobicContact CD2-CG 4.38Å; L168-F203 HydrophobicContact CG-CB 4.38Å; L168-F203 HydrophobicContact CG-CD2 4.39Å; L168-F203 HydrophobicContact CG-CG 4.28Å |
| 169 | V | 95.3 | Very high | 92.3 | Very high | 95 Ų | 95 | 36.3 Ų | 36.3 | 58% | 0.576 | 22% | 0.224 | S | C | * | . | H | α-helix | trans | -64.3 | -31.3 | 174.5 | 170.9 | 0 | 0 | 0 | 0 | 111.8 | H165 G171 F203 | H165-V169 WeakPolarHBondContact O-CB 3.22Å; H165-V169 VanDerWaalsContact O-CG2 3.27Å; H165-V169 WeakPolarHBondContact O-CG2 3.34Å; H165-V169 PolarHBondContact O-N 3.29Å; V169-G171 PolarHBondContact O-N 3.02Å; V169-F203 HydrophobicContact CG2-CE1 4.36Å; V169-F203 HydrophobicContact CG2-CZ 3.88Å |
| 170 | A | 92.4 | Very high | 91.8 | Very high | 47 Ų | 47 | 37.7 Ų | 37.7 | 39% | 0.388 | 23% | 0.229 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -77.1 | 1.4 | 174.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | L136 V166 L167 L168 | L136-A170 HydrophobicContact CD1-CB 3.81Å; L136-A170 HydrophobicContact CD2-CB 3.95Å; L136-A170 HydrophobicContact CG-CB 4.31Å; V166-A170 WeakPolarHBondContact O-CB 3.43Å; V166-A170 PolarHBondContact O-N 3.07Å; L167-A170 CarbonylContact O-C 3.54Å; L167-A170 PolarHBondContact O-N 3.45Å; L167-A170 VanDerWaalsContact O-N 3.17Å; L168-A170 PolarHBondContact O-N 3.39Å |
| 171 | G | 91.6 | Very high | 91.5 | Very high | 52 Ų | 52 | 34.8 Ų | 34.8 | 54% | 0.536 | 22% | 0.216 | S | C | . | . | T | Hydrogen-bonded Turn | trans | 90.9 | 19.9 | 175.3 | 0 | 0 | 0 | 0 | 0 | 115 | L167 L168 V169 | L167-G171 PolarHBondContact O-N 3.35Å; L168-G171 PolarHBondContact O-N 2.9Å; V169-G171 PolarHBondContact O-N 3.02Å |
| 172 | A | 94.1 | Very high | 91.2 | Very high | 6 Ų | 6 | 34.9 Ų | 34.9 | 5% | 0.05 | 21% | 0.212 | C | C | . | . | trans | -60.3 | 133.9 | 171.4 | 0 | 0 | 0 | 0 | 0 | 110.9 | P142 D143 L152 L167 P174 | P142-A172 HydrophobicContact CB-CB 3.88Å; D143-A172 VanDerWaalsContact OD1-CA 3.3Å; D143-A172 WeakPolarHBondContact OD1-CA 3.36Å; L152-A172 HydrophobicContact CD2-CB 4.31Å; L167-A172 HydrophobicContact CB-CB 4.13Å; L167-A172 WeakPolarHBondContact O-CB 3.47Å; L167-A172 PolarHBondContact O-N 3.04Å; A172-P174 WeakPolarHBondContact O-CD 3.31Å | ||
| 173 | D | 93.9 | Very high | 91.1 | Very high | 69 Ų | 69 | 34.4 Ų | 34.4 | 37% | 0.369 | 20% | 0.201 | S | C | . | . | trans | -78.6 | 117.9 | 176 | -178.1 | -4.7 | 0 | 0 | 0 | 110.4 | D143 N175 I176 | D143-D173 PolarHBondContact OD1-N 2.89Å; D173-N175 PolarHBondContact O-N 3.33Å; D173-N175 WeakPolarHBondContact OD1-CB 3.23Å; D173-N175 PolarHBondContact OD1-N 3.4Å; D173-I176 HydrophobicContact CB-CD1 3.86Å; D173-I176 HydrophobicContact CB-CG1 3.89Å | ||
| 174 | P | 94.2 | Very high | 91.1 | Very high | 11 Ų | 11 | 34.4 Ų | 34.4 | 7% | 0.071 | 20% | 0.201 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -74.2 | 0.8 | -179.6 | 32.8 | -37.4 | 0 | 0 | 0 | 114.3 | L152 L168 A172 P184 L200 A205 | L152-P174 HydrophobicContact CD2-CB 4.32Å; L168-P174 HydrophobicContact CD2-CB 4.01Å; L168-P174 HydrophobicContact CD2-CG 4.46Å; A172-P174 WeakPolarHBondContact O-CD 3.31Å; P174-P184 WeakPolarHBondContact O-CD 3.47Å; P174-L200 HydrophobicContact CB-CD2 3.89Å; P174-A205 HydrophobicContact CB-CB 4Å; P174-A205 HydrophobicContact CG-CB 4.38Å |
| 175 | N | 93 | Very high | 91 | Very high | 32 Ų | 32 | 34.7 Ų | 34.7 | 17% | 0.171 | 20% | 0.203 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -112.4 | -0.3 | -174.5 | -65.8 | -65.9 | 0 | 0 | 0 | 114.8 | D173 A177 R183 G204 R206 | D173-N175 PolarHBondContact O-N 3.33Å; D173-N175 WeakPolarHBondContact OD1-CB 3.23Å; D173-N175 PolarHBondContact OD1-N 3.4Å; N175-A177 PolarHBondContact O-N 2.84Å; N175-R183 PolarHBondContact O-NH1 3.24Å; N175-G204 PolarHBondContact ND2-O 3.33Å; N175-R206 WeakPolarHBondContact OD1-CG 3.36Å; N175-R206 PolarHBondContact OD1-N 2.98Å |
| 176 | I | 89.4 | Confident | 90.8 | Very high | 46 Ų | 46 | 30.8 Ų | 30.8 | 24% | 0.236 | 18% | 0.184 | C | C | . | . | trans | -60.5 | 133 | 175.5 | -65.8 | 170.6 | 0 | 0 | 0 | 108.6 | D143 T150 H153 D173 P184 | D143-I176 HydrophobicContact CB-CD1 3.64Å; T150-I176 HydrophobicContact CG2-CB 4.39Å; T150-I176 HydrophobicContact CG2-CD1 4.11Å; T150-I176 HydrophobicContact CG2-CG2 3.88Å; H153-I176 PolarHBondContact CE1-O 3.4Å; H153-I176 PolarHBondContact NE2-O 3.23Å; H153-I176 VanDerWaalsContact NE2-O 3.09Å; D173-I176 HydrophobicContact CB-CD1 3.86Å; D173-I176 HydrophobicContact CB-CG1 3.89Å; I176-P184 WeakPolarHBondContact O-CD 3.4Å | ||
| 177 | A | 88.7 | Confident | 90.4 | Very high | 29 Ų | 29 | 30.4 Ų | 30.4 | 24% | 0.24 | 18% | 0.182 | C | C | . | . | trans | -85.4 | 142.9 | 172.9 | 0 | 0 | 0 | 0 | 0 | 109.9 | N175 | N175-A177 PolarHBondContact O-N 2.84Š| ||
| 178 | D | 84.1 | Confident | 90.1 | Very high | 8 Ų | 8 | 30.5 Ų | 30.5 | 4% | 0.043 | 18% | 0.183 | C | C | . | . | trans | -78.8 | -176.9 | 169.2 | 77.5 | -3.1 | 0 | 0 | 0 | 112.2 | G148 R149 D180 G181 K182 | G148-D178 CarbonylContact O-C 3.43Å; G148-D178 WeakPolarHBondContact O-CA 3.38Å; G148-D178 WeakPolarHBondContact O-CB 3.48Å; R149-D178 HydrophobicContact CG-CB 3.66Å; R149-D178 IonicContact CZ-OD2 3.52Å; R149-D178 IonicContact NE-OD2 2.65Å; R149-D178 PolarHBondContact NE-OD2 3.23Å; R149-D178 VanDerWaalsContact NE-OD2 3.17Å; R149-D178 IonicContact NH2-OD2 3.9Å; D178-D180 PolarHBondContact O-N 3.34Å; D178-D180 WeakPolarHBondContact OD1-CA 3.25Å; D178-D180 WeakPolarHBondContact OD1-CB 3.49Å; D178-D180 PolarHBondContact OD1-N 2.93Å; D178-G181 WeakPolarHBondContact O-CA 3.38Å; D178-G181 PolarHBondContact O-N 3.25Å; D178-G181 PolarHBondContact OD1-N 2.97Å; D178-K182 PolarHBondContact N-O 2.93Å; D178-K182 WeakPolarHBondContact OD1-CA 3.45Å; D178-K182 WeakPolarHBondContact OD1-CB 3.32Å; D178-K182 PolarHBondContact OD1-N 3.43Å | ||
| 179 | Q | 80.6 | Confident | 89.2 | Confident | 92 Ų | 92 | 35.4 Ų | 35.4 | 43% | 0.43 | 20% | 0.201 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -58.3 | -25.7 | 178 | 63.7 | -179.5 | 31.2 | 0 | 0 | 114.7 | G147 G148 | G147-Q179 PolarHBondContact O-OE1 3.5Å; G148-Q179 PolarHBondContact O-N 3.26Å; G148-Q179 VanDerWaalsContact O-N 3.08Å |
| 180 | D | 79.5 | Confident | 88.1 | Confident | 37 Ų | 37 | 32.9 Ų | 32.9 | 20% | 0.198 | 19% | 0.193 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -91 | 9 | 176.1 | -52.8 | -21.5 | 0 | 0 | 0 | 110.7 | R149 D178 K182 | R149-D180 IonicContact NH2-OD2 3.31Å; D178-D180 PolarHBondContact O-N 3.34Å; D178-D180 WeakPolarHBondContact OD1-CA 3.25Å; D178-D180 WeakPolarHBondContact OD1-CB 3.49Å; D178-D180 PolarHBondContact OD1-N 2.93Å; D180-K182 HydrophobicContact CB-CD 4.12Å; D180-K182 HydrophobicContact CB-CG 4.17Å; D180-K182 PolarHBondContact O-N 3.23Å; D180-K182 IonicContact OD2-NZ 3.7Å; D180-K182 PolarHBondContact OD2-NZ 3.47Å |
| 181 | G | 84.1 | Confident | 87.2 | Confident | 2 Ų | 2 | 36.1 Ų | 36.1 | 2% | 0.021 | 21% | 0.211 | C | C | . | . | S | Bend | trans | 71.1 | 10.3 | -173.3 | 0 | 0 | 0 | 0 | 0 | 114.4 | D178 S211 E212 | D178-G181 WeakPolarHBondContact O-CA 3.38Å; D178-G181 PolarHBondContact O-N 3.25Å; D178-G181 PolarHBondContact OD1-N 2.97Å; G181-S211 WeakPolarHBondContact O-CA 3.45Å; G181-E212 PolarHBondContact O-N 3.44Å |
| 182 | K | 88.5 | Confident | 86.7 | Confident | 51 Ų | 51 | 34.8 Ų | 34.8 | 22% | 0.222 | 20% | 0.196 | C | C | . | . | trans | -87.4 | 134 | -177.4 | -65.3 | 170.9 | -169.6 | 134.5 | 0 | 110.6 | H153 D178 D180 H186 L187 | H153-K182 PolarHBondContact NE2-O 3.37Å; D178-K182 PolarHBondContact N-O 2.93Å; D178-K182 WeakPolarHBondContact OD1-CA 3.45Å; D178-K182 WeakPolarHBondContact OD1-CB 3.32Å; D178-K182 PolarHBondContact OD1-N 3.43Å; D180-K182 HydrophobicContact CB-CD 4.12Å; D180-K182 HydrophobicContact CB-CG 4.17Å; D180-K182 PolarHBondContact O-N 3.23Å; D180-K182 IonicContact OD2-NZ 3.7Å; D180-K182 PolarHBondContact OD2-NZ 3.47Å; K182-H186 HydrophobicContact CB-CB 4.22Å; K182-L187 HydrophobicContact CB-CD2 4.09Å; K182-L187 HydrophobicContact CD-CD2 3.88Å | ||
| 183 | R | 92.5 | Very high | 86.4 | Confident | 36 Ų | 36 | 35 Ų | 35 | 14% | 0.136 | 20% | 0.198 | C | C | . | . | trans | -82.8 | 161.3 | 172.8 | -51.1 | 168.8 | -175.5 | -100.6 | -13.4 | 111.1 | N175 L185 H186 R210 | N175-R183 PolarHBondContact O-NH1 3.24Å; R183-L185 PolarHBondContact O-N 3.15Å; R183-H186 WeakPolarHBondContact CB-ND1 3.28Å; R183-H186 PolarHBondContact N-ND1 2.87Å; R183-H186 WeakPolarHBondContact O-CB 3.42Å; R183-H186 PolarHBondContact O-N 3.33Å; R183-H186 PolarHBondContact O-ND1 3.13Å; R183-R210 PolarHBondContact NE-O 2.9Å | ||
| 184 | P | 92.9 | Very high | 86.3 | Confident | 0 Ų | 0 | 34 Ų | 34 | 0% | 0 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -52.2 | -37.4 | 179.7 | -27.6 | 34.5 | 0 | 0 | 0 | 114.1 | L152 H153 P174 I176 H186 L187 C188 L200 | L152-P184 HydrophobicContact CD2-CB 4.24Å; L152-P184 HydrophobicContact CD2-CG 3.9Å; L152-P184 HydrophobicContact CG-CB 4.15Å; L152-P184 HydrophobicContact CG-CG 4.12Å; H153-P184 VanDerWaalsContact NE2-CD 3.28Å; H153-P184 WeakPolarHBondContact NE2-CD 3.47Å; P174-P184 WeakPolarHBondContact O-CD 3.47Å; I176-P184 WeakPolarHBondContact O-CD 3.4Å; P184-H186 VanDerWaalsContact C-N 3.25Å; P184-H186 PolarHBondContact O-N 3.25Å; P184-L187 PolarHBondContact O-N 2.98Å; P184-C188 PolarHBondContact O-N 3.06Å; P184-C188 PolarHBondContact O-SG 2.96Å; P184-L200 HydrophobicContact CB-CD1 4.12Å; P184-L200 HydrophobicContact CB-CD2 4.05Å |
| 185 | L | 93.6 | Very high | 86.3 | Confident | 6 Ų | 6 | 38.1 Ų | 38.1 | 3% | 0.031 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -64.6 | -25.2 | 179.3 | -167.8 | 60.9 | 0 | 0 | 0 | 113.5 | R183 L187 A197 L200 L201 A205 P218 L234 | R183-L185 PolarHBondContact O-N 3.15Å; L185-L187 VanDerWaalsContact C-N 3.33Å; L185-A197 HydrophobicContact CD1-CB 3.76Å; L185-L200 HydrophobicContact CB-CD1 4.12Å; L185-L200 HydrophobicContact CD1-CB 4.24Å; L185-L200 HydrophobicContact CD1-CD1 3.91Å; L185-L201 HydrophobicContact CD1-CG 4.46Å; L185-L201 HydrophobicContact CD2-CD2 3.71Å; L185-L201 HydrophobicContact CD2-CG 4.34Å; L185-A205 HydrophobicContact CD2-CB 4.41Å; L185-P218 HydrophobicContact CB-CG 4.19Å; L185-P218 HydrophobicContact CD2-CB 4.07Å; L185-P218 HydrophobicContact CD2-CG 3.75Å; L185-P218 HydrophobicContact CG-CB 3.89Å; L185-P218 HydrophobicContact CG-CG 3.87Å; L185-L234 HydrophobicContact CD2-CD2 4.03Å; L185-L234 HydrophobicContact CG-CD2 4.49Å |
| 186 | H | 90.9 | Very high | 86.3 | Confident | 3 Ų | 3 | 36.6 Ų | 36.6 | 1% | 0.014 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -77 | -21.9 | 173.6 | -58.1 | 91.7 | 0 | 0 | 0 | 112.8 | K182 R183 P184 G209 E216 P218 V221 | K182-H186 HydrophobicContact CB-CB 4.22Å; R183-H186 WeakPolarHBondContact CB-ND1 3.28Å; R183-H186 PolarHBondContact N-ND1 2.87Å; R183-H186 WeakPolarHBondContact O-CB 3.42Å; R183-H186 PolarHBondContact O-N 3.33Å; R183-H186 PolarHBondContact O-ND1 3.13Å; P184-H186 VanDerWaalsContact C-N 3.25Å; P184-H186 PolarHBondContact O-N 3.25Å; H186-G209 PolarHBondContact CE1-O 3.34Å; H186-G209 PolarHBondContact NE2-O 3.28Å; H186-E216 PolarHBondContact NE2-O 3.24Å; H186-E216 VanDerWaalsContact NE2-O 3.13Å; H186-P218 WeakPolarHBondContact NE2-CD 3.49Å; H186-V221 HydrophobicContact CB-CG2 4.39Å |
| 187 | L | 88.9 | Confident | 86.6 | Confident | 10 Ų | 10 | 34.4 Ų | 34.4 | 5% | 0.052 | 19% | 0.191 | C | C | . | . | H | α-helix | trans | -92.5 | -9.3 | -175 | -60 | -172.5 | 0 | 0 | 0 | 112.9 | H153 A157 K182 P184 L185 R189 | H153-L187 HydrophobicContact CB-CD1 3.66Å; H153-L187 VanDerWaalsContact CD2-CD1 3.49Å; H153-L187 WeakPolarHBondContact CD2-CD1 3.3Å; A157-L187 WeakPolarHBondContact CA-O 3.49Å; A157-L187 HydrophobicContact CB-CB 4.41Å; K182-L187 HydrophobicContact CB-CD2 4.09Å; K182-L187 HydrophobicContact CD-CD2 3.88Å; P184-L187 PolarHBondContact O-N 2.98Å; L185-L187 VanDerWaalsContact C-N 3.33Å; L187-R189 WeakPolarHBondContact O-CG 3.5Å; L187-R189 PolarHBondContact O-N 3.26Å |
| 188 | C | 87.6 | Confident | 86.9 | Confident | 2 Ų | 2 | 36.9 Ų | 36.9 | 1% | 0.014 | 20% | 0.197 | C | C | . | . | trans | -59.9 | 104.9 | 177.6 | -57.7 | 0 | 0 | 0 | 0 | 110.2 | P184 T193 | P184-C188 PolarHBondContact O-N 3.06Å; P184-C188 PolarHBondContact O-SG 2.96Å; C188-T193 HydrophobicContact CB-CG2 3.76Å; C188-T193 WeakPolarHBondContact O-CG2 3.44Å | ||
| 189 | R | 76.6 | Confident | 87.4 | Confident | 110 Ų | 110 | 37.9 Ų | 37.9 | 42% | 0.415 | 20% | 0.202 | S | C | . | . | trans | -138.2 | 144.3 | -177 | -66.8 | 177.9 | -176.8 | -173.2 | -0 | 109.2 | L187 T193 L225 | L187-R189 WeakPolarHBondContact O-CG 3.5Å; L187-R189 PolarHBondContact O-N 3.26Å; R189-T193 WeakPolarHBondContact CA-OG1 3.44Å; R189-T193 PolarHBondContact N-OG1 2.78Å; R189-T193 PolarHBondContact O-OG1 3.33Å; R189-L225 HydrophobicContact CG-CD1 3.91Å | ||
| 190 | G | 72.6 | Confident | 88.1 | Confident | 41 Ų | 41 | 33.5 Ų | 33.5 | 42% | 0.423 | 18% | 0.182 | S | C | . | . | S | Bend | trans | 86.6 | -162.6 | 174.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | T193 | G190-T193 PolarHBondContact N-OG1 2.8Å; G190-T193 WeakPolarHBondContact O-CB 3.36Å; G190-T193 PolarHBondContact O-N 3.17Å; G190-T193 PolarHBondContact O-OG1 3.07Å |
| 191 | P | 74.4 | Confident | 88.9 | Confident | 116 Ų | 116 | 32.7 Ų | 32.7 | 75% | 0.753 | 18% | 0.177 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -66.3 | 140.6 | -179.8 | 28.8 | -33.8 | 0 | 0 | 0 | 110.8 | G159 T193 | G159-P191 WeakPolarHBondContact CA-O 3.3Å; P191-T193 VanDerWaalsContact C-N 3.31Å |
| 192 | G | 81.4 | Confident | 89.4 | Confident | 23 Ų | 23 | 42.3 Ų | 42.3 | 24% | 0.237 | 21% | 0.213 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 83.7 | 1.9 | -178.1 | 0 | 0 | 0 | 0 | 0 | 115.1 | T161 L194 E195 C196 | T161-G192 WeakPolarHBondContact CG2-O 3.35Å; G192-L194 VanDerWaalsContact C-N 3.28Å; G192-L194 PolarHBondContact O-N 3.36Å; G192-E195 VanDerWaalsContact CA-OE2 3.22Å; G192-E195 WeakPolarHBondContact CA-OE2 3.34Å; G192-E195 PolarHBondContact O-N 3.27Å; G192-C196 WeakPolarHBondContact O-CB 3.49Å; G192-C196 PolarHBondContact O-N 3.3Å; G192-C196 PolarHBondContact O-SG 2.81Å |
| 193 | T | 86.8 | Confident | 89.7 | Confident | 12 Ų | 12 | 43.7 Ų | 43.7 | 7% | 0.074 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -56.6 | -40.6 | 180 | -71.1 | 0 | 0 | 0 | 0 | 112.4 | C188 R189 G190 P191 C196 A197 L230 | C188-T193 HydrophobicContact CB-CG2 3.76Å; C188-T193 WeakPolarHBondContact O-CG2 3.44Å; R189-T193 WeakPolarHBondContact CA-OG1 3.44Å; R189-T193 PolarHBondContact N-OG1 2.78Å; R189-T193 PolarHBondContact O-OG1 3.33Å; G190-T193 PolarHBondContact N-OG1 2.8Å; G190-T193 WeakPolarHBondContact O-CB 3.36Å; G190-T193 PolarHBondContact O-N 3.17Å; G190-T193 PolarHBondContact O-OG1 3.07Å; P191-T193 VanDerWaalsContact C-N 3.31Å; T193-C196 PolarHBondContact O-N 2.88Å; T193-A197 WeakPolarHBondContact O-CB 3.35Å; T193-A197 PolarHBondContact O-N 3.34Å; T193-L230 HydrophobicContact CG2-CD1 4.42Å; T193-L230 HydrophobicContact CG2-CD2 3.83Å |
| 194 | L | 92.2 | Very high | 89.7 | Confident | 47 Ų | 47 | 44.3 Ų | 44.3 | 25% | 0.246 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -68.3 | -47.8 | -175 | -167.3 | 144 | 0 | 0 | 0 | 110.8 | G192 C196 A197 E198 E229 | G192-L194 VanDerWaalsContact C-N 3.28Å; G192-L194 PolarHBondContact O-N 3.36Å; L194-C196 PolarHBondContact O-N 3.2Å; L194-A197 PolarHBondContact O-N 2.78Å; L194-E198 HydrophobicContact CD2-CG 4.15Å; L194-E198 WeakPolarHBondContact O-CG 3.36Å; L194-E198 PolarHBondContact O-N 3.21Å; L194-E229 HydrophobicContact CD1-CB 3.51Å |
| 195 | E | 94.1 | Very high | 89.8 | Confident | 98 Ų | 98 | 44.7 Ų | 44.7 | 46% | 0.458 | 24% | 0.24 | S | C | . | . | H | α-helix | trans | -66.7 | -37.5 | 177.9 | -58.6 | 87.4 | 166.2 | 0 | 0 | 111.6 | T161 G192 E198 L199 | T161-E195 HydrophobicContact CG2-CB 3.66Å; G192-E195 VanDerWaalsContact CA-OE2 3.22Å; G192-E195 WeakPolarHBondContact CA-OE2 3.34Å; G192-E195 PolarHBondContact O-N 3.27Å; E195-E198 PolarHBondContact O-N 3.26Å; E195-L199 WeakPolarHBondContact O-CB 3.5Å; E195-L199 VanDerWaalsContact O-CG 3.28Å; E195-L199 WeakPolarHBondContact O-CG 3.28Å; E195-L199 PolarHBondContact O-N 3.07Å |
| 196 | C | 93.8 | Very high | 89.8 | Confident | 0 Ų | 0 | 51.9 Ų | 51.9 | 0% | 0 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -59.1 | -49 | 171.9 | -76 | 0 | 0 | 0 | 0 | 111.4 | G192 T193 L194 L199 L200 | G192-C196 WeakPolarHBondContact O-CB 3.49Å; G192-C196 PolarHBondContact O-N 3.3Å; G192-C196 PolarHBondContact O-SG 2.81Å; T193-C196 PolarHBondContact O-N 2.88Å; L194-C196 PolarHBondContact O-N 3.2Å; C196-L199 PolarHBondContact O-N 3.07Å; C196-L200 VanDerWaalsContact O-CG 3.32Å; C196-L200 WeakPolarHBondContact O-CG 3.4Å; C196-L200 PolarHBondContact O-N 2.8Å |
| 197 | A | 94.9 | Very high | 89.9 | Confident | 0 Ų | 0 | 53.1 Ų | 53.1 | 0% | 0 | 27% | 0.274 | C | S | . | . | H | α-helix | trans | -63.5 | -41.6 | 178.5 | 0 | 0 | 0 | 0 | 0 | 111.9 | L185 T193 L194 L199 L200 L201 L230 L233 | L185-A197 HydrophobicContact CD1-CB 3.76Å; T193-A197 WeakPolarHBondContact O-CB 3.35Å; T193-A197 PolarHBondContact O-N 3.34Å; L194-A197 PolarHBondContact O-N 2.78Å; A197-L199 VanDerWaalsContact C-N 3.34Å; A197-L199 PolarHBondContact O-N 2.8Å; A197-L200 PolarHBondContact O-N 2.97Å; A197-L201 WeakPolarHBondContact O-CB 3.48Å; A197-L201 WeakPolarHBondContact O-CG 3.47Å; A197-L201 PolarHBondContact O-N 3.14Å; A197-L230 HydrophobicContact CB-CD1 3.42Å; A197-L230 VanDerWaalsContact CB-CD1 3.42Å; A197-L233 HydrophobicContact CB-CD2 3.88Å |
| 198 | E | 95 | Very high | 90.1 | Very high | 80 Ų | 80 | 55.6 Ų | 55.6 | 37% | 0.374 | 29% | 0.288 | S | S | . | . | H | α-helix | trans | -59.1 | -44.7 | 175.1 | -77.8 | -170.9 | 164.8 | 0 | 0 | 112.4 | L194 E195 R202 L233 | L194-E198 HydrophobicContact CD2-CG 4.15Å; L194-E198 WeakPolarHBondContact O-CG 3.36Å; L194-E198 PolarHBondContact O-N 3.21Å; E195-E198 PolarHBondContact O-N 3.26Å; E198-R202 VanDerWaalsContact O-CB 3.3Å; E198-R202 WeakPolarHBondContact O-CB 3.12Å; E198-R202 PolarHBondContact O-N 3.08Å; E198-L233 HydrophobicContact CB-CD2 4.45Å; E198-L233 HydrophobicContact CG-CD1 3.77Å; E198-L233 HydrophobicContact CG-CD2 3.54Å; E198-L233 HydrophobicContact CG-CG 4.31Å |
| 199 | L | 95.4 | Very high | 90.2 | Very high | 29 Ų | 29 | 55.7 Ų | 55.7 | 15% | 0.152 | 29% | 0.289 | C | S | . | . | H | α-helix | trans | -63.1 | -50.6 | 176.4 | -73.6 | 175.2 | 0 | 0 | 0 | 111.1 | V164 H165 L168 E195 C196 A197 L201 R202 F203 | V164-L199 HydrophobicContact CG1-CB 4.23Å; V164-L199 HydrophobicContact CG1-CD1 4.3Å; H165-L199 HydrophobicContact CB-CD1 3.88Å; L168-L199 HydrophobicContact CD1-CB 4.07Å; E195-L199 WeakPolarHBondContact O-CB 3.5Å; E195-L199 VanDerWaalsContact O-CG 3.28Å; E195-L199 WeakPolarHBondContact O-CG 3.28Å; E195-L199 PolarHBondContact O-N 3.07Å; C196-L199 PolarHBondContact O-N 3.07Å; A197-L199 VanDerWaalsContact C-N 3.34Å; A197-L199 PolarHBondContact O-N 2.8Å; L199-L201 VanDerWaalsContact C-N 3.31Å; L199-L201 PolarHBondContact O-N 3.42Å; L199-R202 WeakPolarHBondContact O-CB 3.35Å; L199-R202 PolarHBondContact O-N 2.8Å; L199-R202 VanDerWaalsContact O-N 3.11Å; L199-F203 VanDerWaalsContact O-CD2 3.31Å; L199-F203 WeakPolarHBondContact O-CD2 3.25Å; L199-F203 PolarHBondContact O-N 3.2Å |
| 200 | L | 95.4 | Very high | 90.9 | Very high | 0 Ų | 0 | 56.1 Ų | 56.1 | 0% | 0 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -54.7 | -48.3 | 178.2 | -73.3 | 172.9 | 0 | 0 | 0 | 111.5 | L152 V164 L168 P174 P184 L185 C196 A197 R202 F203 G204 A205 | L152-L200 HydrophobicContact CD1-CD2 4.27Å; L152-L200 HydrophobicContact CD2-CD2 3.98Å; L152-L200 HydrophobicContact CG-CD2 4.31Å; V164-L200 HydrophobicContact CG1-CD2 4.5Å; L168-L200 HydrophobicContact CD1-CD2 4.29Å; L168-L200 HydrophobicContact CD2-CD2 4.26Å; P174-L200 HydrophobicContact CB-CD2 3.89Å; P184-L200 HydrophobicContact CB-CD1 4.12Å; P184-L200 HydrophobicContact CB-CD2 4.05Å; L185-L200 HydrophobicContact CB-CD1 4.12Å; L185-L200 HydrophobicContact CD1-CB 4.24Å; L185-L200 HydrophobicContact CD1-CD1 3.91Å; C196-L200 VanDerWaalsContact O-CG 3.32Å; C196-L200 WeakPolarHBondContact O-CG 3.4Å; C196-L200 PolarHBondContact O-N 2.8Å; A197-L200 PolarHBondContact O-N 2.97Å; L200-R202 VanDerWaalsContact C-N 3.34Å; L200-R202 PolarHBondContact O-N 2.98Å; L200-F203 CarbonylContact O-C 3.45Å; L200-F203 PolarHBondContact O-N 2.78Å; L200-G204 PolarHBondContact O-N 2.84Å; L200-A205 VanDerWaalsContact C-CB 3.45Å; L200-A205 HydrophobicContact CB-CB 3.87Å; L200-A205 WeakPolarHBondContact O-CB 3.2Å; L200-A205 PolarHBondContact O-N 3.27Å |
| 201 | L | 95.1 | Very high | 91.7 | Very high | 20 Ų | 20 | 54.5 Ų | 54.5 | 11% | 0.105 | 27% | 0.273 | C | S | . | . | H | α-helix | trans | -64 | -38 | 178.8 | -68.5 | 175.2 | 0 | 0 | 0 | 112.2 | L185 A197 L199 F203 G204 A205 V207 L233 L234 R237 | L185-L201 HydrophobicContact CD1-CG 4.46Å; L185-L201 HydrophobicContact CD2-CD2 3.71Å; L185-L201 HydrophobicContact CD2-CG 4.34Å; A197-L201 WeakPolarHBondContact O-CB 3.48Å; A197-L201 WeakPolarHBondContact O-CG 3.47Å; A197-L201 PolarHBondContact O-N 3.14Å; L199-L201 VanDerWaalsContact C-N 3.31Å; L199-L201 PolarHBondContact O-N 3.42Å; L201-F203 VanDerWaalsContact C-N 3.3Å; L201-F203 PolarHBondContact O-N 3.48Å; L201-G204 PolarHBondContact O-N 3.17Å; L201-A205 HydrophobicContact CD2-CB 4.39Å; L201-V207 HydrophobicContact CD2-CB 4.33Å; L201-V207 HydrophobicContact CD2-CG2 3.53Å; L201-L233 HydrophobicContact CD1-CD2 4.31Å; L201-L233 HydrophobicContact CD1-CG 4.29Å; L201-L234 HydrophobicContact CD1-CD2 4.2Å; L201-R237 HydrophobicContact CD1-CB 4.15Å; L201-R237 HydrophobicContact CD1-CG 3.87Å |
| 202 | R | 95.2 | Very high | 92.3 | Very high | 204 Ų | 204 | 56 Ų | 56 | 77% | 0.77 | 27% | 0.27 | S | S | * | . | H | α-helix | trans | -65.1 | -33.4 | 175.9 | -176.1 | 177.9 | 178.4 | -178.9 | -0.3 | 112.5 | E198 L199 L200 G204 | E198-R202 VanDerWaalsContact O-CB 3.3Å; E198-R202 WeakPolarHBondContact O-CB 3.12Å; E198-R202 PolarHBondContact O-N 3.08Å; L199-R202 WeakPolarHBondContact O-CB 3.35Å; L199-R202 PolarHBondContact O-N 2.8Å; L199-R202 VanDerWaalsContact O-N 3.11Å; L200-R202 VanDerWaalsContact C-N 3.34Å; L200-R202 PolarHBondContact O-N 2.98Å; R202-G204 VanDerWaalsContact C-N 3.31Å |
| 203 | F | 95.1 | Very high | 92.3 | Very high | 81 Ų | 81 | 61.2 Ų | 61.2 | 36% | 0.355 | 29% | 0.288 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90 | 13.1 | 177.9 | -79.3 | -94 | 0 | 0 | 0 | 113.5 | L168 V169 L199 L200 L201 | L168-F203 HydrophobicContact CB-CB 4.35Å; L168-F203 HydrophobicContact CB-CD1 3.83Å; L168-F203 HydrophobicContact CB-CD2 3.95Å; L168-F203 HydrophobicContact CB-CE1 4.02Å; L168-F203 HydrophobicContact CB-CE2 4.13Å; L168-F203 HydrophobicContact CB-CG 3.79Å; L168-F203 HydrophobicContact CB-CZ 4.17Å; L168-F203 HydrophobicContact CD1-CB 4.1Å; L168-F203 HydrophobicContact CD1-CD2 3.73Å; L168-F203 HydrophobicContact CD1-CE2 4.37Å; L168-F203 HydrophobicContact CD1-CG 4.01Å; L168-F203 HydrophobicContact CD2-CB 4.01Å; L168-F203 HydrophobicContact CD2-CG 4.38Å; L168-F203 HydrophobicContact CG-CB 4.38Å; L168-F203 HydrophobicContact CG-CD2 4.39Å; L168-F203 HydrophobicContact CG-CG 4.28Å; V169-F203 HydrophobicContact CG2-CE1 4.36Å; V169-F203 HydrophobicContact CG2-CZ 3.88Å; L199-F203 VanDerWaalsContact O-CD2 3.31Å; L199-F203 WeakPolarHBondContact O-CD2 3.25Å; L199-F203 PolarHBondContact O-N 3.2Å; L200-F203 CarbonylContact O-C 3.45Å; L200-F203 PolarHBondContact O-N 2.78Å; L201-F203 VanDerWaalsContact C-N 3.3Å; L201-F203 PolarHBondContact O-N 3.48Å |
| 204 | G | 92.3 | Very high | 92.2 | Very high | 48 Ų | 48 | 64.9 Ų | 64.9 | 50% | 0.495 | 30% | 0.304 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 91 | 22.9 | 171.1 | 0 | 0 | 0 | 0 | 0 | 115.4 | N175 L200 L201 R202 | N175-G204 PolarHBondContact ND2-O 3.33Å; L200-G204 PolarHBondContact O-N 2.84Å; L201-G204 PolarHBondContact O-N 3.17Å; R202-G204 VanDerWaalsContact C-N 3.31Å |
| 205 | A | 94.4 | Very high | 92.1 | Very high | 9 Ų | 9 | 66.5 Ų | 66.5 | 7% | 0.074 | 31% | 0.311 | C | S | . | . | trans | -60.5 | 136 | 166.5 | 0 | 0 | 0 | 0 | 0 | 110.7 | P174 L185 L200 L201 V207 | P174-A205 HydrophobicContact CB-CB 4Å; P174-A205 HydrophobicContact CG-CB 4.38Å; L185-A205 HydrophobicContact CD2-CB 4.41Å; L200-A205 VanDerWaalsContact C-CB 3.45Å; L200-A205 HydrophobicContact CB-CB 3.87Å; L200-A205 WeakPolarHBondContact O-CB 3.2Å; L200-A205 PolarHBondContact O-N 3.27Å; L201-A205 HydrophobicContact CD2-CB 4.39Å; A205-V207 PolarHBondContact O-N 3.45Å | ||
| 206 | R | 93.4 | Very high | 92 | Very high | 156 Ų | 156 | 62.6 Ų | 62.6 | 59% | 0.589 | 29% | 0.292 | S | S | * | . | trans | -70.2 | 116.3 | 175.4 | -68.4 | 178.8 | -171.2 | 169.4 | 2 | 109.9 | N175 D208 G209 | N175-R206 WeakPolarHBondContact OD1-CG 3.36Å; N175-R206 PolarHBondContact OD1-N 2.98Å; R206-D208 PolarHBondContact O-N 3.38Å; R206-G209 PolarHBondContact O-N 3.18Å; R206-G209 VanDerWaalsContact O-N 3.11Å | ||
| 207 | V | 93.8 | Very high | 92.1 | Very high | 29 Ų | 29 | 62.7 Ų | 62.7 | 18% | 0.176 | 29% | 0.293 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -57.6 | -46.9 | 179.4 | -178.4 | 0 | 0 | 0 | 0 | 111.3 | L201 A205 P218 L234 R237 A239 | L201-V207 HydrophobicContact CD2-CB 4.33Å; L201-V207 HydrophobicContact CD2-CG2 3.53Å; A205-V207 PolarHBondContact O-N 3.45Å; V207-P218 VanDerWaalsContact O-CD 3.27Å; V207-P218 WeakPolarHBondContact O-CD 3.16Å; V207-P218 WeakPolarHBondContact O-CG 3.02Å; V207-L234 HydrophobicContact CG1-CD2 4.31Å; V207-R237 HydrophobicContact CG2-CB 4.15Å; V207-A239 HydrophobicContact CG1-CB 3.51Å |
| 208 | D | 92.1 | Very high | 92 | Very high | 62 Ų | 62 | 62.8 Ų | 62.8 | 33% | 0.332 | 29% | 0.294 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -99.7 | 28.1 | 176.7 | -66.2 | -35.7 | 0 | 0 | 0 | 112.3 | R206 R210 T217 A239 C240 | R206-D208 PolarHBondContact O-N 3.38Å; D208-R210 PolarHBondContact O-N 2.86Å; D208-R210 VanDerWaalsContact O-N 3.08Å; D208-T217 HydrophobicContact CB-CG2 4.47Å; D208-A239 WeakPolarHBondContact OD1-CA 3.46Å; D208-C240 PolarHBondContact OD1-N 3.41Å; D208-C240 PolarHBondContact OD2-N 2.72Å |
| 209 | G | 90.4 | Very high | 92 | Very high | 4 Ų | 4 | 59 Ų | 59 | 4% | 0.041 | 28% | 0.276 | C | S | . | . | trans | -62.2 | 115.1 | 176.8 | 0 | 0 | 0 | 0 | 0 | 109.7 | H186 R206 P218 | H186-G209 PolarHBondContact CE1-O 3.34Å; H186-G209 PolarHBondContact NE2-O 3.28Å; R206-G209 PolarHBondContact O-N 3.18Å; R206-G209 VanDerWaalsContact O-N 3.11Å; G209-P218 WeakPolarHBondContact O-CD 3.33Å | ||
| 210 | R | 91.6 | Very high | 92 | Very high | 120 Ų | 120 | 57.7 Ų | 57.7 | 45% | 0.453 | 27% | 0.269 | S | S | . | . | trans | -75.5 | 148.4 | 179.2 | -63.8 | -175.8 | -178.8 | -169.2 | -1.4 | 111.8 | R183 D208 E215 E216 T217 | R183-R210 PolarHBondContact NE-O 2.9Å; D208-R210 PolarHBondContact O-N 2.86Å; D208-R210 VanDerWaalsContact O-N 3.08Å; R210-E215 IonicContact CZ-OE2 3.41Å; R210-E215 IonicContact NH1-OE2 3.53Å; R210-E215 PolarHBondContact NH1-OE2 3.47Å; R210-E216 CarbonylContact C-O 3.57Å; R210-E216 VanDerWaalsContact CA-O 3.3Å; R210-E216 WeakPolarHBondContact CA-O 3.48Å; R210-T217 HydrophobicContact CG-CG2 4.33Å | ||
| 211 | S | 89.7 | Confident | 91.8 | Very high | 6 Ų | 6 | 58.1 Ų | 58.1 | 4% | 0.042 | 27% | 0.271 | C | S | . | . | trans | -71.4 | 154.1 | 161.5 | 66 | 0 | 0 | 0 | 0 | 110.9 | G181 E215 E216 | G181-S211 WeakPolarHBondContact O-CA 3.45Å; S211-E215 VanDerWaalsContact O-CA 3.28Å; S211-E215 WeakPolarHBondContact O-CA 3.28Å; S211-E215 PolarHBondContact O-N 3.46Å; S211-E215 PolarHBondContact OG-N 2.89Å; S211-E216 PolarHBondContact N-O 3.46Å; S211-E216 PolarHBondContact OG-N 3.33Å | ||
| 212 | E | 85.6 | Confident | 91.6 | Very high | 148 Ų | 148 | 57.1 Ų | 57.1 | 69% | 0.692 | 27% | 0.266 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -78.2 | -35.1 | -176.5 | -57.8 | -171 | 164.1 | 0 | 0 | 113.1 | G181 | G181-E212 PolarHBondContact O-N 3.44Š|
| 213 | E | 81.6 | Confident | 91.5 | Very high | 133 Ų | 133 | 47.4 Ų | 47.4 | 62% | 0.621 | 23% | 0.23 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -82.4 | -52.7 | -175.8 | -63.2 | -173.6 | 158.4 | 0 | 0 | 113.2 | ||
| 214 | E | 85.2 | Confident | 91.2 | Very high | 88 Ų | 88 | 48 Ų | 48 | 41% | 0.411 | 23% | 0.229 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -100.9 | -3.4 | -172.5 | -62.1 | 178.9 | 167 | 0 | 0 | 112.7 | E216 N245 A246 | E214-E216 HydrophobicContact CB-CG 3.7Å; E214-E216 PolarHBondContact O-N 3.42Å; E214-E216 VanDerWaalsContact O-N 3.16Å; E214-N245 WeakPolarHBondContact O-CB 3.28Å; E214-A246 WeakPolarHBondContact O-CB 3.49Å; E214-A246 PolarHBondContact O-N 3.42Å |
| 215 | E | 90.7 | Very high | 90.9 | Very high | 82 Ų | 82 | 48.9 Ų | 48.9 | 38% | 0.383 | 22% | 0.223 | S | C | . | . | trans | 53.6 | 26.3 | -171.6 | -64.9 | -166.9 | -155.1 | 0 | 0 | 114.4 | R210 S211 A246 | R210-E215 IonicContact CZ-OE2 3.41Å; R210-E215 IonicContact NH1-OE2 3.53Å; R210-E215 PolarHBondContact NH1-OE2 3.47Å; S211-E215 VanDerWaalsContact O-CA 3.28Å; S211-E215 WeakPolarHBondContact O-CA 3.28Å; S211-E215 PolarHBondContact O-N 3.46Å; S211-E215 PolarHBondContact OG-N 2.89Å; E215-A246 HydrophobicContact CB-CB 4.24Å; E215-A246 HydrophobicContact CG-CB 4.32Å | ||
| 216 | E | 91.9 | Very high | 90.6 | Very high | 16 Ų | 16 | 48.6 Ų | 48.6 | 8% | 0.075 | 22% | 0.221 | C | C | . | . | trans | -76.1 | 143.1 | -177.9 | -69.4 | -166.1 | 145.8 | 0 | 0 | 111.6 | H186 R210 S211 E214 H220 R224 N245 | H186-E216 PolarHBondContact NE2-O 3.24Å; H186-E216 VanDerWaalsContact NE2-O 3.13Å; R210-E216 CarbonylContact C-O 3.57Å; R210-E216 VanDerWaalsContact CA-O 3.3Å; R210-E216 WeakPolarHBondContact CA-O 3.48Å; S211-E216 PolarHBondContact N-O 3.46Å; S211-E216 PolarHBondContact OG-N 3.33Å; E214-E216 HydrophobicContact CB-CG 3.7Å; E214-E216 PolarHBondContact O-N 3.42Å; E214-E216 VanDerWaalsContact O-N 3.16Å; E216-H220 HydrophobicContact CB-CB 4.19Å; E216-H220 HydrophobicContact CG-CB 4.37Å; E216-R224 IonicContact OE1-CZ 2.85Å; E216-R224 IonicContact OE1-NH1 3.35Å; E216-R224 PolarHBondContact OE1-NH1 2.8Å; E216-R224 IonicContact OE1-NH2 3.61Å; E216-R224 IonicContact OE2-CZ 3.72Å; E216-R224 VanDerWaalsContact OE2-CZ 3.26Å; E216-R224 IonicContact OE2-NH1 3.46Å; E216-R224 PolarHBondContact OE2-NH1 2.62Å; E216-R224 IonicContact OE2-NH2 3.17Å; E216-R224 PolarHBondContact OE2-NH2 3.25Å; E216-N245 HydrophobicContact CG-CB 4.02Å | ||
| 217 | T | 94.5 | Very high | 90.4 | Very high | 2 Ų | 2 | 44.2 Ų | 44.2 | 1% | 0.012 | 21% | 0.206 | C | C | . | . | trans | -92 | 161.5 | 168.6 | 68.9 | 0 | 0 | 0 | 0 | 110.5 | D208 R210 L219 H220 V221 A243 | D208-T217 HydrophobicContact CB-CG2 4.47Å; R210-T217 HydrophobicContact CG-CG2 4.33Å; T217-L219 PolarHBondContact O-N 3Å; T217-L219 VanDerWaalsContact O-N 3.08Å; T217-H220 PolarHBondContact N-ND1 3.04Å; T217-H220 WeakPolarHBondContact O-CB 3.26Å; T217-H220 PolarHBondContact O-N 3.37Å; T217-H220 PolarHBondContact OG1-ND1 3.31Å; T217-V221 PolarHBondContact O-N 2.91Å; T217-A243 HydrophobicContact CG2-CB 3.82Å | ||
| 218 | P | 93.9 | Very high | 90.3 | Very high | 2 Ų | 2 | 43.6 Ų | 43.6 | 1% | 0.013 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -55.1 | -29.7 | 173.9 | -26.5 | 35.3 | 0 | 0 | 0 | 113.1 | L185 H186 V207 G209 V221 A222 L234 | L185-P218 HydrophobicContact CB-CG 4.19Å; L185-P218 HydrophobicContact CD2-CB 4.07Å; L185-P218 HydrophobicContact CD2-CG 3.75Å; L185-P218 HydrophobicContact CG-CB 3.89Å; L185-P218 HydrophobicContact CG-CG 3.87Å; H186-P218 WeakPolarHBondContact NE2-CD 3.49Å; V207-P218 VanDerWaalsContact O-CD 3.27Å; V207-P218 WeakPolarHBondContact O-CD 3.16Å; V207-P218 WeakPolarHBondContact O-CG 3.02Å; G209-P218 WeakPolarHBondContact O-CD 3.33Å; P218-V221 PolarHBondContact O-N 2.99Å; P218-A222 WeakPolarHBondContact O-CB 3.47Å; P218-A222 PolarHBondContact O-N 3.43Å; P218-L234 HydrophobicContact CB-CD1 3.93Å; P218-L234 HydrophobicContact CB-CD2 4.21Å |
| 219 | L | 95.3 | Very high | 90.4 | Very high | 0 Ų | 0 | 47.3 Ų | 47.3 | 0% | 0 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -67.3 | -34.6 | 176 | -171.9 | 62.6 | 0 | 0 | 0 | 112.3 | T217 A223 A231 L234 L235 A239 P251 L280 | T217-L219 PolarHBondContact O-N 3Å; T217-L219 VanDerWaalsContact O-N 3.08Å; L219-A223 VanDerWaalsContact O-CB 3.24Å; L219-A223 WeakPolarHBondContact O-CB 3.4Å; L219-A223 PolarHBondContact O-N 2.94Å; L219-A231 HydrophobicContact CD1-CB 3.84Å; L219-L234 HydrophobicContact CB-CD1 4.32Å; L219-L234 HydrophobicContact CD1-CB 4.26Å; L219-L234 HydrophobicContact CD1-CD1 4.37Å; L219-L235 HydrophobicContact CD1-CG 4.19Å; L219-L235 HydrophobicContact CD2-CD2 3.72Å; L219-L235 HydrophobicContact CD2-CG 4.22Å; L219-A239 HydrophobicContact CD2-CB 4.09Å; L219-P251 HydrophobicContact CB-CG 4.31Å; L219-P251 HydrophobicContact CD2-CB 4.08Å; L219-P251 HydrophobicContact CD2-CG 3.79Å; L219-P251 HydrophobicContact CG-CB 3.88Å; L219-P251 HydrophobicContact CG-CG 3.88Å; L219-L280 HydrophobicContact CD1-CD2 4.25Å; L219-L280 HydrophobicContact CD2-CD2 4.09Å; L219-L280 HydrophobicContact CG-CD2 4.34Å |
| 220 | H | 94.1 | Very high | 90.5 | Very high | 1 Ų | 1 | 47.5 Ų | 47.5 | 1% | 0.005 | 22% | 0.218 | C | C | . | . | H | α-helix | trans | -63.5 | -45.4 | 172.3 | -70.4 | 84.4 | 0 | 0 | 0 | 111.3 | E216 T217 A223 R224 A243 W249 P251 | E216-H220 HydrophobicContact CB-CB 4.19Å; E216-H220 HydrophobicContact CG-CB 4.37Å; T217-H220 PolarHBondContact N-ND1 3.04Å; T217-H220 WeakPolarHBondContact O-CB 3.26Å; T217-H220 PolarHBondContact O-N 3.37Å; T217-H220 PolarHBondContact OG1-ND1 3.31Å; H220-A223 PolarHBondContact O-N 3.34Å; H220-R224 WeakPolarHBondContact O-CB 3.17Å; H220-R224 PolarHBondContact O-N 3.04Å; H220-A243 PolarHBondContact CE1-O 2.88Å; H220-A243 PolarHBondContact NE2-O 3.48Å; H220-W249 PolarHBondContact NE2-O 3.46Å; H220-P251 WeakPolarHBondContact NE2-CD 3.35Å |
| 221 | V | 91.1 | Very high | 90.6 | Very high | 9 Ų | 9 | 41.8 Ų | 41.8 | 6% | 0.055 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -64.6 | -45.8 | 179.2 | -177.2 | 0 | 0 | 0 | 0 | 110.5 | H186 T217 P218 A223 R224 L225 | H186-V221 HydrophobicContact CB-CG2 4.39Å; T217-V221 PolarHBondContact O-N 2.91Å; P218-V221 PolarHBondContact O-N 2.99Å; V221-A223 VanDerWaalsContact C-N 3.28Å; V221-A223 PolarHBondContact O-N 3.18Å; V221-R224 PolarHBondContact O-N 3.2Å; V221-L225 HydrophobicContact CG1-CD1 3.82Å; V221-L225 HydrophobicContact CG1-CG 4.34Å; V221-L225 WeakPolarHBondContact O-CB 3.35Å; V221-L225 VanDerWaalsContact O-CG 3.3Å; V221-L225 WeakPolarHBondContact O-CG 3.36Å; V221-L225 PolarHBondContact O-N 2.81Å |
| 222 | A | 91.9 | Very high | 90.9 | Very high | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 21% | 0.207 | C | C | . | . | H | α-helix | trans | -58 | -42.4 | 174.8 | 0 | 0 | 0 | 0 | 0 | 111.3 | P218 G226 H227 L230 A231 L234 | P218-A222 WeakPolarHBondContact O-CB 3.47Å; P218-A222 PolarHBondContact O-N 3.43Å; A222-G226 CarbonylContact O-C 3.55Å; A222-G226 PolarHBondContact O-N 2.89Å; A222-H227 PolarHBondContact O-N 3.34Å; A222-L230 HydrophobicContact CB-CB 4.31Å; A222-L230 HydrophobicContact CB-CD2 3.81Å; A222-L230 HydrophobicContact CB-CG 3.95Å; A222-A231 HydrophobicContact CB-CB 4.35Å; A222-L234 HydrophobicContact CB-CD1 4.22Å |
| 223 | A | 92.3 | Very high | 91.3 | Very high | 0 Ų | 0 | 37.4 Ų | 37.4 | 0% | 0 | 18% | 0.177 | C | C | . | . | H | α-helix | trans | -66.8 | -44.2 | 179.1 | 0 | 0 | 0 | 0 | 0 | 112.8 | L219 H220 V221 L225 G226 P251 A254 A255 L276 | L219-A223 VanDerWaalsContact O-CB 3.24Å; L219-A223 WeakPolarHBondContact O-CB 3.4Å; L219-A223 PolarHBondContact O-N 2.94Å; H220-A223 PolarHBondContact O-N 3.34Å; V221-A223 VanDerWaalsContact C-N 3.28Å; V221-A223 PolarHBondContact O-N 3.18Å; A223-L225 VanDerWaalsContact C-N 3.34Å; A223-L225 PolarHBondContact O-N 2.91Å; A223-G226 PolarHBondContact O-N 3.34Å; A223-G226 VanDerWaalsContact O-N 3.1Å; A223-P251 HydrophobicContact CB-CB 4.31Å; A223-P251 VanDerWaalsContact CB-O 3.3Å; A223-P251 WeakPolarHBondContact CB-O 3.22Å; A223-A254 HydrophobicContact CB-CB 4.21Å; A223-A255 HydrophobicContact CB-CB 4.24Å; A223-L276 HydrophobicContact CB-CD2 4Å; A223-L276 WeakPolarHBondContact O-CD2 3.45Å |
| 224 | R | 89.3 | Confident | 92 | Very high | 93 Ų | 93 | 31.1 Ų | 31.1 | 35% | 0.351 | 15% | 0.148 | S | C | . | . | H | α-helix | trans | -65.3 | -35.6 | 178.5 | -178.2 | 166.1 | 63.4 | -105.8 | 12 | 113 | E216 H220 V221 G226 | E216-R224 IonicContact OE1-CZ 2.85Å; E216-R224 IonicContact OE1-NH1 3.35Å; E216-R224 PolarHBondContact OE1-NH1 2.8Å; E216-R224 IonicContact OE1-NH2 3.61Å; E216-R224 IonicContact OE2-CZ 3.72Å; E216-R224 VanDerWaalsContact OE2-CZ 3.26Å; E216-R224 IonicContact OE2-NH1 3.46Å; E216-R224 PolarHBondContact OE2-NH1 2.62Å; E216-R224 IonicContact OE2-NH2 3.17Å; E216-R224 PolarHBondContact OE2-NH2 3.25Å; H220-R224 WeakPolarHBondContact O-CB 3.17Å; H220-R224 PolarHBondContact O-N 3.04Å; V221-R224 PolarHBondContact O-N 3.2Å; R224-G226 VanDerWaalsContact C-N 3.3Å |
| 225 | L | 86.5 | Confident | 92.5 | Very high | 67 Ų | 67 | 28.2 Ų | 28.2 | 35% | 0.351 | 14% | 0.135 | S | C | . | . | H | α-helix | trans | -82.2 | -10.3 | 175.3 | -62.6 | 177.1 | 0 | 0 | 0 | 112.7 | R189 V221 A223 H227 | R189-L225 HydrophobicContact CG-CD1 3.91Å; V221-L225 HydrophobicContact CG1-CD1 3.82Å; V221-L225 HydrophobicContact CG1-CG 4.34Å; V221-L225 WeakPolarHBondContact O-CB 3.35Å; V221-L225 VanDerWaalsContact O-CG 3.3Å; V221-L225 WeakPolarHBondContact O-CG 3.36Å; V221-L225 PolarHBondContact O-N 2.81Å; A223-L225 VanDerWaalsContact C-N 3.34Å; A223-L225 PolarHBondContact O-N 2.91Å; L225-H227 VanDerWaalsContact C-N 3.33Å |
| 226 | G | 87.5 | Confident | 92.7 | Very high | 3 Ų | 3 | 33 Ų | 33 | 3% | 0.031 | 15% | 0.15 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 73.2 | 18.5 | -176.5 | 0 | 0 | 0 | 0 | 0 | 114.1 | A222 A223 R224 V228 R272 | A222-G226 CarbonylContact O-C 3.55Å; A222-G226 PolarHBondContact O-N 2.89Å; A223-G226 PolarHBondContact O-N 3.34Å; A223-G226 VanDerWaalsContact O-N 3.1Å; R224-G226 VanDerWaalsContact C-N 3.3Å; G226-V228 PolarHBondContact O-N 2.92Å; G226-R272 WeakPolarHBondContact O-CD 3.4Å; G226-R272 WeakPolarHBondContact O-CG 3.41Å |
| 227 | H | 89.7 | Confident | 92.8 | Very high | 63 Ų | 63 | 37.5 Ų | 37.5 | 29% | 0.292 | 17% | 0.166 | S | C | . | . | trans | -75.3 | 86 | -179.2 | -67.2 | -40.4 | 0 | 0 | 0 | 111.8 | A222 L225 E229 L230 A231 | A222-H227 PolarHBondContact O-N 3.34Å; L225-H227 VanDerWaalsContact C-N 3.33Å; H227-E229 PolarHBondContact O-N 3.49Å; H227-L230 HydrophobicContact CB-CB 3.89Å; H227-L230 HydrophobicContact CB-CD2 4.42Å; H227-L230 PolarHBondContact O-N 3.03Å; H227-A231 PolarHBondContact O-N 3.19Å | ||
| 228 | V | 91.8 | Very high | 92.6 | Very high | 16 Ų | 16 | 40.1 Ų | 40.1 | 10% | 0.097 | 19% | 0.193 | C | C | . | . | H | α-helix | trans | -57.6 | -47.2 | -176.3 | -177.9 | 0 | 0 | 0 | 0 | 112.5 | G226 L230 A231 D232 R272 Q275 L276 L279 | G226-V228 PolarHBondContact O-N 2.92Å; V228-L230 VanDerWaalsContact C-N 3.35Å; V228-L230 PolarHBondContact O-N 2.98Å; V228-A231 PolarHBondContact O-N 2.91Å; V228-D232 PolarHBondContact O-N 3.16Å; V228-R272 HydrophobicContact CG2-CG 3.56Å; V228-Q275 HydrophobicContact CG1-CB 4.48Å; V228-Q275 HydrophobicContact CG1-CG 3.84Å; V228-Q275 HydrophobicContact CG2-CB 4.35Å; V228-Q275 HydrophobicContact CG2-CG 4.49Å; V228-L276 HydrophobicContact CG2-CB 4.23Å; V228-L279 HydrophobicContact CG1-CD1 4.16Å |
| 229 | E | 92.9 | Very high | 92.7 | Very high | 141 Ų | 141 | 40.3 Ų | 40.3 | 66% | 0.659 | 20% | 0.195 | S | C | * | . | H | α-helix | trans | -68.3 | -35.7 | -176.3 | -56.1 | 179.3 | 164.9 | 0 | 0 | 112 | L194 H227 D232 L233 | L194-E229 HydrophobicContact CD1-CB 3.51Å; H227-E229 PolarHBondContact O-N 3.49Å; E229-D232 PolarHBondContact O-N 2.99Å; E229-L233 WeakPolarHBondContact O-CB 3.48Å; E229-L233 PolarHBondContact O-N 3Å |
| 230 | L | 93.3 | Very high | 92.6 | Very high | 8 Ų | 8 | 42.9 Ų | 42.9 | 4% | 0.042 | 21% | 0.212 | C | C | . | . | H | α-helix | trans | -66.2 | -42.1 | 173.2 | 179.9 | 61.6 | 0 | 0 | 0 | 111 | T193 A197 A222 H227 V228 L233 L234 | T193-L230 HydrophobicContact CG2-CD1 4.42Å; T193-L230 HydrophobicContact CG2-CD2 3.83Å; A197-L230 HydrophobicContact CB-CD1 3.42Å; A197-L230 VanDerWaalsContact CB-CD1 3.42Å; A222-L230 HydrophobicContact CB-CB 4.31Å; A222-L230 HydrophobicContact CB-CD2 3.81Å; A222-L230 HydrophobicContact CB-CG 3.95Å; H227-L230 HydrophobicContact CB-CB 3.89Å; H227-L230 HydrophobicContact CB-CD2 4.42Å; H227-L230 PolarHBondContact O-N 3.03Å; V228-L230 VanDerWaalsContact C-N 3.35Å; V228-L230 PolarHBondContact O-N 2.98Å; L230-L233 PolarHBondContact O-N 2.87Å; L230-L234 HydrophobicContact CD1-CD1 4.35Å; L230-L234 HydrophobicContact CD1-CG 4.35Å; L230-L234 HydrophobicContact CG-CD1 4.09Å; L230-L234 WeakPolarHBondContact O-CB 3.45Å; L230-L234 VanDerWaalsContact O-CG 3.25Å; L230-L234 WeakPolarHBondContact O-CG 3.28Å; L230-L234 PolarHBondContact O-N 3.14Å |
| 231 | A | 94.4 | Very high | 92.6 | Very high | 0 Ų | 0 | 43.9 Ų | 43.9 | 0% | 0 | 22% | 0.219 | C | C | . | . | H | α-helix | trans | -62.7 | -42 | 175.6 | 0 | 0 | 0 | 0 | 0 | 111.9 | L219 A222 H227 V228 L234 L235 L276 | L219-A231 HydrophobicContact CD1-CB 3.84Å; A222-A231 HydrophobicContact CB-CB 4.35Å; H227-A231 PolarHBondContact O-N 3.19Å; V228-A231 PolarHBondContact O-N 2.91Å; A231-L234 PolarHBondContact O-N 2.92Å; A231-L235 WeakPolarHBondContact O-CB 3.28Å; A231-L235 WeakPolarHBondContact O-CG 3.45Å; A231-L235 PolarHBondContact O-N 3.06Å; A231-L276 HydrophobicContact CB-CD1 3.48Å; A231-L276 VanDerWaalsContact CB-CD1 3.48Å |
| 232 | D | 95.1 | Very high | 92.8 | Very high | 50 Ų | 50 | 46.2 Ų | 46.2 | 27% | 0.267 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -58.4 | -48.8 | 173.8 | -169.2 | 47.2 | 0 | 0 | 0 | 111.3 | V228 E229 L234 L235 R236 L279 | V228-D232 PolarHBondContact O-N 3.16Å; E229-D232 PolarHBondContact O-N 2.99Å; D232-L234 PolarHBondContact O-N 2.66Å; D232-L235 PolarHBondContact O-N 3.16Å; D232-R236 VanDerWaalsContact CG-NE 3.32Å; D232-R236 WeakPolarHBondContact O-CB 3.24Å; D232-R236 VanDerWaalsContact O-CG 3.27Å; D232-R236 WeakPolarHBondContact O-CG 3.33Å; D232-R236 PolarHBondContact O-N 3.19Å; D232-R236 IonicContact OD1-CZ 3.86Å; D232-R236 IonicContact OD1-NE 3.01Å; D232-R236 PolarHBondContact OD1-NE 2.8Å; D232-R236 IonicContact OD1-NH2 3.9Å; D232-R236 PolarHBondContact OD1-NH2 2.88Å; D232-R236 IonicContact OD2-CZ 2.62Å; D232-R236 VanDerWaalsContact OD2-CZ 3.31Å; D232-R236 IonicContact OD2-NE 3.88Å; D232-R236 PolarHBondContact OD2-NE 3.4Å; D232-R236 IonicContact OD2-NH2 3.88Å; D232-R236 PolarHBondContact OD2-NH2 3.24Å; D232-L279 HydrophobicContact CB-CD1 3.6Å |
| 233 | L | 94.9 | Very high | 92.9 | Very high | 12 Ų | 12 | 46.7 Ų | 46.7 | 6% | 0.063 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -58.7 | -47.7 | 178.1 | 177.6 | 68.8 | 0 | 0 | 0 | 111.6 | A197 E198 L201 E229 L230 R236 R237 | A197-L233 HydrophobicContact CB-CD2 3.88Å; E198-L233 HydrophobicContact CB-CD2 4.45Å; E198-L233 HydrophobicContact CG-CD1 3.77Å; E198-L233 HydrophobicContact CG-CD2 3.54Å; E198-L233 HydrophobicContact CG-CG 4.31Å; L201-L233 HydrophobicContact CD1-CD2 4.31Å; L201-L233 HydrophobicContact CD1-CG 4.29Å; E229-L233 WeakPolarHBondContact O-CB 3.48Å; E229-L233 PolarHBondContact O-N 3Å; L230-L233 PolarHBondContact O-N 2.87Å; L233-R236 PolarHBondContact O-N 2.9Å; L233-R237 HydrophobicContact CD1-CG 4.35Å; L233-R237 WeakPolarHBondContact O-CB 3.4Å; L233-R237 WeakPolarHBondContact O-CG 3.35Å; L233-R237 PolarHBondContact O-N 2.95Å; L233-R237 VanDerWaalsContact O-N 3.08Å |
| 234 | L | 95.3 | Very high | 93 | Very high | 1 Ų | 1 | 52.7 Ų | 52.7 | 1% | 0.005 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -62 | -44.9 | -179.5 | -71.4 | 170.2 | 0 | 0 | 0 | 111.4 | L185 L201 V207 P218 L219 A222 L230 A231 D232 R237 G238 A239 | L185-L234 HydrophobicContact CD2-CD2 4.03Å; L185-L234 HydrophobicContact CG-CD2 4.49Å; L201-L234 HydrophobicContact CD1-CD2 4.2Å; V207-L234 HydrophobicContact CG1-CD2 4.31Å; P218-L234 HydrophobicContact CB-CD1 3.93Å; P218-L234 HydrophobicContact CB-CD2 4.21Å; L219-L234 HydrophobicContact CB-CD1 4.32Å; L219-L234 HydrophobicContact CD1-CB 4.26Å; L219-L234 HydrophobicContact CD1-CD1 4.37Å; A222-L234 HydrophobicContact CB-CD1 4.22Å; L230-L234 HydrophobicContact CD1-CD1 4.35Å; L230-L234 HydrophobicContact CD1-CG 4.35Å; L230-L234 HydrophobicContact CG-CD1 4.09Å; L230-L234 WeakPolarHBondContact O-CB 3.45Å; L230-L234 VanDerWaalsContact O-CG 3.25Å; L230-L234 WeakPolarHBondContact O-CG 3.28Å; L230-L234 PolarHBondContact O-N 3.14Å; A231-L234 PolarHBondContact O-N 2.92Å; D232-L234 PolarHBondContact O-N 2.66Å; L234-R237 CarbonylContact O-C 3.59Å; L234-R237 WeakPolarHBondContact O-CA 3.43Å; L234-R237 PolarHBondContact O-N 2.69Å; L234-R237 VanDerWaalsContact O-N 3.1Å; L234-G238 PolarHBondContact O-N 2.87Å; L234-A239 HydrophobicContact CB-CB 4Å; L234-A239 VanDerWaalsContact O-CB 3.23Å; L234-A239 WeakPolarHBondContact O-CB 3.32Å; L234-A239 PolarHBondContact O-N 2.63Å |
| 235 | L | 95.4 | Very high | 93.1 | Very high | 26 Ų | 26 | 48.9 Ų | 48.9 | 14% | 0.136 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -64.9 | -41.8 | 177.8 | -73.4 | 171.1 | 0 | 0 | 0 | 112.4 | L219 A231 D232 R237 G238 A239 P241 L279 L280 A283 | L219-L235 HydrophobicContact CD1-CG 4.19Å; L219-L235 HydrophobicContact CD2-CD2 3.72Å; L219-L235 HydrophobicContact CD2-CG 4.22Å; A231-L235 WeakPolarHBondContact O-CB 3.28Å; A231-L235 WeakPolarHBondContact O-CG 3.45Å; A231-L235 PolarHBondContact O-N 3.06Å; D232-L235 PolarHBondContact O-N 3.16Å; L235-R237 PolarHBondContact O-N 3.17Å; L235-G238 PolarHBondContact O-N 3.28Å; L235-A239 HydrophobicContact CD2-CB 4.35Å; L235-P241 HydrophobicContact CD2-CB 4.01Å; L235-L279 HydrophobicContact CD1-CD2 3.13Å; L235-L279 HydrophobicContact CD1-CG 4.47Å; L235-L279 HydrophobicContact CG-CD2 4.42Å; L235-L280 HydrophobicContact CD1-CD2 3.97Å; L235-A283 HydrophobicContact CB-CB 4.47Å; L235-A283 HydrophobicContact CD1-CB 3.62Å; L235-A283 HydrophobicContact CD2-CB 3.93Å; L235-A283 HydrophobicContact CG-CB 4.22Å |
| 236 | R | 94.9 | Very high | 93.3 | Very high | 184 Ų | 184 | 47.8 Ų | 47.8 | 69% | 0.694 | 25% | 0.245 | S | C | * | . | H | α-helix | trans | -60.7 | -26.7 | 172.8 | -72.3 | 177.1 | -168.2 | -80.1 | -8.1 | 113 | D232 L233 G238 | D232-R236 VanDerWaalsContact CG-NE 3.32Å; D232-R236 WeakPolarHBondContact O-CB 3.24Å; D232-R236 VanDerWaalsContact O-CG 3.27Å; D232-R236 WeakPolarHBondContact O-CG 3.33Å; D232-R236 PolarHBondContact O-N 3.19Å; D232-R236 IonicContact OD1-CZ 3.86Å; D232-R236 IonicContact OD1-NE 3.01Å; D232-R236 PolarHBondContact OD1-NE 2.8Å; D232-R236 IonicContact OD1-NH2 3.9Å; D232-R236 PolarHBondContact OD1-NH2 2.88Å; D232-R236 IonicContact OD2-CZ 2.62Å; D232-R236 VanDerWaalsContact OD2-CZ 3.31Å; D232-R236 IonicContact OD2-NE 3.88Å; D232-R236 PolarHBondContact OD2-NE 3.4Å; D232-R236 IonicContact OD2-NH2 3.88Å; D232-R236 PolarHBondContact OD2-NH2 3.24Å; L233-R236 PolarHBondContact O-N 2.9Å; R236-G238 VanDerWaalsContact C-N 3.3Å |
| 237 | R | 93.8 | Very high | 93.4 | Very high | 110 Ų | 110 | 52.9 Ų | 52.9 | 42% | 0.415 | 27% | 0.268 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -91.8 | 9.1 | 177.8 | -61.8 | -71.2 | 179.4 | 80 | 7.3 | 112.7 | L201 V207 L233 L234 L235 | L201-R237 HydrophobicContact CD1-CB 4.15Å; L201-R237 HydrophobicContact CD1-CG 3.87Å; V207-R237 HydrophobicContact CG2-CB 4.15Å; L233-R237 HydrophobicContact CD1-CG 4.35Å; L233-R237 WeakPolarHBondContact O-CB 3.4Å; L233-R237 WeakPolarHBondContact O-CG 3.35Å; L233-R237 PolarHBondContact O-N 2.95Å; L233-R237 VanDerWaalsContact O-N 3.08Å; L234-R237 CarbonylContact O-C 3.59Å; L234-R237 WeakPolarHBondContact O-CA 3.43Å; L234-R237 PolarHBondContact O-N 2.69Å; L234-R237 VanDerWaalsContact O-N 3.1Å; L235-R237 PolarHBondContact O-N 3.17Å |
| 238 | G | 92.1 | Very high | 93.5 | Very high | 56 Ų | 56 | 50.3 Ų | 50.3 | 58% | 0.577 | 26% | 0.258 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 90.6 | 22.2 | 171.8 | 0 | 0 | 0 | 0 | 0 | 114.7 | L234 L235 R236 | L234-G238 PolarHBondContact O-N 2.87Å; L235-G238 PolarHBondContact O-N 3.28Å; R236-G238 VanDerWaalsContact C-N 3.3Å |
| 239 | A | 94.7 | Very high | 93.5 | Very high | 6 Ų | 6 | 51.9 Ų | 51.9 | 5% | 0.05 | 26% | 0.262 | C | S | . | . | trans | -60.2 | 140 | 172.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | V207 D208 L219 L234 L235 P241 | V207-A239 HydrophobicContact CG1-CB 3.51Å; D208-A239 WeakPolarHBondContact OD1-CA 3.46Å; L219-A239 HydrophobicContact CD2-CB 4.09Å; L234-A239 HydrophobicContact CB-CB 4Å; L234-A239 VanDerWaalsContact O-CB 3.23Å; L234-A239 WeakPolarHBondContact O-CB 3.32Å; L234-A239 PolarHBondContact O-N 2.63Å; L235-A239 HydrophobicContact CD2-CB 4.35Å; A239-P241 VanDerWaalsContact O-CD 3.31Å; A239-P241 WeakPolarHBondContact O-CD 3.37Å | ||
| 240 | C | 94.4 | Very high | 93.6 | Very high | 55 Ų | 55 | 45.2 Ų | 45.2 | 37% | 0.372 | 23% | 0.231 | S | C | . | . | trans | -76 | 116.3 | 176.4 | -175.4 | 0 | 0 | 0 | 0 | 110.6 | D208 D242 A243 | D208-C240 PolarHBondContact OD1-N 3.41Å; D208-C240 PolarHBondContact OD2-N 2.72Å; C240-D242 PolarHBondContact O-N 2.95Å; C240-A243 HydrophobicContact CB-CB 4.24Å; C240-A243 PolarHBondContact O-N 3.26Å | ||
| 241 | P | 94.3 | Very high | 93.7 | Very high | 22 Ų | 22 | 44.8 Ų | 44.8 | 14% | 0.143 | 23% | 0.229 | C | C | . | . | T | Hydrogen-bonded Turn | trans | -68.4 | -22.3 | -179 | 28.2 | -35.1 | 0 | 0 | 0 | 113.3 | L235 A239 P251 A285 | L235-P241 HydrophobicContact CD2-CB 4.01Å; A239-P241 VanDerWaalsContact O-CD 3.31Å; A239-P241 WeakPolarHBondContact O-CD 3.37Å; P241-P251 VanDerWaalsContact O-CD 3.28Å; P241-P251 WeakPolarHBondContact O-CD 3.35Å; P241-A285 HydrophobicContact CB-CB 3.99Å |
| 242 | D | 94.1 | Very high | 93.7 | Very high | 58 Ų | 58 | 44.8 Ų | 44.8 | 31% | 0.31 | 23% | 0.229 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -106.2 | 17.9 | -179.4 | -66.5 | -37.6 | 0 | 0 | 0 | 113.2 | C240 R244 A285 D286 | C240-D242 PolarHBondContact O-N 2.95Å; D242-R244 PolarHBondContact O-N 3.48Å; D242-A285 WeakPolarHBondContact OD1-CA 3.3Å; D242-D286 PolarHBondContact OD1-N 3.16Å |
| 243 | A | 94.1 | Very high | 93.6 | Very high | 10 Ų | 10 | 42.4 Ų | 42.4 | 8% | 0.083 | 22% | 0.216 | C | C | . | . | trans | -53.8 | 135 | 172.7 | 0 | 0 | 0 | 0 | 0 | 109.6 | T217 H220 C240 T250 P251 | T217-A243 HydrophobicContact CG2-CB 3.82Å; H220-A243 PolarHBondContact CE1-O 2.88Å; H220-A243 PolarHBondContact NE2-O 3.48Å; C240-A243 HydrophobicContact CB-CB 4.24Å; C240-A243 PolarHBondContact O-N 3.26Å; A243-T250 WeakPolarHBondContact O-CA 3.38Å; A243-P251 VanDerWaalsContact O-CD 3.28Å; A243-P251 WeakPolarHBondContact O-CD 3.42Å | ||
| 244 | R | 93.7 | Very high | 93.4 | Very high | 125 Ų | 125 | 42.1 Ų | 42.1 | 47% | 0.472 | 22% | 0.215 | S | C | . | . | trans | -107.9 | 131.6 | 177.4 | -66.2 | -173.8 | -178.9 | -156.1 | -3.6 | 110.2 | D242 W249 T250 | D242-R244 PolarHBondContact O-N 3.48Å; R244-W249 VanDerWaalsContact CA-O 3.32Å; R244-W249 WeakPolarHBondContact CA-O 3.2Å; R244-T250 HydrophobicContact CG-CG2 4.22Å | ||
| 245 | N | 92.7 | Very high | 93.2 | Very high | 14 Ų | 14 | 42 Ų | 42 | 8% | 0.075 | 22% | 0.215 | C | C | . | . | trans | -81.2 | -176.2 | 171.2 | 81.1 | -8.8 | 0 | 0 | 0 | 111.2 | E214 E216 E247 G248 W249 | E214-N245 WeakPolarHBondContact O-CB 3.28Å; E216-N245 HydrophobicContact CG-CB 4.02Å; N245-E247 PolarHBondContact O-N 3.4Å; N245-E247 PolarHBondContact OD1-N 2.87Å; N245-G248 PolarHBondContact O-N 2.85Å; N245-G248 PolarHBondContact OD1-N 3.1Å; N245-G248 VanDerWaalsContact OD1-N 3.14Å; N245-W249 PolarHBondContact N-O 2.91Å; N245-W249 WeakPolarHBondContact OD1-CA 3.45Å; N245-W249 WeakPolarHBondContact OD1-CB 2.82Å; N245-W249 PolarHBondContact OD1-N 2.91Å | ||
| 246 | A | 91.3 | Very high | 92.9 | Very high | 44 Ų | 44 | 40.8 Ų | 40.8 | 36% | 0.364 | 21% | 0.209 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -61.8 | -25.2 | -176.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | E214 E215 Q292 | E214-A246 WeakPolarHBondContact O-CB 3.49Å; E214-A246 PolarHBondContact O-N 3.42Å; E215-A246 HydrophobicContact CB-CB 4.24Å; E215-A246 HydrophobicContact CG-CB 4.32Å; A246-Q292 PolarHBondContact O-NE2 2.92Å |
| 247 | E | 88.6 | Confident | 92.6 | Very high | 110 Ų | 110 | 33.2 Ų | 33.2 | 51% | 0.514 | 18% | 0.182 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -92 | 1.8 | 176.1 | -62.6 | -177.8 | 177.7 | 0 | 0 | 112.6 | N245 W249 Q292 | N245-E247 PolarHBondContact O-N 3.4Å; N245-E247 PolarHBondContact OD1-N 2.87Å; E247-W249 VanDerWaalsContact C-N 3.28Å; E247-W249 VanDerWaalsContact CB-CD1 3.44Å; E247-W249 HydrophobicContact CB-CG 4.46Å; E247-W249 PolarHBondContact O-N 3.01Å; E247-W249 PolarHBondContact OE2-NE1 3.2Å; E247-Q292 WeakPolarHBondContact O-CB 3.16Å; E247-Q292 WeakPolarHBondContact O-CG 3.3Å; E247-Q292 PolarHBondContact O-N 3Å |
| 248 | G | 91 | Very high | 92.1 | Very high | 8 Ų | 8 | 29 Ų | 29 | 8% | 0.082 | 17% | 0.168 | C | C | . | . | trans | 77.3 | 10.3 | -176.1 | 0 | 0 | 0 | 0 | 0 | 114.4 | N245 | N245-G248 PolarHBondContact O-N 2.85Å; N245-G248 PolarHBondContact OD1-N 3.1Å; N245-G248 VanDerWaalsContact OD1-N 3.14Å | ||
| 249 | W | 93.1 | Very high | 91.2 | Very high | 49 Ų | 49 | 34.4 Ų | 34.4 | 19% | 0.186 | 17% | 0.171 | C | C | . | . | trans | -71 | 141.7 | 176.4 | -69.4 | 46.2 | 0 | 0 | 0 | 110.3 | H220 R244 N245 E247 L253 A254 D257 L300 | H220-W249 PolarHBondContact NE2-O 3.46Å; R244-W249 VanDerWaalsContact CA-O 3.32Å; R244-W249 WeakPolarHBondContact CA-O 3.2Å; N245-W249 PolarHBondContact N-O 2.91Å; N245-W249 WeakPolarHBondContact OD1-CA 3.45Å; N245-W249 WeakPolarHBondContact OD1-CB 2.82Å; N245-W249 PolarHBondContact OD1-N 2.91Å; E247-W249 VanDerWaalsContact C-N 3.28Å; E247-W249 VanDerWaalsContact CB-CD1 3.44Å; E247-W249 HydrophobicContact CB-CG 4.46Å; E247-W249 PolarHBondContact O-N 3.01Å; E247-W249 PolarHBondContact OE2-NE1 3.2Å; W249-L253 HydrophobicContact CB-CB 4.41Å; W249-L253 HydrophobicContact CD2-CB 4.46Å; W249-L253 HydrophobicContact CE3-CB 4.12Å; W249-A254 HydrophobicContact CE3-CB 4.45Å; W249-D257 HydrophobicContact CH2-CB 3.95Å; W249-D257 HydrophobicContact CZ3-CB 3.67Å; W249-L300 HydrophobicContact CH2-CD1 4.39Å; W249-L300 HydrophobicContact CZ3-CD1 4.33Å | ||
| 250 | T | 94.9 | Very high | 89.9 | Confident | 1 Ų | 1 | 36.3 Ų | 36.3 | 1% | 0.006 | 18% | 0.184 | C | C | . | . | trans | -97.5 | 161.9 | 168.1 | 61.6 | 0 | 0 | 0 | 0 | 110.1 | A243 R244 L252 L253 A254 A289 | A243-T250 WeakPolarHBondContact O-CA 3.38Å; R244-T250 HydrophobicContact CG-CG2 4.22Å; T250-L252 PolarHBondContact O-N 3.27Å; T250-L252 VanDerWaalsContact O-N 3.16Å; T250-L253 WeakPolarHBondContact O-CB 3.42Å; T250-L253 PolarHBondContact O-N 3.42Å; T250-L253 PolarHBondContact OG1-N 3.22Å; T250-A254 PolarHBondContact O-N 3.38Å; T250-A289 HydrophobicContact CG2-CB 3.75Å | ||
| 251 | P | 94.1 | Very high | 88.5 | Confident | 0 Ų | 0 | 43.2 Ų | 43.2 | 0% | 0 | 21% | 0.211 | C | C | . | . | H | α-helix | trans | -53 | -34.1 | 170.5 | -26.9 | 33.3 | 0 | 0 | 0 | 113.1 | L219 H220 A223 P241 A243 A254 A255 L280 | L219-P251 HydrophobicContact CB-CG 4.31Å; L219-P251 HydrophobicContact CD2-CB 4.08Å; L219-P251 HydrophobicContact CD2-CG 3.79Å; L219-P251 HydrophobicContact CG-CB 3.88Å; L219-P251 HydrophobicContact CG-CG 3.88Å; H220-P251 WeakPolarHBondContact NE2-CD 3.35Å; A223-P251 HydrophobicContact CB-CB 4.31Å; A223-P251 VanDerWaalsContact CB-O 3.3Å; A223-P251 WeakPolarHBondContact CB-O 3.22Å; P241-P251 VanDerWaalsContact O-CD 3.28Å; P241-P251 WeakPolarHBondContact O-CD 3.35Å; A243-P251 VanDerWaalsContact O-CD 3.28Å; A243-P251 WeakPolarHBondContact O-CD 3.42Å; P251-A254 PolarHBondContact O-N 3Å; P251-A255 WeakPolarHBondContact O-CB 3.4Å; P251-A255 PolarHBondContact O-N 3.02Å; P251-L280 HydrophobicContact CB-CD1 4.27Å; P251-L280 HydrophobicContact CB-CD2 4.04Å |
| 252 | L | 94.7 | Very high | 87 | Confident | 0 Ų | 0 | 44.5 Ų | 44.5 | 0% | 0 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -67 | -40.6 | 176.2 | -174.2 | 65.9 | 0 | 0 | 0 | 112.3 | T250 A255 C256 C277 L280 L281 A285 P297 L313 | T250-L252 PolarHBondContact O-N 3.27Å; T250-L252 VanDerWaalsContact O-N 3.16Å; L252-A255 PolarHBondContact O-N 3.05Å; L252-C256 PolarHBondContact O-N 3.39Å; L252-C256 PolarHBondContact O-SG 2.9Å; L252-C277 HydrophobicContact CD1-CB 4.05Å; L252-L280 HydrophobicContact CB-CD1 4.31Å; L252-L280 HydrophobicContact CD1-CB 4.22Å; L252-L280 HydrophobicContact CD1-CD1 4.2Å; L252-L281 HydrophobicContact CD1-CG 4.23Å; L252-L281 HydrophobicContact CD2-CD2 3.78Å; L252-L281 HydrophobicContact CD2-CG 4.34Å; L252-A285 HydrophobicContact CD2-CB 4.44Å; L252-P297 HydrophobicContact CD2-CB 4.17Å; L252-P297 HydrophobicContact CD2-CG 3.74Å; L252-P297 HydrophobicContact CG-CB 4.2Å; L252-P297 HydrophobicContact CG-CG 3.97Å; L252-L313 HydrophobicContact CD2-CD2 4.39Å |
| 253 | L | 93.3 | Very high | 85.6 | Confident | 0 Ų | 0 | 48 Ų | 48 | 0% | 0 | 24% | 0.237 | C | C | . | . | H | α-helix | trans | -62.2 | -45.1 | 172.6 | -76.7 | 163.3 | 0 | 0 | 0 | 111 | W249 T250 A255 C256 D257 D291 R296 P297 L300 | W249-L253 HydrophobicContact CB-CB 4.41Å; W249-L253 HydrophobicContact CD2-CB 4.46Å; W249-L253 HydrophobicContact CE3-CB 4.12Å; T250-L253 WeakPolarHBondContact O-CB 3.42Å; T250-L253 PolarHBondContact O-N 3.42Å; T250-L253 PolarHBondContact OG1-N 3.22Å; L253-A255 VanDerWaalsContact C-N 3.34Å; L253-A255 PolarHBondContact O-N 3.21Å; L253-C256 PolarHBondContact O-N 3.16Å; L253-C256 VanDerWaalsContact O-N 3.16Å; L253-D257 PolarHBondContact O-N 2.87Å; L253-D257 VanDerWaalsContact O-N 3.09Å; L253-D291 HydrophobicContact CD1-CB 3.99Å; L253-R296 VanDerWaalsContact CD2-C 3.48Å; L253-P297 HydrophobicContact CD2-CG 4.02Å; L253-P297 HydrophobicContact CG-CG 4.19Å; L253-L300 HydrophobicContact CB-CD1 4.15Å; L253-L300 HydrophobicContact CD2-CD1 3.53Å; L253-L300 HydrophobicContact CD2-CG 4.34Å; L253-L300 HydrophobicContact CG-CD1 4.48Å |
| 254 | A | 91.8 | Very high | 84.3 | Confident | 5 Ų | 5 | 52.9 Ų | 52.9 | 4% | 0.041 | 27% | 0.267 | C | S | . | . | H | α-helix | trans | -61 | -40.1 | 176.4 | 0 | 0 | 0 | 0 | 0 | 112.6 | A223 W249 T250 P251 C256 D257 | A223-A254 HydrophobicContact CB-CB 4.21Å; W249-A254 HydrophobicContact CE3-CB 4.45Å; T250-A254 PolarHBondContact O-N 3.38Å; P251-A254 PolarHBondContact O-N 3Å; A254-C256 VanDerWaalsContact C-N 3.34Å; A254-D257 PolarHBondContact O-N 3.33Å |
| 255 | A | 91.3 | Very high | 83.2 | Confident | 0 Ų | 0 | 51.3 Ų | 51.3 | 0% | 0 | 27% | 0.268 | C | S | . | . | H | α-helix | trans | -63.9 | -37.3 | 175 | 0 | 0 | 0 | 0 | 0 | 112.6 | A223 P251 L252 L253 V258 L276 L280 | A223-A255 HydrophobicContact CB-CB 4.24Å; P251-A255 WeakPolarHBondContact O-CB 3.4Å; P251-A255 PolarHBondContact O-N 3.02Å; L252-A255 PolarHBondContact O-N 3.05Å; L253-A255 VanDerWaalsContact C-N 3.34Å; L253-A255 PolarHBondContact O-N 3.21Å; A255-V258 WeakPolarHBondContact O-CG2 3.44Å; A255-L276 HydrophobicContact CB-CD2 3.47Å; A255-L276 VanDerWaalsContact CB-CD2 3.47Å; A255-L276 HydrophobicContact CB-CG 3.96Å; A255-L280 HydrophobicContact CB-CD1 4.06Å |
| 256 | C | 88.8 | Confident | 82.3 | Confident | 0 Ų | 0 | 52 Ų | 52 | 0% | 0 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -75.4 | -24 | 179.6 | -68.2 | 0 | 0 | 0 | 0 | 113.2 | L252 L253 A254 V258 L300 R304 | L252-C256 PolarHBondContact O-N 3.39Å; L252-C256 PolarHBondContact O-SG 2.9Å; L253-C256 PolarHBondContact O-N 3.16Å; L253-C256 VanDerWaalsContact O-N 3.16Å; A254-C256 VanDerWaalsContact C-N 3.34Å; C256-V258 VanDerWaalsContact C-N 3.35Å; C256-L300 HydrophobicContact CB-CB 3.94Å; C256-R304 WeakPolarHBondContact O-CG 3.47Å |
| 257 | D | 88.1 | Confident | 81.6 | Confident | 25 Ų | 25 | 56.8 Ų | 56.8 | 13% | 0.134 | 29% | 0.29 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -83.4 | -6.8 | -179.6 | -162.6 | 49.9 | 0 | 0 | 0 | 114.6 | W249 L253 A254 R259 L300 R304 | W249-D257 HydrophobicContact CH2-CB 3.95Å; W249-D257 HydrophobicContact CZ3-CB 3.67Å; L253-D257 PolarHBondContact O-N 2.87Å; L253-D257 VanDerWaalsContact O-N 3.09Å; A254-D257 PolarHBondContact O-N 3.33Å; D257-R259 PolarHBondContact O-N 2.98Å; D257-R259 VanDerWaalsContact O-N 3.15Å; D257-L300 HydrophobicContact CB-CD1 4.29Å; D257-R304 VanDerWaalsContact CG-NH2 3.28Å; D257-R304 PolarHBondContact O-NE 2.72Å; D257-R304 VanDerWaalsContact O-NE 3.1Å; D257-R304 IonicContact OD1-CZ 3.19Å; D257-R304 IonicContact OD1-NE 2.99Å; D257-R304 PolarHBondContact OD1-NE 3.49Å; D257-R304 IonicContact OD1-NH2 2.67Å; D257-R304 PolarHBondContact OD1-NH2 3.26Å; D257-R304 IonicContact OD2-NH2 2.94Å; D257-R304 PolarHBondContact OD2-NH2 3.38Å |
| 258 | V | 82.5 | Confident | 81.2 | Confident | 21 Ų | 21 | 54 Ų | 54 | 13% | 0.127 | 29% | 0.286 | C | S | . | . | trans | -53.6 | 123.7 | -176.5 | 177.6 | 0 | 0 | 0 | 0 | 110.9 | A255 C256 T269 H306 | A255-V258 WeakPolarHBondContact O-CG2 3.44Å; C256-V258 VanDerWaalsContact C-N 3.35Å; V258-T269 HydrophobicContact CG1-CG2 3.76Å; V258-H306 PolarHBondContact O-NE2 3Å | ||
| 259 | R | 74.6 | Confident | 80.8 | Confident | 169 Ų | 169 | 54.3 Ų | 54.3 | 64% | 0.638 | 29% | 0.286 | S | S | * | . | trans | -93.5 | 129.6 | -176.9 | -72.7 | -178.9 | -99.5 | -170.5 | -3.3 | 110.8 | D257 Q261 | D257-R259 PolarHBondContact O-N 2.98Å; D257-R259 VanDerWaalsContact O-N 3.15Å; R259-Q261 PolarHBondContact O-N 2.71Å | ||
| 260 | C | 66.6 | Low | 80.2 | Confident | 47 Ų | 47 | 54.5 Ų | 54.5 | 32% | 0.318 | 29% | 0.293 | S | S | . | . | trans | -72 | 115.7 | 166.3 | -56.6 | 0 | 0 | 0 | 0 | 108.9 | A266 | C260-A266 HydrophobicContact CB-CB 4.24Š| ||
| 261 | Q | 65.3 | Low | 79.8 | Confident | 199 Ų | 199 | 57.1 Ų | 57.1 | 93% | 0.93 | 31% | 0.314 | S | S | * | . | S | Bend | trans | -83.2 | -23.8 | 178.7 | -63.7 | 177.7 | 8.6 | 0 | 0 | 112.3 | R259 | R259-Q261 PolarHBondContact O-N 2.71Š|
| 262 | S | 63.3 | Low | 79.5 | Confident | 49 Ų | 49 | 61.7 Ų | 61.7 | 34% | 0.343 | 33% | 0.332 | S | S | . | . | S | Bend | trans | -132.7 | 149.3 | 176.9 | 177.9 | 0 | 0 | 0 | 0 | 111 | T264 A266 | S262-T264 VanDerWaalsContact C-N 3.29Å; S262-T264 PolarHBondContact OG-N 2.9Å; S262-T264 PolarHBondContact OG-OG1 2.68Å; S262-A266 PolarHBondContact O-N 3.23Å |
| 263 | I | 63.4 | Low | 79.2 | Confident | 131 Ų | 131 | 61.8 Ų | 61.8 | 67% | 0.672 | 33% | 0.332 | S | S | * | . | S | Bend | trans | -67.6 | -32.3 | 174.7 | -60.7 | 165.8 | 0 | 0 | 0 | 110.6 | D265 A266 | I263-D265 VanDerWaalsContact C-N 3.28Å; I263-D265 PolarHBondContact O-N 3.21Å; I263-A266 WeakPolarHBondContact O-CB 3.36Å; I263-A266 PolarHBondContact O-N 3.06Å |
| 264 | T | 66.3 | Low | 79.1 | Confident | 114 Ų | 114 | 64.5 Ų | 64.5 | 70% | 0.699 | 35% | 0.347 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -67 | -29.7 | -179.4 | 58 | 0 | 0 | 0 | 0 | 113 | S262 | S262-T264 VanDerWaalsContact C-N 3.29Å; S262-T264 PolarHBondContact OG-N 2.9Å; S262-T264 PolarHBondContact OG-OG1 2.68Å |
| 265 | D | 71.8 | Confident | 79.2 | Confident | 92 Ų | 92 | 70 Ų | 70 | 49% | 0.492 | 37% | 0.371 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -104.5 | 4.3 | -173.7 | -55.2 | -13.9 | 0 | 0 | 0 | 111.7 | I263 E267 A268 T269 | I263-D265 VanDerWaalsContact C-N 3.28Å; I263-D265 PolarHBondContact O-N 3.21Å; D265-E267 PolarHBondContact O-N 2.65Å; D265-A268 PolarHBondContact O-N 3.35Å; D265-T269 VanDerWaalsContact O-CB 3.27Å; D265-T269 WeakPolarHBondContact O-CB 3.44Å; D265-T269 PolarHBondContact O-N 3.25Å; D265-T269 PolarHBondContact O-OG1 3.18Å |
| 266 | A | 73.2 | Confident | 79.3 | Confident | 27 Ų | 27 | 70 Ų | 70 | 22% | 0.223 | 37% | 0.371 | C | S | . | . | H | α-helix | trans | -62.5 | -44.6 | -176 | 0 | 0 | 0 | 0 | 0 | 111.5 | C260 S262 I263 T269 T270 | C260-A266 HydrophobicContact CB-CB 4.24Å; S262-A266 PolarHBondContact O-N 3.23Å; I263-A266 WeakPolarHBondContact O-CB 3.36Å; I263-A266 PolarHBondContact O-N 3.06Å; A266-T269 PolarHBondContact O-N 3.48Å; A266-T270 WeakPolarHBondContact O-CG2 3.42Å; A266-T270 PolarHBondContact O-N 3.29Å; A266-T270 PolarHBondContact O-OG1 3.47Å |
| 267 | E | 76.4 | Confident | 79.5 | Confident | 145 Ų | 145 | 70 Ų | 70 | 68% | 0.678 | 37% | 0.371 | S | S | * | . | H | α-helix | trans | -62.3 | -51.1 | 178.3 | -67.4 | -176.9 | 176.3 | 0 | 0 | 111.4 | D265 T269 T270 A271 | D265-E267 PolarHBondContact O-N 2.65Å; E267-T269 VanDerWaalsContact C-N 3.26Å; E267-T269 PolarHBondContact O-N 3.44Å; E267-T270 PolarHBondContact O-N 3.22Å; E267-T270 PolarHBondContact O-OG1 3.2Å; E267-A271 WeakPolarHBondContact O-CB 3.3Å; E267-A271 PolarHBondContact O-N 3.33Å |
| 268 | A | 81.6 | Confident | 79.8 | Confident | 53 Ų | 53 | 71.7 Ų | 71.7 | 44% | 0.438 | 39% | 0.385 | S | S | . | . | H | α-helix | trans | -60.1 | -37.7 | 177.5 | 0 | 0 | 0 | 0 | 0 | 112.2 | D265 R272 | D265-A268 PolarHBondContact O-N 3.35Å; A268-R272 WeakPolarHBondContact O-CB 3.29Å; A268-R272 PolarHBondContact O-N 3.06Å |
| 269 | T | 82 | Confident | 80.4 | Confident | 14 Ų | 14 | 71.9 Ų | 71.9 | 9% | 0.086 | 39% | 0.386 | C | S | . | . | H | α-helix | trans | -67.4 | -44.9 | 176.3 | -57.2 | 0 | 0 | 0 | 0 | 111.2 | V258 D265 A266 E267 A271 R272 C273 | V258-T269 HydrophobicContact CG1-CG2 3.76Å; D265-T269 VanDerWaalsContact O-CB 3.27Å; D265-T269 WeakPolarHBondContact O-CB 3.44Å; D265-T269 PolarHBondContact O-N 3.25Å; D265-T269 PolarHBondContact O-OG1 3.18Å; A266-T269 PolarHBondContact O-N 3.48Å; E267-T269 VanDerWaalsContact C-N 3.26Å; E267-T269 PolarHBondContact O-N 3.44Å; T269-A271 PolarHBondContact O-N 2.92Å; T269-R272 PolarHBondContact O-N 3.31Å; T269-C273 WeakPolarHBondContact O-CB 3.3Å; T269-C273 PolarHBondContact O-N 2.62Å; T269-C273 PolarHBondContact O-SG 3.35Å |
| 270 | T | 80.3 | Confident | 81.4 | Confident | 52 Ų | 52 | 63.9 Ų | 63.9 | 32% | 0.319 | 36% | 0.355 | S | S | . | . | H | α-helix | trans | -63.5 | -39.9 | 177.2 | 63.5 | 0 | 0 | 0 | 0 | 112.1 | A266 E267 C273 L274 H306 | A266-T270 WeakPolarHBondContact O-CG2 3.42Å; A266-T270 PolarHBondContact O-N 3.29Å; A266-T270 PolarHBondContact O-OG1 3.47Å; E267-T270 PolarHBondContact O-N 3.22Å; E267-T270 PolarHBondContact O-OG1 3.2Å; T270-C273 PolarHBondContact O-N 3.43Å; T270-L274 WeakPolarHBondContact O-CB 3.5Å; T270-L274 PolarHBondContact O-N 3.05Å; T270-H306 WeakPolarHBondContact CG2-ND1 3.39Å |
| 271 | A | 86.2 | Confident | 82.7 | Confident | 56 Ų | 56 | 63 Ų | 63 | 46% | 0.463 | 35% | 0.347 | S | S | . | . | H | α-helix | trans | -63 | -43.6 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.4 | E267 T269 L274 Q275 | E267-A271 WeakPolarHBondContact O-CB 3.3Å; E267-A271 PolarHBondContact O-N 3.33Å; T269-A271 PolarHBondContact O-N 2.92Å; A271-L274 PolarHBondContact O-N 3.3Å; A271-Q275 WeakPolarHBondContact O-CB 3.2Å; A271-Q275 PolarHBondContact O-N 2.92Å |
| 272 | R | 88.1 | Confident | 84.1 | Confident | 96 Ų | 96 | 58.2 Ų | 58.2 | 36% | 0.362 | 34% | 0.336 | S | S | . | . | H | α-helix | trans | -64.8 | -42.9 | 176.6 | -161.2 | 179.2 | -48 | 104.4 | -1.7 | 112.2 | G226 V228 A268 T269 L274 Q275 L276 | G226-R272 WeakPolarHBondContact O-CD 3.4Å; G226-R272 WeakPolarHBondContact O-CG 3.41Å; V228-R272 HydrophobicContact CG2-CG 3.56Å; A268-R272 WeakPolarHBondContact O-CB 3.29Å; A268-R272 PolarHBondContact O-N 3.06Å; T269-R272 PolarHBondContact O-N 3.31Å; R272-L274 VanDerWaalsContact C-N 3.34Å; R272-Q275 PolarHBondContact O-N 3.36Å; R272-L276 VanDerWaalsContact O-CB 3.28Å; R272-L276 WeakPolarHBondContact O-CB 3.35Å; R272-L276 PolarHBondContact O-N 2.92Å |
| 273 | C | 88.8 | Confident | 85.5 | Confident | 3 Ų | 3 | 58.2 Ų | 58.2 | 2% | 0.02 | 34% | 0.339 | C | S | . | . | H | α-helix | trans | -61.3 | -43.8 | 175.2 | -65 | 0 | 0 | 0 | 0 | 111.1 | T269 T270 L276 C277 V309 | T269-C273 WeakPolarHBondContact O-CB 3.3Å; T269-C273 PolarHBondContact O-N 2.62Å; T269-C273 PolarHBondContact O-SG 3.35Å; T270-C273 PolarHBondContact O-N 3.43Å; C273-L276 PolarHBondContact O-N 3.39Å; C273-C277 WeakPolarHBondContact O-CB 3.39Å; C273-C277 PolarHBondContact O-N 2.9Å; C273-C277 PolarHBondContact O-SG 2.86Å; C273-V309 HydrophobicContact CB-CG2 4.44Å |
| 274 | L | 90.9 | Very high | 86.8 | Confident | 57 Ų | 57 | 54.3 Ų | 54.3 | 30% | 0.298 | 33% | 0.331 | S | S | . | . | H | α-helix | trans | -61 | -47.9 | 176.3 | -179.4 | 67.6 | 0 | 0 | 0 | 111.7 | T270 A271 R272 L276 C277 S278 A308 V309 L312 | T270-L274 WeakPolarHBondContact O-CB 3.5Å; T270-L274 PolarHBondContact O-N 3.05Å; A271-L274 PolarHBondContact O-N 3.3Å; R272-L274 VanDerWaalsContact C-N 3.34Å; L274-L276 VanDerWaalsContact C-N 3.34Å; L274-L276 PolarHBondContact O-N 3.34Å; L274-C277 PolarHBondContact O-N 3.41Å; L274-S278 VanDerWaalsContact O-CB 3.3Å; L274-S278 WeakPolarHBondContact O-CB 3.4Å; L274-S278 PolarHBondContact O-N 3.39Å; L274-A308 HydrophobicContact CD1-CB 3.86Å; L274-A308 HydrophobicContact CD2-CB 3.84Å; L274-A308 HydrophobicContact CG-CB 4.35Å; L274-V309 HydrophobicContact CB-CG2 4.31Å; L274-V309 HydrophobicContact CD1-CG2 4.28Å; L274-L312 HydrophobicContact CD1-CB 4.34Å; L274-L312 HydrophobicContact CD1-CD1 3.71Å |
| 275 | Q | 93.2 | Very high | 88.1 | Confident | 119 Ų | 119 | 49.3 Ų | 49.3 | 56% | 0.556 | 30% | 0.301 | S | S | * | . | H | α-helix | trans | -62.2 | -43.4 | 179.5 | -167.7 | 178.6 | -5.8 | 0 | 0 | 111.3 | V228 A271 R272 L279 | V228-Q275 HydrophobicContact CG1-CB 4.48Å; V228-Q275 HydrophobicContact CG1-CG 3.84Å; V228-Q275 HydrophobicContact CG2-CB 4.35Å; V228-Q275 HydrophobicContact CG2-CG 4.49Å; A271-Q275 WeakPolarHBondContact O-CB 3.2Å; A271-Q275 PolarHBondContact O-N 2.92Å; R272-Q275 PolarHBondContact O-N 3.36Å; Q275-L279 VanDerWaalsContact O-CB 3.26Å; Q275-L279 WeakPolarHBondContact O-CB 3.37Å; Q275-L279 PolarHBondContact O-N 3.01Å |
| 276 | L | 93.3 | Very high | 89.1 | Confident | 0 Ų | 0 | 48.5 Ų | 48.5 | 0% | 0 | 30% | 0.297 | C | S | . | . | H | α-helix | trans | -64.5 | -45.3 | 176.8 | -177.7 | 64.9 | 0 | 0 | 0 | 112.3 | A223 V228 A231 A255 R272 C273 L274 L279 L280 | A223-L276 HydrophobicContact CB-CD2 4Å; A223-L276 WeakPolarHBondContact O-CD2 3.45Å; V228-L276 HydrophobicContact CG2-CB 4.23Å; A231-L276 HydrophobicContact CB-CD1 3.48Å; A231-L276 VanDerWaalsContact CB-CD1 3.48Å; A255-L276 HydrophobicContact CB-CD2 3.47Å; A255-L276 VanDerWaalsContact CB-CD2 3.47Å; A255-L276 HydrophobicContact CB-CG 3.96Å; R272-L276 VanDerWaalsContact O-CB 3.28Å; R272-L276 WeakPolarHBondContact O-CB 3.35Å; R272-L276 PolarHBondContact O-N 2.92Å; C273-L276 PolarHBondContact O-N 3.39Å; L274-L276 VanDerWaalsContact C-N 3.34Å; L274-L276 PolarHBondContact O-N 3.34Å; L276-L279 WeakPolarHBondContact O-CB 2.97Å; L276-L279 PolarHBondContact O-N 3Å; L276-L280 HydrophobicContact CD1-CD1 4.46Å; L276-L280 HydrophobicContact CG-CD1 4.19Å; L276-L280 WeakPolarHBondContact O-CG 3.44Å; L276-L280 PolarHBondContact O-N 3.18Å |
| 277 | C | 93.8 | Very high | 89.9 | Confident | 0 Ų | 0 | 47.8 Ų | 47.8 | 0% | 0 | 29% | 0.291 | C | S | . | . | H | α-helix | trans | -64.1 | -43.7 | 177.7 | -68.1 | 0 | 0 | 0 | 0 | 111.2 | L252 C273 L274 L279 L280 L281 V309 | L252-C277 HydrophobicContact CD1-CB 4.05Å; C273-C277 WeakPolarHBondContact O-CB 3.39Å; C273-C277 PolarHBondContact O-N 2.9Å; C273-C277 PolarHBondContact O-SG 2.86Å; L274-C277 PolarHBondContact O-N 3.41Å; C277-L279 VanDerWaalsContact C-N 3.28Å; C277-L279 PolarHBondContact O-N 3.36Å; C277-L280 PolarHBondContact O-N 3.1Å; C277-L281 WeakPolarHBondContact O-CB 3.42Å; C277-L281 WeakPolarHBondContact O-CD1 3.38Å; C277-L281 VanDerWaalsContact O-CG 3.22Å; C277-L281 WeakPolarHBondContact O-CG 3.42Å; C277-L281 PolarHBondContact O-N 3.36Å; C277-V309 HydrophobicContact CB-CG1 4.31Å |
| 278 | S | 94.7 | Very high | 90.5 | Very high | 61 Ų | 61 | 43.2 Ų | 43.2 | 43% | 0.427 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -57.2 | -44.3 | 173.8 | -176.4 | 0 | 0 | 0 | 0 | 111.4 | L274 L281 S282 | L274-S278 VanDerWaalsContact O-CB 3.3Å; L274-S278 WeakPolarHBondContact O-CB 3.4Å; L274-S278 PolarHBondContact O-N 3.39Å; S278-L281 PolarHBondContact O-N 3.26Å; S278-S282 VanDerWaalsContact O-CB 3.28Å; S278-S282 WeakPolarHBondContact O-CB 3.28Å; S278-S282 PolarHBondContact O-N 2.94Å; S278-S282 PolarHBondContact O-OG 3.12Å |
| 279 | L | 95.6 | Very high | 91 | Very high | 26 Ų | 26 | 40.9 Ų | 40.9 | 14% | 0.136 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -63.6 | -49.2 | 178.9 | -171.2 | 149.1 | 0 | 0 | 0 | 111.7 | V228 D232 L235 Q275 L276 C277 L281 S282 A283 | V228-L279 HydrophobicContact CG1-CD1 4.16Å; D232-L279 HydrophobicContact CB-CD1 3.6Å; L235-L279 HydrophobicContact CD1-CD2 3.13Å; L235-L279 HydrophobicContact CD1-CG 4.47Å; L235-L279 HydrophobicContact CG-CD2 4.42Å; Q275-L279 VanDerWaalsContact O-CB 3.26Å; Q275-L279 WeakPolarHBondContact O-CB 3.37Å; Q275-L279 PolarHBondContact O-N 3.01Å; L276-L279 WeakPolarHBondContact O-CB 2.97Å; L276-L279 PolarHBondContact O-N 3Å; C277-L279 VanDerWaalsContact C-N 3.28Å; C277-L279 PolarHBondContact O-N 3.36Å; L279-L281 PolarHBondContact O-N 3.22Å; L279-S282 PolarHBondContact O-N 3.34Å; L279-S282 PolarHBondContact O-OG 2.75Å; L279-A283 WeakPolarHBondContact O-CB 3.37Å; L279-A283 PolarHBondContact O-N 3.36Å |
| 280 | L | 94.4 | Very high | 91.4 | Very high | 0 Ų | 0 | 41.2 Ų | 41.2 | 0% | 0 | 26% | 0.256 | C | S | . | . | H | α-helix | trans | -60.4 | -44.4 | 177.7 | -71.5 | 168.9 | 0 | 0 | 0 | 111.9 | L219 L235 P251 L252 A255 L276 C277 A283 G284 A285 | L219-L280 HydrophobicContact CD1-CD2 4.25Å; L219-L280 HydrophobicContact CD2-CD2 4.09Å; L219-L280 HydrophobicContact CG-CD2 4.34Å; L235-L280 HydrophobicContact CD1-CD2 3.97Å; P251-L280 HydrophobicContact CB-CD1 4.27Å; P251-L280 HydrophobicContact CB-CD2 4.04Å; L252-L280 HydrophobicContact CB-CD1 4.31Å; L252-L280 HydrophobicContact CD1-CB 4.22Å; L252-L280 HydrophobicContact CD1-CD1 4.2Å; A255-L280 HydrophobicContact CB-CD1 4.06Å; L276-L280 HydrophobicContact CD1-CD1 4.46Å; L276-L280 HydrophobicContact CG-CD1 4.19Å; L276-L280 WeakPolarHBondContact O-CG 3.44Å; L276-L280 PolarHBondContact O-N 3.18Å; C277-L280 PolarHBondContact O-N 3.1Å; L280-A283 CarbonylContact O-C 3.5Å; L280-A283 WeakPolarHBondContact O-CB 3.34Å; L280-A283 PolarHBondContact O-N 3.06Å; L280-G284 PolarHBondContact O-N 3.4Å; L280-A285 HydrophobicContact CB-CB 4.11Å; L280-A285 WeakPolarHBondContact O-CB 3.28Å; L280-A285 PolarHBondContact O-N 3.09Å |
| 281 | L | 94.1 | Very high | 91.8 | Very high | 28 Ų | 28 | 39.2 Ų | 39.2 | 15% | 0.147 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -67.3 | -37.8 | 178.2 | -69.5 | 166.8 | 0 | 0 | 0 | 111.9 | L252 C277 S278 L279 A283 G284 A285 A287 L312 L313 | L252-L281 HydrophobicContact CD1-CG 4.23Å; L252-L281 HydrophobicContact CD2-CD2 3.78Å; L252-L281 HydrophobicContact CD2-CG 4.34Å; C277-L281 WeakPolarHBondContact O-CB 3.42Å; C277-L281 WeakPolarHBondContact O-CD1 3.38Å; C277-L281 VanDerWaalsContact O-CG 3.22Å; C277-L281 WeakPolarHBondContact O-CG 3.42Å; C277-L281 PolarHBondContact O-N 3.36Å; S278-L281 PolarHBondContact O-N 3.26Å; L279-L281 PolarHBondContact O-N 3.22Å; L281-A283 PolarHBondContact O-N 2.87Å; L281-G284 PolarHBondContact O-N 3.29Å; L281-A285 HydrophobicContact CD2-CB 4.49Å; L281-A285 WeakPolarHBondContact CD2-O 3.47Å; L281-A287 HydrophobicContact CD2-CB 3.64Å; L281-L312 HydrophobicContact CD1-CD2 3.12Å; L281-L312 HydrophobicContact CD1-CG 4.49Å; L281-L313 HydrophobicContact CD1-CD2 4.11Å |
| 282 | S | 94.1 | Very high | 91.9 | Very high | 100 Ų | 100 | 43 Ų | 43 | 70% | 0.699 | 25% | 0.251 | S | S | * | . | H | α-helix | trans | -65.8 | -28.1 | 173.5 | 76.4 | 0 | 0 | 0 | 0 | 112.9 | S278 L279 G284 | S278-S282 VanDerWaalsContact O-CB 3.28Å; S278-S282 WeakPolarHBondContact O-CB 3.28Å; S278-S282 PolarHBondContact O-N 2.94Å; S278-S282 PolarHBondContact O-OG 3.12Å; L279-S282 PolarHBondContact O-N 3.34Å; L279-S282 PolarHBondContact O-OG 2.75Å; S282-G284 PolarHBondContact O-N 2.88Å |
| 283 | A | 92.4 | Very high | 91.8 | Very high | 48 Ų | 48 | 42.8 Ų | 42.8 | 40% | 0.397 | 26% | 0.258 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -80.1 | -1.3 | 173.6 | 0 | 0 | 0 | 0 | 0 | 113.2 | L235 L279 L280 L281 | L235-A283 HydrophobicContact CB-CB 4.47Å; L235-A283 HydrophobicContact CD1-CB 3.62Å; L235-A283 HydrophobicContact CD2-CB 3.93Å; L235-A283 HydrophobicContact CG-CB 4.22Å; L279-A283 WeakPolarHBondContact O-CB 3.37Å; L279-A283 PolarHBondContact O-N 3.36Å; L280-A283 CarbonylContact O-C 3.5Å; L280-A283 WeakPolarHBondContact O-CB 3.34Å; L280-A283 PolarHBondContact O-N 3.06Å; L281-A283 PolarHBondContact O-N 2.87Å |
| 284 | G | 91.1 | Very high | 91.7 | Very high | 50 Ų | 50 | 48.5 Ų | 48.5 | 52% | 0.515 | 28% | 0.282 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 95.8 | 17.4 | 176.4 | 0 | 0 | 0 | 0 | 0 | 115.2 | L280 L281 S282 | L280-G284 PolarHBondContact O-N 3.4Å; L281-G284 PolarHBondContact O-N 3.29Å; S282-G284 PolarHBondContact O-N 2.88Å |
| 285 | A | 93.6 | Very high | 91.5 | Very high | 9 Ų | 9 | 46.9 Ų | 46.9 | 7% | 0.074 | 27% | 0.273 | C | S | . | . | trans | -59.3 | 140.6 | 172.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | P241 D242 L252 L280 L281 A287 | P241-A285 HydrophobicContact CB-CB 3.99Å; D242-A285 WeakPolarHBondContact OD1-CA 3.3Å; L252-A285 HydrophobicContact CD2-CB 4.44Å; L280-A285 HydrophobicContact CB-CB 4.11Å; L280-A285 WeakPolarHBondContact O-CB 3.28Å; L280-A285 PolarHBondContact O-N 3.09Å; L281-A285 HydrophobicContact CD2-CB 4.49Å; L281-A285 WeakPolarHBondContact CD2-O 3.47Å; A285-A287 PolarHBondContact O-N 3.4Å | ||
| 286 | D | 92.5 | Very high | 91.5 | Very high | 75 Ų | 75 | 44 Ų | 44 | 40% | 0.401 | 26% | 0.257 | S | S | . | . | trans | -73.3 | 110.3 | 173.6 | 178.5 | 12.3 | 0 | 0 | 0 | 110.7 | D242 D288 A289 | D242-D286 PolarHBondContact OD1-N 3.16Å; D286-D288 PolarHBondContact O-N 3.13Å; D286-D288 PolarHBondContact OD1-N 2.95Å; D286-A289 HydrophobicContact CB-CB 4.12Å; D286-A289 WeakPolarHBondContact O-CB 3.48Å; D286-A289 PolarHBondContact O-N 2.98Å; D286-A289 PolarHBondContact OD2-N 3.32Å | ||
| 287 | A | 91.3 | Very high | 91.4 | Very high | 11 Ų | 11 | 44 Ų | 44 | 9% | 0.091 | 26% | 0.257 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -62.4 | -21.6 | 178.1 | 0 | 0 | 0 | 0 | 0 | 113.5 | L281 A285 P297 L313 C316 V318 | L281-A287 HydrophobicContact CD2-CB 3.64Å; A285-A287 PolarHBondContact O-N 3.4Å; A287-P297 WeakPolarHBondContact O-CG 3.35Å; A287-L313 HydrophobicContact CB-CD2 4.15Å; A287-C316 HydrophobicContact CB-CB 3.99Å; A287-V318 HydrophobicContact CB-CG2 3.56Å |
| 288 | D | 88.9 | Confident | 91.3 | Very high | 50 Ų | 50 | 44 Ų | 44 | 27% | 0.267 | 26% | 0.257 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -104.3 | 6.7 | -177.1 | -154.8 | 31.6 | 0 | 0 | 0 | 112.3 | D286 A290 R296 | D286-D288 PolarHBondContact O-N 3.13Å; D286-D288 PolarHBondContact OD1-N 2.95Å; D288-A290 PolarHBondContact O-N 3.17Å; D288-R296 PolarHBondContact O-NH1 3.32Å; D288-R296 VanDerWaalsContact OD1-CD 3.27Å; D288-R296 WeakPolarHBondContact OD1-CD 3.38Å; D288-R296 IonicContact OD1-CZ 2.74Å; D288-R296 IonicContact OD1-NE 3.79Å; D288-R296 IonicContact OD1-NH1 2.97Å; D288-R296 PolarHBondContact OD1-NH1 3.35Å; D288-R296 IonicContact OD2-CZ 3.08Å; D288-R296 IonicContact OD2-NH1 3.31Å; D288-R296 PolarHBondContact OD2-NH1 3.32Å; D288-R296 IonicContact OD2-NH2 2.65Å |
| 289 | A | 91.1 | Very high | 91 | Very high | 3 Ų | 3 | 41.1 Ų | 41.1 | 3% | 0.025 | 24% | 0.237 | C | C | . | . | trans | -56.5 | 123 | -177.9 | 0 | 0 | 0 | 0 | 0 | 112.2 | T250 D286 P297 | T250-A289 HydrophobicContact CG2-CB 3.75Å; D286-A289 HydrophobicContact CB-CB 4.12Å; D286-A289 WeakPolarHBondContact O-CB 3.48Å; D286-A289 PolarHBondContact O-N 2.98Å; D286-A289 PolarHBondContact OD2-N 3.32Å; A289-P297 WeakPolarHBondContact O-CD 3.38Å | ||
| 290 | A | 90.1 | Very high | 90.7 | Very high | 21 Ų | 21 | 39.9 Ų | 39.9 | 17% | 0.174 | 23% | 0.23 | C | C | . | . | trans | -101.4 | 138.6 | -179.2 | 0 | 0 | 0 | 0 | 0 | 111.8 | D288 Q295 R296 | D288-A290 PolarHBondContact O-N 3.17Å; A290-Q295 VanDerWaalsContact CA-O 3.29Å; A290-Q295 WeakPolarHBondContact CA-O 3.19Å; A290-R296 HydrophobicContact CB-CG 3.96Å | ||
| 291 | D | 89.6 | Confident | 90.4 | Very high | 11 Ų | 11 | 39.9 Ų | 39.9 | 6% | 0.059 | 23% | 0.23 | C | C | . | . | trans | -75.8 | -173.8 | 170.2 | 71.8 | 2.6 | 0 | 0 | 0 | 112.1 | L253 D293 K294 Q295 | L253-D291 HydrophobicContact CD1-CB 3.99Å; D291-D293 VanDerWaalsContact C-N 3.26Å; D291-D293 PolarHBondContact O-N 3.12Å; D291-D293 VanDerWaalsContact OD1-C 3.31Å; D291-D293 WeakPolarHBondContact OD1-CA 3.33Å; D291-D293 PolarHBondContact OD1-N 3.36Å; D291-K294 PolarHBondContact O-N 2.72Å; D291-K294 PolarHBondContact OD1-N 2.95Å; D291-Q295 PolarHBondContact N-O 2.65Å; D291-Q295 WeakPolarHBondContact OD1-CA 3.46Å; D291-Q295 WeakPolarHBondContact OD1-CB 3.38Å; D291-Q295 PolarHBondContact OD1-N 2.97Å; D291-Q295 WeakPolarHBondContact OD2-CB 3.49Å | ||
| 292 | Q | 88.2 | Confident | 89.9 | Confident | 135 Ų | 135 | 38.5 Ų | 38.5 | 63% | 0.631 | 22% | 0.223 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -60.7 | -32.3 | 177.2 | -76.1 | 175 | 9.7 | 0 | 0 | 113.8 | A246 E247 K294 | A246-Q292 PolarHBondContact O-NE2 2.92Å; E247-Q292 WeakPolarHBondContact O-CB 3.16Å; E247-Q292 WeakPolarHBondContact O-CG 3.3Å; E247-Q292 PolarHBondContact O-N 3Å; Q292-K294 PolarHBondContact O-N 2.92Å |
| 293 | D | 85.8 | Confident | 89.4 | Confident | 92 Ų | 92 | 36.2 Ų | 36.2 | 49% | 0.492 | 20% | 0.199 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -83.9 | 7.4 | 176.8 | -73.9 | -29.5 | 0 | 0 | 0 | 112.9 | D291 Q295 Y325 | D291-D293 VanDerWaalsContact C-N 3.26Å; D291-D293 PolarHBondContact O-N 3.12Å; D291-D293 VanDerWaalsContact OD1-C 3.31Å; D291-D293 WeakPolarHBondContact OD1-CA 3.33Å; D291-D293 PolarHBondContact OD1-N 3.36Å; D293-Q295 HydrophobicContact CB-CG 3.99Å; D293-Q295 PolarHBondContact O-N 3.16Å; D293-Q295 VanDerWaalsContact O-N 3.12Å; D293-Y325 VanDerWaalsContact O-CB 3.24Å; D293-Y325 WeakPolarHBondContact O-CB 3.27Å; D293-Y325 PolarHBondContact O-N 2.9Å |
| 294 | K | 86.6 | Confident | 88.9 | Confident | 122 Ų | 122 | 36.1 Ų | 36.1 | 53% | 0.53 | 19% | 0.188 | S | C | . | . | trans | 56.5 | 19 | -171.2 | -56.9 | -176.7 | 176.9 | 179.7 | 0 | 113.5 | D291 Q292 | D291-K294 PolarHBondContact O-N 2.72Å; D291-K294 PolarHBondContact OD1-N 2.95Å; Q292-K294 PolarHBondContact O-N 2.92Å | ||
| 295 | Q | 87.3 | Confident | 88.3 | Confident | 24 Ų | 24 | 34 Ų | 34 | 11% | 0.112 | 17% | 0.166 | C | C | . | . | trans | -70.3 | 140.9 | 167 | -56.9 | -173.1 | 12.3 | 0 | 0 | 108.1 | A290 D291 D293 D324 | A290-Q295 VanDerWaalsContact CA-O 3.29Å; A290-Q295 WeakPolarHBondContact CA-O 3.19Å; D291-Q295 PolarHBondContact N-O 2.65Å; D291-Q295 WeakPolarHBondContact OD1-CA 3.46Å; D291-Q295 WeakPolarHBondContact OD1-CB 3.38Å; D291-Q295 PolarHBondContact OD1-N 2.97Å; D291-Q295 WeakPolarHBondContact OD2-CB 3.49Å; D293-Q295 HydrophobicContact CB-CG 3.99Å; D293-Q295 PolarHBondContact O-N 3.16Å; D293-Q295 VanDerWaalsContact O-N 3.12Å; Q295-D324 HydrophobicContact CG-CB 4.09Å | ||
| 296 | R | 92.4 | Very high | 87.9 | Confident | 58 Ų | 58 | 33.8 Ų | 33.8 | 22% | 0.219 | 16% | 0.164 | C | C | . | . | trans | -121.7 | 161.9 | -175.4 | -58.9 | 175.7 | -178.5 | -106.7 | 21.9 | 108.1 | L253 D288 A290 L298 H299 L300 | L253-R296 VanDerWaalsContact CD2-C 3.48Å; D288-R296 PolarHBondContact O-NH1 3.32Å; D288-R296 VanDerWaalsContact OD1-CD 3.27Å; D288-R296 WeakPolarHBondContact OD1-CD 3.38Å; D288-R296 IonicContact OD1-CZ 2.74Å; D288-R296 IonicContact OD1-NE 3.79Å; D288-R296 IonicContact OD1-NH1 2.97Å; D288-R296 PolarHBondContact OD1-NH1 3.35Å; D288-R296 IonicContact OD2-CZ 3.08Å; D288-R296 IonicContact OD2-NH1 3.31Å; D288-R296 PolarHBondContact OD2-NH1 3.32Å; D288-R296 IonicContact OD2-NH2 2.65Å; A290-R296 HydrophobicContact CB-CG 3.96Å; R296-L298 PolarHBondContact O-N 3.25Å; R296-H299 WeakPolarHBondContact CB-ND1 3.48Å; R296-H299 PolarHBondContact N-ND1 2.85Å; R296-H299 VanDerWaalsContact N-ND1 3.13Å; R296-H299 WeakPolarHBondContact O-CB 3.43Å; R296-H299 PolarHBondContact O-N 3Å; R296-L300 PolarHBondContact O-N 3.46Å | ||
| 297 | P | 91.9 | Very high | 87.4 | Confident | 0 Ų | 0 | 31.3 Ų | 31.3 | 0% | 0 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -49.4 | -39.8 | 178.8 | -31.4 | 36.2 | 0 | 0 | 0 | 112.7 | L252 L253 A287 A289 H299 L300 A301 L313 | L252-P297 HydrophobicContact CD2-CB 4.17Å; L252-P297 HydrophobicContact CD2-CG 3.74Å; L252-P297 HydrophobicContact CG-CB 4.2Å; L252-P297 HydrophobicContact CG-CG 3.97Å; L253-P297 HydrophobicContact CD2-CG 4.02Å; L253-P297 HydrophobicContact CG-CG 4.19Å; A287-P297 WeakPolarHBondContact O-CG 3.35Å; A289-P297 WeakPolarHBondContact O-CD 3.38Å; P297-H299 PolarHBondContact O-N 3.46Å; P297-L300 PolarHBondContact O-N 3Å; P297-A301 WeakPolarHBondContact O-CB 3.24Å; P297-A301 PolarHBondContact O-N 3.21Å; P297-L313 HydrophobicContact CB-CD1 3.78Å; P297-L313 HydrophobicContact CB-CD2 4.02Å |
| 298 | L | 90.9 | Very high | 87.2 | Confident | 0 Ų | 0 | 33.3 Ų | 33.3 | 0% | 0 | 17% | 0.17 | C | C | . | . | H | α-helix | trans | -61.8 | -39 | 178.5 | -171.5 | 62.9 | 0 | 0 | 0 | 112.9 | R296 C302 V310 L313 L314 V318 P330 L353 | R296-L298 PolarHBondContact O-N 3.25Å; L298-C302 VanDerWaalsContact O-CB 3.29Å; L298-C302 WeakPolarHBondContact O-CB 3.44Å; L298-C302 PolarHBondContact O-N 3.18Å; L298-C302 PolarHBondContact O-SG 2.89Å; L298-V310 HydrophobicContact CD1-CB 4.44Å; L298-V310 HydrophobicContact CD1-CG1 3.93Å; L298-V310 HydrophobicContact CD1-CG2 4.42Å; L298-L313 HydrophobicContact CB-CD1 4.4Å; L298-L313 HydrophobicContact CD1-CB 4.29Å; L298-L313 HydrophobicContact CD1-CD1 4.47Å; L298-L314 HydrophobicContact CD1-CD2 4.3Å; L298-L314 HydrophobicContact CD1-CG 4.22Å; L298-L314 HydrophobicContact CD2-CD2 3.98Å; L298-V318 HydrophobicContact CB-CG1 4.23Å; L298-V318 HydrophobicContact CD2-CG1 3.99Å; L298-P330 HydrophobicContact CB-CG 4.48Å; L298-P330 HydrophobicContact CD2-CB 4.12Å; L298-P330 HydrophobicContact CD2-CG 3.71Å; L298-P330 HydrophobicContact CG-CB 3.92Å; L298-P330 HydrophobicContact CG-CG 3.88Å; L298-L353 HydrophobicContact CD1-CD2 4.39Å; L298-L353 HydrophobicContact CD2-CD2 4.36Å |
| 299 | H | 88.8 | Confident | 87.2 | Confident | 0 Ų | 0 | 31 Ų | 31 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -64.1 | -45.7 | 177.1 | -63.2 | 101.8 | 0 | 0 | 0 | 111.4 | R296 P297 C302 R303 T322 H328 P330 C333 | R296-H299 WeakPolarHBondContact CB-ND1 3.48Å; R296-H299 PolarHBondContact N-ND1 2.85Å; R296-H299 VanDerWaalsContact N-ND1 3.13Å; R296-H299 WeakPolarHBondContact O-CB 3.43Å; R296-H299 PolarHBondContact O-N 3Å; P297-H299 PolarHBondContact O-N 3.46Å; H299-C302 PolarHBondContact O-N 2.84Å; H299-R303 WeakPolarHBondContact O-CB 3.5Å; H299-R303 PolarHBondContact O-N 3.48Å; H299-T322 PolarHBondContact CE1-OG1 3.34Å; H299-T322 VanDerWaalsContact CE1-OG1 3.27Å; H299-T322 PolarHBondContact NE2-O 3.4Å; H299-T322 VanDerWaalsContact NE2-O 3.13Å; H299-H328 PolarHBondContact NE2-O 3.46Å; H299-P330 WeakPolarHBondContact NE2-CD 3.44Å; H299-C333 WeakPolarHBondContact O-CB 3.48Å |
| 300 | L | 88.4 | Confident | 87.1 | Confident | 0 Ų | 0 | 30.8 Ų | 30.8 | 0% | 0 | 16% | 0.157 | C | C | . | . | H | α-helix | trans | -68.1 | -46.8 | 179.8 | -63.6 | -180 | 0 | 0 | 0 | 111.5 | W249 L253 C256 D257 R296 P297 C302 R303 R304 | W249-L300 HydrophobicContact CH2-CD1 4.39Å; W249-L300 HydrophobicContact CZ3-CD1 4.33Å; L253-L300 HydrophobicContact CB-CD1 4.15Å; L253-L300 HydrophobicContact CD2-CD1 3.53Å; L253-L300 HydrophobicContact CD2-CG 4.34Å; L253-L300 HydrophobicContact CG-CD1 4.48Å; C256-L300 HydrophobicContact CB-CB 3.94Å; D257-L300 HydrophobicContact CB-CD1 4.29Å; R296-L300 PolarHBondContact O-N 3.46Å; P297-L300 PolarHBondContact O-N 3Å; L300-C302 VanDerWaalsContact C-N 3.26Å; L300-C302 PolarHBondContact O-N 3.06Å; L300-R303 WeakPolarHBondContact O-CB 3.47Å; L300-R303 PolarHBondContact O-N 2.91Å; L300-R303 VanDerWaalsContact O-N 3.08Å; L300-R304 WeakPolarHBondContact O-CG 3.27Å; L300-R304 PolarHBondContact O-N 2.73Å |
| 301 | A | 88.4 | Confident | 86.9 | Confident | 0 Ų | 0 | 33.5 Ų | 33.5 | 0% | 0 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -58.1 | -39.5 | 176.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | P297 G305 H306 V309 V310 L313 | P297-A301 WeakPolarHBondContact O-CB 3.24Å; P297-A301 PolarHBondContact O-N 3.21Å; A301-G305 PolarHBondContact O-N 3.33Å; A301-H306 PolarHBondContact O-N 3.29Å; A301-V309 HydrophobicContact CB-CB 4.33Å; A301-V309 HydrophobicContact CB-CG1 3.92Å; A301-V310 HydrophobicContact CB-CG2 3.83Å; A301-L313 HydrophobicContact CB-CD1 4.14Å |
| 302 | C | 84.9 | Confident | 86.9 | Confident | 0 Ų | 0 | 34.6 Ų | 34.6 | 0% | 0 | 17% | 0.171 | C | C | . | . | H | α-helix | trans | -65.4 | -47.8 | 173.1 | -70.9 | 0 | 0 | 0 | 0 | 111.8 | L298 H299 L300 R304 G305 P330 C333 A334 V349 | L298-C302 VanDerWaalsContact O-CB 3.29Å; L298-C302 WeakPolarHBondContact O-CB 3.44Å; L298-C302 PolarHBondContact O-N 3.18Å; L298-C302 PolarHBondContact O-SG 2.89Å; H299-C302 PolarHBondContact O-N 2.84Å; L300-C302 VanDerWaalsContact C-N 3.26Å; L300-C302 PolarHBondContact O-N 3.06Å; C302-R304 PolarHBondContact O-N 3.3Å; C302-G305 PolarHBondContact O-N 3.32Å; C302-G305 VanDerWaalsContact O-N 3.08Å; C302-P330 HydrophobicContact CB-CB 4.44Å; C302-P330 VanDerWaalsContact CB-O 3.28Å; C302-P330 WeakPolarHBondContact CB-O 3.14Å; C302-C333 HydrophobicContact CB-CB 4.32Å; C302-A334 HydrophobicContact CB-CB 4.04Å; C302-A334 WeakPolarHBondContact O-CA 3.28Å; C302-V349 HydrophobicContact CB-CG1 4.22Å |
| 303 | R | 83.4 | Confident | 87 | Confident | 52 Ų | 52 | 28.1 Ų | 28.1 | 20% | 0.196 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -57.9 | -35.3 | 178.5 | -171.2 | -175.3 | -72.7 | 156.5 | -0.5 | 112.7 | H299 L300 C333 G337 | H299-R303 WeakPolarHBondContact O-CB 3.5Å; H299-R303 PolarHBondContact O-N 3.48Å; L300-R303 WeakPolarHBondContact O-CB 3.47Å; L300-R303 PolarHBondContact O-N 2.91Å; L300-R303 VanDerWaalsContact O-N 3.08Å; R303-C333 WeakPolarHBondContact CA-O 3.44Å; R303-C333 HydrophobicContact CB-CB 4.22Å; R303-G337 WeakPolarHBondContact O-CA 3.1Å |
| 304 | R | 81.8 | Confident | 87 | Confident | 45 Ų | 45 | 24.1 Ų | 24.1 | 17% | 0.17 | 12% | 0.119 | C | C | . | . | H | α-helix | trans | -86.2 | -16.4 | 178.3 | -59.3 | -56.4 | 178.5 | -164.9 | 2.4 | 113.7 | C256 D257 L300 C302 | C256-R304 WeakPolarHBondContact O-CG 3.47Å; D257-R304 VanDerWaalsContact CG-NH2 3.28Å; D257-R304 PolarHBondContact O-NE 2.72Å; D257-R304 VanDerWaalsContact O-NE 3.1Å; D257-R304 IonicContact OD1-CZ 3.19Å; D257-R304 IonicContact OD1-NE 2.99Å; D257-R304 PolarHBondContact OD1-NE 3.49Å; D257-R304 IonicContact OD1-NH2 2.67Å; D257-R304 PolarHBondContact OD1-NH2 3.26Å; D257-R304 IonicContact OD2-NH2 2.94Å; D257-R304 PolarHBondContact OD2-NH2 3.38Å; L300-R304 WeakPolarHBondContact O-CG 3.27Å; L300-R304 PolarHBondContact O-N 2.73Å; C302-R304 PolarHBondContact O-N 3.3Å |
| 305 | G | 78.9 | Confident | 87.1 | Confident | 5 Ų | 5 | 22.6 Ų | 22.6 | 5% | 0.052 | 12% | 0.124 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 80.8 | 24.2 | 179.5 | 0 | 0 | 0 | 0 | 0 | 113.9 | A301 C302 A307 S345 | A301-G305 PolarHBondContact O-N 3.33Å; C302-G305 PolarHBondContact O-N 3.32Å; C302-G305 VanDerWaalsContact O-N 3.08Å; G305-A307 VanDerWaalsContact C-N 3.34Å; G305-A307 PolarHBondContact O-N 3.21Å; G305-S345 WeakPolarHBondContact O-CB 3.39Å; G305-S345 PolarHBondContact O-OG 2.95Å |
| 306 | H | 83.9 | Confident | 87 | Confident | 6 Ų | 6 | 24.5 Ų | 24.5 | 3% | 0.028 | 14% | 0.14 | C | C | . | . | trans | -81.7 | 74.8 | -177.7 | -65.2 | -36.6 | 0 | 0 | 0 | 111 | V258 T270 A301 A308 V309 V310 | V258-H306 PolarHBondContact O-NE2 3Å; T270-H306 WeakPolarHBondContact CG2-ND1 3.39Å; A301-H306 PolarHBondContact O-N 3.29Å; H306-A308 VanDerWaalsContact C-N 3.31Å; H306-A308 PolarHBondContact O-N 3.09Å; H306-V309 HydrophobicContact CB-CB 3.95Å; H306-V309 HydrophobicContact CB-CG2 3.94Å; H306-V309 WeakPolarHBondContact O-CB 3.44Å; H306-V309 PolarHBondContact O-N 3.06Å; H306-V310 PolarHBondContact O-N 3.46Å | ||
| 307 | A | 82.9 | Confident | 86.5 | Confident | 23 Ų | 23 | 24.9 Ų | 24.9 | 19% | 0.19 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -53.4 | -42 | -172.4 | 0 | 0 | 0 | 0 | 0 | 114.2 | G305 V309 V310 E311 H348 V349 | G305-A307 VanDerWaalsContact C-N 3.34Å; G305-A307 PolarHBondContact O-N 3.21Å; A307-V309 VanDerWaalsContact C-N 3.34Å; A307-V309 PolarHBondContact O-N 3.01Å; A307-V310 WeakPolarHBondContact O-CB 3.25Å; A307-V310 PolarHBondContact O-N 3.32Å; A307-E311 PolarHBondContact O-N 2.98Å; A307-H348 HydrophobicContact CB-CB 3.71Å; A307-V349 HydrophobicContact CB-CG2 3.87Å |
| 308 | A | 86.4 | Confident | 86.2 | Confident | 52 Ų | 52 | 25.5 Ų | 25.5 | 43% | 0.43 | 17% | 0.165 | S | C | . | . | H | α-helix | trans | -65.4 | -36.6 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.7 | L274 H306 L312 | L274-A308 HydrophobicContact CD1-CB 3.86Å; L274-A308 HydrophobicContact CD2-CB 3.84Å; L274-A308 HydrophobicContact CG-CB 4.35Å; H306-A308 VanDerWaalsContact C-N 3.31Å; H306-A308 PolarHBondContact O-N 3.09Å; A308-L312 WeakPolarHBondContact O-CB 3.39Å; A308-L312 PolarHBondContact O-N 2.88Å |
| 309 | V | 89 | Confident | 85.8 | Confident | 1 Ų | 1 | 28.3 Ų | 28.3 | 1% | 0.006 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -69.3 | -38.2 | 175.4 | 179.2 | 0 | 0 | 0 | 0 | 110.3 | C273 L274 C277 A301 H306 A307 L312 L313 | C273-V309 HydrophobicContact CB-CG2 4.44Å; L274-V309 HydrophobicContact CB-CG2 4.31Å; L274-V309 HydrophobicContact CD1-CG2 4.28Å; C277-V309 HydrophobicContact CB-CG1 4.31Å; A301-V309 HydrophobicContact CB-CB 4.33Å; A301-V309 HydrophobicContact CB-CG1 3.92Å; H306-V309 HydrophobicContact CB-CB 3.95Å; H306-V309 HydrophobicContact CB-CG2 3.94Å; H306-V309 WeakPolarHBondContact O-CB 3.44Å; H306-V309 PolarHBondContact O-N 3.06Å; A307-V309 VanDerWaalsContact C-N 3.34Å; A307-V309 PolarHBondContact O-N 3.01Å; V309-L312 PolarHBondContact O-N 2.94Å; V309-L313 HydrophobicContact CG1-CD1 3.97Å; V309-L313 HydrophobicContact CG1-CG 4.28Å; V309-L313 VanDerWaalsContact O-CG 3.3Å; V309-L313 WeakPolarHBondContact O-CG 3.49Å; V309-L313 PolarHBondContact O-N 2.92Å |
| 310 | V | 88.6 | Confident | 85.3 | Confident | 0 Ų | 0 | 28.5 Ų | 28.5 | 0% | 0 | 19% | 0.187 | C | C | . | . | H | α-helix | trans | -60.6 | -49.1 | 175.3 | 170.9 | 0 | 0 | 0 | 0 | 111.1 | L298 A301 H306 A307 L312 L313 L314 V349 A352 L353 | L298-V310 HydrophobicContact CD1-CB 4.44Å; L298-V310 HydrophobicContact CD1-CG1 3.93Å; L298-V310 HydrophobicContact CD1-CG2 4.42Å; A301-V310 HydrophobicContact CB-CG2 3.83Å; H306-V310 PolarHBondContact O-N 3.46Å; A307-V310 WeakPolarHBondContact O-CB 3.25Å; A307-V310 PolarHBondContact O-N 3.32Å; V310-L312 VanDerWaalsContact C-N 3.31Å; V310-L312 PolarHBondContact O-N 3.1Å; V310-L313 PolarHBondContact O-N 3.08Å; V310-L314 HydrophobicContact CG1-CD1 3.78Å; V310-L314 HydrophobicContact CG1-CG 4.4Å; V310-L314 WeakPolarHBondContact O-CB 3.22Å; V310-L314 VanDerWaalsContact O-CG 3.25Å; V310-L314 WeakPolarHBondContact O-CG 3.44Å; V310-L314 PolarHBondContact O-N 3.15Å; V310-V349 HydrophobicContact CG1-CG1 4.47Å; V310-V349 HydrophobicContact CG2-CG1 4.2Å; V310-V349 HydrophobicContact CG2-CG2 4.3Å; V310-A352 HydrophobicContact CG1-CB 4.04Å; V310-L353 HydrophobicContact CG1-CD2 4.38Å; V310-L353 HydrophobicContact CG1-CG 4.42Å |
| 311 | E | 86.4 | Confident | 84.8 | Confident | 78 Ų | 78 | 31.1 Ų | 31.1 | 36% | 0.364 | 20% | 0.201 | S | C | . | . | H | α-helix | trans | -59.3 | -42.3 | 175.8 | -71.8 | -74.1 | -176.2 | 0 | 0 | 111.6 | A307 L314 S315 A352 H356 | A307-E311 PolarHBondContact O-N 2.98Å; E311-L314 PolarHBondContact O-N 3.29Å; E311-S315 WeakPolarHBondContact O-CB 3.41Å; E311-S315 PolarHBondContact O-N 3Å; E311-A352 VanDerWaalsContact CD-CB 3.45Å; E311-A352 HydrophobicContact CG-CB 3.96Å; E311-A352 WeakPolarHBondContact OE1-CA 3.45Å; E311-A352 WeakPolarHBondContact OE1-CB 3.29Å; E311-H356 IonicContact OE2-NE2 2.8Å |
| 312 | L | 89.8 | Confident | 84.6 | Confident | 33 Ų | 33 | 32 Ų | 32 | 17% | 0.173 | 21% | 0.206 | C | C | . | . | H | α-helix | trans | -60.3 | -52.2 | 176.6 | -163.7 | 171.8 | 0 | 0 | 0 | 110.8 | L274 L281 A308 V309 V310 L314 S315 C316 | L274-L312 HydrophobicContact CD1-CB 4.34Å; L274-L312 HydrophobicContact CD1-CD1 3.71Å; L281-L312 HydrophobicContact CD1-CD2 3.12Å; L281-L312 HydrophobicContact CD1-CG 4.49Å; A308-L312 WeakPolarHBondContact O-CB 3.39Å; A308-L312 PolarHBondContact O-N 2.88Å; V309-L312 PolarHBondContact O-N 2.94Å; V310-L312 VanDerWaalsContact C-N 3.31Å; V310-L312 PolarHBondContact O-N 3.1Å; L312-L314 VanDerWaalsContact C-N 3.33Å; L312-L314 PolarHBondContact O-N 3.41Å; L312-S315 WeakPolarHBondContact O-CB 3.42Å; L312-S315 PolarHBondContact O-N 3.27Å; L312-S315 VanDerWaalsContact O-N 3.1Å; L312-S315 PolarHBondContact O-OG 3.49Å; L312-C316 PolarHBondContact O-N 2.67Å; L312-C316 PolarHBondContact O-SG 3.05Å; L312-C316 VanDerWaalsContact O-SG 3.4Å |
| 313 | L | 90.3 | Very high | 84.3 | Confident | 0 Ų | 0 | 37.6 Ų | 37.6 | 0% | 0 | 23% | 0.233 | C | C | . | . | H | α-helix | trans | -61.4 | -39.2 | 179.5 | -69.2 | 170.8 | 0 | 0 | 0 | 112.5 | L252 L281 A287 P297 L298 A301 V309 V310 S315 C316 V318 | L252-L313 HydrophobicContact CD2-CD2 4.39Å; L281-L313 HydrophobicContact CD1-CD2 4.11Å; A287-L313 HydrophobicContact CB-CD2 4.15Å; P297-L313 HydrophobicContact CB-CD1 3.78Å; P297-L313 HydrophobicContact CB-CD2 4.02Å; L298-L313 HydrophobicContact CB-CD1 4.4Å; L298-L313 HydrophobicContact CD1-CB 4.29Å; L298-L313 HydrophobicContact CD1-CD1 4.47Å; A301-L313 HydrophobicContact CB-CD1 4.14Å; V309-L313 HydrophobicContact CG1-CD1 3.97Å; V309-L313 HydrophobicContact CG1-CG 4.28Å; V309-L313 VanDerWaalsContact O-CG 3.3Å; V309-L313 WeakPolarHBondContact O-CG 3.49Å; V309-L313 PolarHBondContact O-N 2.92Å; V310-L313 PolarHBondContact O-N 3.08Å; L313-S315 VanDerWaalsContact C-N 3.33Å; L313-C316 WeakPolarHBondContact O-CB 3.37Å; L313-C316 PolarHBondContact O-N 3Å; L313-V318 WeakPolarHBondContact O-CB 3.46Å; L313-V318 VanDerWaalsContact O-CG2 3.28Å; L313-V318 WeakPolarHBondContact O-CG2 3.47Å |
| 314 | L | 86.8 | Confident | 84.3 | Confident | 7 Ų | 7 | 35.8 Ų | 35.8 | 4% | 0.037 | 23% | 0.227 | C | C | . | . | H | α-helix | trans | -67 | -34.8 | 175.8 | -69.9 | 170.6 | 0 | 0 | 0 | 112 | L298 V310 E311 L312 C316 G317 A320 A352 L353 H356 | L298-L314 HydrophobicContact CD1-CD2 4.3Å; L298-L314 HydrophobicContact CD1-CG 4.22Å; L298-L314 HydrophobicContact CD2-CD2 3.98Å; V310-L314 HydrophobicContact CG1-CD1 3.78Å; V310-L314 HydrophobicContact CG1-CG 4.4Å; V310-L314 WeakPolarHBondContact O-CB 3.22Å; V310-L314 VanDerWaalsContact O-CG 3.25Å; V310-L314 WeakPolarHBondContact O-CG 3.44Å; V310-L314 PolarHBondContact O-N 3.15Å; E311-L314 PolarHBondContact O-N 3.29Å; L312-L314 VanDerWaalsContact C-N 3.33Å; L312-L314 PolarHBondContact O-N 3.41Å; L314-C316 PolarHBondContact O-N 2.79Å; L314-G317 PolarHBondContact O-N 2.93Å; L314-A320 HydrophobicContact CD2-CB 3.97Å; L314-A352 HydrophobicContact CD1-CB 4.13Å; L314-L353 HydrophobicContact CD1-CD2 4.31Å; L314-H356 HydrophobicContact CB-CB 4.5Å; L314-H356 HydrophobicContact CD1-CB 4.05Å; L314-H356 HydrophobicContact CD2-CB 4.03Å; L314-H356 HydrophobicContact CG-CB 4.43Å |
| 315 | S | 87.9 | Confident | 84.2 | Confident | 90 Ų | 90 | 42.4 Ų | 42.4 | 63% | 0.629 | 25% | 0.254 | S | S | * | . | H | α-helix | trans | -65.4 | -25.9 | 174.2 | 80.4 | 0 | 0 | 0 | 0 | 112.9 | E311 L312 L313 G317 | E311-S315 WeakPolarHBondContact O-CB 3.41Å; E311-S315 PolarHBondContact O-N 3Å; L312-S315 WeakPolarHBondContact O-CB 3.42Å; L312-S315 PolarHBondContact O-N 3.27Å; L312-S315 VanDerWaalsContact O-N 3.1Å; L312-S315 PolarHBondContact O-OG 3.49Å; L313-S315 VanDerWaalsContact C-N 3.33Å; S315-G317 PolarHBondContact O-N 3.13Å |
| 316 | C | 85.8 | Confident | 84 | Confident | 65 Ų | 65 | 44.7 Ų | 44.7 | 44% | 0.439 | 28% | 0.278 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -74.7 | -1.2 | 171.4 | -60.7 | 0 | 0 | 0 | 0 | 113.5 | A287 L312 L313 L314 | A287-C316 HydrophobicContact CB-CB 3.99Å; L312-C316 PolarHBondContact O-N 2.67Å; L312-C316 PolarHBondContact O-SG 3.05Å; L312-C316 VanDerWaalsContact O-SG 3.4Å; L313-C316 WeakPolarHBondContact O-CB 3.37Å; L313-C316 PolarHBondContact O-N 3Å; L314-C316 PolarHBondContact O-N 2.79Å |
| 317 | G | 80.3 | Confident | 83.7 | Confident | 65 Ų | 65 | 46.2 Ų | 46.2 | 67% | 0.67 | 30% | 0.295 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 86 | 14.6 | 177.8 | 0 | 0 | 0 | 0 | 0 | 114.8 | L314 S315 | L314-G317 PolarHBondContact O-N 2.93Å; S315-G317 PolarHBondContact O-N 3.13Å |
| 318 | V | 86.8 | Confident | 83.5 | Confident | 13 Ų | 13 | 48 Ų | 48 | 8% | 0.079 | 30% | 0.299 | C | S | . | . | trans | -64.3 | 136.8 | 175.7 | -179.7 | 0 | 0 | 0 | 0 | 110.2 | A287 L298 L313 A320 | A287-V318 HydrophobicContact CB-CG2 3.56Å; L298-V318 HydrophobicContact CB-CG1 4.23Å; L298-V318 HydrophobicContact CD2-CG1 3.99Å; L313-V318 WeakPolarHBondContact O-CB 3.46Å; L313-V318 VanDerWaalsContact O-CG2 3.28Å; L313-V318 WeakPolarHBondContact O-CG2 3.47Å; V318-A320 PolarHBondContact O-N 3.38Å | ||
| 319 | S | 81.7 | Confident | 83.3 | Confident | 59 Ų | 59 | 46.5 Ų | 46.5 | 41% | 0.413 | 28% | 0.284 | S | S | . | . | trans | -72.1 | 122.5 | -179.9 | 169.4 | 0 | 0 | 0 | 0 | 111.5 | N321 | S319-N321 PolarHBondContact O-N 3.02Å; S319-N321 VanDerWaalsContact O-N 3.09Å; S319-N321 PolarHBondContact OG-N 3.21Å | ||
| 320 | A | 79.1 | Confident | 82.9 | Confident | 5 Ų | 5 | 46.4 Ų | 46.4 | 4% | 0.041 | 28% | 0.284 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -67.8 | -7 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114.4 | L314 V318 P330 L353 A358 | L314-A320 HydrophobicContact CD2-CB 3.97Å; V318-A320 PolarHBondContact O-N 3.38Å; A320-P330 WeakPolarHBondContact O-CD 3.4Å; A320-L353 HydrophobicContact CB-CD2 4.15Å; A320-A358 HydrophobicContact CB-CB 4.11Å |
| 321 | N | 78.2 | Confident | 82.4 | Confident | 55 Ų | 55 | 46.5 Ų | 46.5 | 29% | 0.294 | 29% | 0.285 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -118.1 | 7.6 | -171.1 | -65.7 | -51.2 | 0 | 0 | 0 | 113.8 | S319 G357 A358 V359 | S319-N321 PolarHBondContact O-N 3.02Å; S319-N321 VanDerWaalsContact O-N 3.09Å; S319-N321 PolarHBondContact OG-N 3.21Å; N321-G357 PolarHBondContact ND2-O 3.34Å; N321-A358 VanDerWaalsContact OD1-CA 3.28Å; N321-A358 WeakPolarHBondContact OD1-CA 3.4Å; N321-V359 PolarHBondContact OD1-N 2.89Å |
| 322 | T | 82.8 | Confident | 81.9 | Confident | 19 Ų | 19 | 44.2 Ų | 44.2 | 12% | 0.117 | 27% | 0.274 | C | S | . | . | trans | -59.2 | 145.5 | 173.4 | 55.8 | 0 | 0 | 0 | 0 | 110.1 | H299 T329 P330 | H299-T322 PolarHBondContact CE1-OG1 3.34Å; H299-T322 VanDerWaalsContact CE1-OG1 3.27Å; H299-T322 PolarHBondContact NE2-O 3.4Å; H299-T322 VanDerWaalsContact NE2-O 3.13Å; T322-T329 WeakPolarHBondContact O-CA 3.28Å; T322-P330 VanDerWaalsContact O-CD 3.22Å; T322-P330 WeakPolarHBondContact O-CD 3.45Å | ||
| 323 | M | 80.2 | Confident | 81.4 | Confident | 116 Ų | 116 | 42.7 Ų | 42.7 | 57% | 0.571 | 27% | 0.266 | S | S | * | . | trans | -108.1 | 143.2 | 174.7 | -66.2 | -179 | -64.5 | 0 | 0 | 110.1 | H328 T329 | M323-H328 WeakPolarHBondContact CA-O 3.05Å; M323-T329 HydrophobicContact CG-CG2 3.87Å | ||
| 324 | D | 83.3 | Confident | 80.7 | Confident | 14 Ų | 14 | 42.8 Ų | 42.8 | 8% | 0.075 | 27% | 0.266 | C | S | . | . | trans | -72.8 | 178.4 | 164.1 | 72.3 | 5.4 | 0 | 0 | 0 | 111.2 | Q295 G326 G327 H328 | Q295-D324 HydrophobicContact CG-CB 4.09Å; D324-G326 PolarHBondContact O-N 3.46Å; D324-G326 VanDerWaalsContact OD1-C 3.32Å; D324-G326 VanDerWaalsContact OD1-CA 3.28Å; D324-G326 WeakPolarHBondContact OD1-CA 3.46Å; D324-G326 PolarHBondContact OD1-N 3.39Å; D324-G327 PolarHBondContact O-N 3.43Å; D324-G327 PolarHBondContact OD1-N 3.26Å; D324-H328 PolarHBondContact N-O 3.31Å; D324-H328 WeakPolarHBondContact OD1-CB 3.46Å; D324-H328 IonicContact OD1-CG 3.72Å; D324-H328 PolarHBondContact OD1-N 2.84Å; D324-H328 IonicContact OD1-ND1 3.38Å; D324-H328 PolarHBondContact OD1-ND1 3.46Å; D324-H328 IonicContact OD2-CG 3.86Å; D324-H328 IonicContact OD2-ND1 3.34Å; D324-H328 PolarHBondContact OD2-ND1 3.3Å | ||
| 325 | Y | 78.9 | Confident | 80 | Confident | 185 Ų | 185 | 43.4 Ų | 43.4 | 73% | 0.725 | 27% | 0.27 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -59.6 | -27.8 | 177.3 | -169.5 | -92.6 | 0 | 0 | 0 | 113 | D293 G327 | D293-Y325 VanDerWaalsContact O-CB 3.24Å; D293-Y325 WeakPolarHBondContact O-CB 3.27Å; D293-Y325 PolarHBondContact O-N 2.9Å; Y325-G327 VanDerWaalsContact C-N 3.25Å; Y325-G327 PolarHBondContact O-N 3.32Å |
| 326 | G | 74.6 | Confident | 79.2 | Confident | 53 Ų | 53 | 43.7 Ų | 43.7 | 55% | 0.546 | 26% | 0.261 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.1 | -0.6 | 176.1 | 0 | 0 | 0 | 0 | 0 | 114.6 | D324 H328 | D324-G326 PolarHBondContact O-N 3.46Å; D324-G326 VanDerWaalsContact OD1-C 3.32Å; D324-G326 VanDerWaalsContact OD1-CA 3.28Å; D324-G326 WeakPolarHBondContact OD1-CA 3.46Å; D324-G326 PolarHBondContact OD1-N 3.39Å; G326-H328 PolarHBondContact O-N 3.48Å |
| 327 | G | 77.1 | Confident | 78.2 | Confident | 38 Ų | 38 | 40.8 Ų | 40.8 | 39% | 0.392 | 24% | 0.242 | S | C | . | . | S | Bend | trans | 75.6 | 11.9 | -175.3 | 0 | 0 | 0 | 0 | 0 | 113.5 | D324 Y325 | D324-G327 PolarHBondContact O-N 3.43Å; D324-G327 PolarHBondContact OD1-N 3.26Å; Y325-G327 VanDerWaalsContact C-N 3.25Å; Y325-G327 PolarHBondContact O-N 3.32Å |
| 328 | H | 78.8 | Confident | 77.2 | Confident | 61 Ų | 61 | 40.8 Ų | 40.8 | 28% | 0.282 | 23% | 0.23 | S | C | . | . | trans | -83.3 | 130.1 | 176.8 | -53.6 | 110.3 | 0 | 0 | 0 | 110 | H299 M323 D324 G326 H332 Q336 | H299-H328 PolarHBondContact NE2-O 3.46Å; M323-H328 WeakPolarHBondContact CA-O 3.05Å; D324-H328 PolarHBondContact N-O 3.31Å; D324-H328 WeakPolarHBondContact OD1-CB 3.46Å; D324-H328 IonicContact OD1-CG 3.72Å; D324-H328 PolarHBondContact OD1-N 2.84Å; D324-H328 IonicContact OD1-ND1 3.38Å; D324-H328 PolarHBondContact OD1-ND1 3.46Å; D324-H328 IonicContact OD2-CG 3.86Å; D324-H328 IonicContact OD2-ND1 3.34Å; D324-H328 PolarHBondContact OD2-ND1 3.3Å; G326-H328 PolarHBondContact O-N 3.48Å; H328-H332 HydrophobicContact CB-CB 3.89Å; H328-Q336 PolarHBondContact NE2-NE2 3.02Å | ||
| 329 | T | 82.4 | Confident | 75.6 | Confident | 19 Ų | 19 | 43.6 Ų | 43.6 | 12% | 0.117 | 26% | 0.255 | C | S | . | . | trans | -82.8 | 165.8 | 167.4 | 69.5 | 0 | 0 | 0 | 0 | 110.8 | T322 M323 L331 H332 C333 | T322-T329 WeakPolarHBondContact O-CA 3.28Å; M323-T329 HydrophobicContact CG-CG2 3.87Å; T329-L331 PolarHBondContact O-N 2.92Å; T329-L331 VanDerWaalsContact O-N 3.1Å; T329-H332 PolarHBondContact N-ND1 3.47Å; T329-H332 WeakPolarHBondContact O-CA 3.44Å; T329-H332 VanDerWaalsContact O-CB 3.32Å; T329-H332 WeakPolarHBondContact O-CB 3.09Å; T329-H332 PolarHBondContact O-N 2.94Å; T329-H332 PolarHBondContact OG1-ND1 3.19Å; T329-C333 PolarHBondContact O-N 3.1Å; T329-C333 VanDerWaalsContact O-N 3.14Å | ||
| 330 | P | 82.2 | Confident | 74.2 | Confident | 0 Ų | 0 | 44.3 Ų | 44.3 | 0% | 0 | 26% | 0.264 | C | S | . | . | H | α-helix | trans | -53.5 | -33.9 | 174.8 | -27.5 | 33.7 | 0 | 0 | 0 | 113.2 | L298 H299 C302 A320 T322 H332 C333 A334 L353 | L298-P330 HydrophobicContact CB-CG 4.48Å; L298-P330 HydrophobicContact CD2-CB 4.12Å; L298-P330 HydrophobicContact CD2-CG 3.71Å; L298-P330 HydrophobicContact CG-CB 3.92Å; L298-P330 HydrophobicContact CG-CG 3.88Å; H299-P330 WeakPolarHBondContact NE2-CD 3.44Å; C302-P330 HydrophobicContact CB-CB 4.44Å; C302-P330 VanDerWaalsContact CB-O 3.28Å; C302-P330 WeakPolarHBondContact CB-O 3.14Å; A320-P330 WeakPolarHBondContact O-CD 3.4Å; T322-P330 VanDerWaalsContact O-CD 3.22Å; T322-P330 WeakPolarHBondContact O-CD 3.45Å; P330-H332 VanDerWaalsContact C-N 3.34Å; P330-H332 PolarHBondContact O-N 2.94Å; P330-C333 WeakPolarHBondContact O-CB 3.43Å; P330-C333 PolarHBondContact O-N 3.33Å; P330-A334 PolarHBondContact O-N 3.33Å; P330-L353 HydrophobicContact CB-CD1 4.42Å; P330-L353 HydrophobicContact CB-CD2 4.1Å |
| 331 | L | 78.1 | Confident | 72.9 | Confident | 2 Ų | 2 | 45.6 Ų | 45.6 | 1% | 0.01 | 28% | 0.275 | C | S | . | . | H | α-helix | trans | -62 | -39.1 | 174.2 | -170.8 | 70.5 | 0 | 0 | 0 | 112.3 | T329 L335 V350 L353 W362 | T329-L331 PolarHBondContact O-N 2.92Å; T329-L331 VanDerWaalsContact O-N 3.1Å; L331-L335 WeakPolarHBondContact O-CG 3.33Å; L331-V350 HydrophobicContact CD1-CB 4.43Å; L331-V350 HydrophobicContact CD1-CG1 4Å; L331-V350 HydrophobicContact CD1-CG2 4.02Å; L331-L353 HydrophobicContact CB-CD1 4.24Å; L331-L353 HydrophobicContact CD1-CD1 3.99Å; L331-W362 HydrophobicContact CD1-CH2 4.31Å; L331-W362 HydrophobicContact CD1-CZ3 4.24Å; L331-W362 HydrophobicContact CD2-CE3 4.23Å; L331-W362 HydrophobicContact CD2-CH2 4.33Å; L331-W362 HydrophobicContact CD2-CZ3 4.13Å; L331-W362 HydrophobicContact CG-CZ3 4.35Å |
| 332 | H | 75.1 | Confident | 71.3 | Confident | 30 Ų | 30 | 43.7 Ų | 43.7 | 14% | 0.139 | 27% | 0.265 | C | S | . | . | H | α-helix | trans | -65.8 | -41.8 | 174.4 | -66.1 | 87.2 | 0 | 0 | 0 | 111 | H328 T329 P330 A334 L335 Q336 | H328-H332 HydrophobicContact CB-CB 3.89Å; T329-H332 PolarHBondContact N-ND1 3.47Å; T329-H332 WeakPolarHBondContact O-CA 3.44Å; T329-H332 VanDerWaalsContact O-CB 3.32Å; T329-H332 WeakPolarHBondContact O-CB 3.09Å; T329-H332 PolarHBondContact O-N 2.94Å; T329-H332 PolarHBondContact OG1-ND1 3.19Å; P330-H332 VanDerWaalsContact C-N 3.34Å; P330-H332 PolarHBondContact O-N 2.94Å; H332-A334 VanDerWaalsContact C-N 3.34Å; H332-A334 PolarHBondContact O-N 3.32Å; H332-L335 PolarHBondContact O-N 3.45Å; H332-L335 VanDerWaalsContact O-N 3.16Å; H332-Q336 PolarHBondContact O-N 3.44Å |
| 333 | C | 78.6 | Confident | 69.3 | Low | 0 Ų | 0 | 46.9 Ų | 46.9 | 0% | 0 | 29% | 0.293 | C | S | . | . | H | α-helix | trans | -63.1 | -39.2 | 178.2 | -60.1 | 0 | 0 | 0 | 0 | 112.2 | H299 C302 R303 T329 P330 L335 Q336 G337 | H299-C333 WeakPolarHBondContact O-CB 3.48Å; C302-C333 HydrophobicContact CB-CB 4.32Å; R303-C333 WeakPolarHBondContact CA-O 3.44Å; R303-C333 HydrophobicContact CB-CB 4.22Å; T329-C333 PolarHBondContact O-N 3.1Å; T329-C333 VanDerWaalsContact O-N 3.14Å; P330-C333 WeakPolarHBondContact O-CB 3.43Å; P330-C333 PolarHBondContact O-N 3.33Å; C333-L335 PolarHBondContact O-N 2.97Å; C333-L335 VanDerWaalsContact O-N 3.13Å; C333-Q336 PolarHBondContact O-N 3.33Å; C333-Q336 VanDerWaalsContact O-N 3.08Å; C333-G337 PolarHBondContact O-N 2.9Å |
| 334 | A | 76.7 | Confident | 67.9 | Low | 2 Ų | 2 | 48.3 Ų | 48.3 | 2% | 0.017 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -56 | -29.7 | 175.4 | 0 | 0 | 0 | 0 | 0 | 113.2 | C302 P330 H332 L342 V349 V350 | C302-A334 HydrophobicContact CB-CB 4.04Å; C302-A334 WeakPolarHBondContact O-CA 3.28Å; P330-A334 PolarHBondContact O-N 3.33Å; H332-A334 VanDerWaalsContact C-N 3.34Å; H332-A334 PolarHBondContact O-N 3.32Å; A334-L342 WeakPolarHBondContact O-CD2 3.49Å; A334-V349 HydrophobicContact CB-CG1 3.91Å; A334-V350 HydrophobicContact CB-CG2 4.47Å |
| 335 | L | 70.6 | Confident | 66.5 | Low | 20 Ų | 20 | 48.7 Ų | 48.7 | 11% | 0.105 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -89.4 | -18.9 | -178.1 | -60 | 167.8 | 0 | 0 | 0 | 113.3 | L331 H332 C333 W362 P363 L366 F373 | L331-L335 WeakPolarHBondContact O-CG 3.33Å; H332-L335 PolarHBondContact O-N 3.45Å; H332-L335 VanDerWaalsContact O-N 3.16Å; C333-L335 PolarHBondContact O-N 2.97Å; C333-L335 VanDerWaalsContact O-N 3.13Å; L335-W362 HydrophobicContact CD1-CE3 4.46Å; L335-P363 HydrophobicContact CD1-CG 4.28Å; L335-L366 HydrophobicContact CD1-CD1 3.95Å; L335-L366 HydrophobicContact CD1-CD2 3.5Å; L335-L366 HydrophobicContact CD1-CG 3.97Å; L335-L366 HydrophobicContact CD2-CD2 3.51Å; L335-L366 HydrophobicContact CG-CD2 4.04Å; L335-F373 HydrophobicContact CD2-CE1 4.4Å; L335-F373 HydrophobicContact CD2-CZ 4.27Å |
| 336 | Q | 71 | Confident | 65.8 | Low | 97 Ų | 97 | 40.5 Ų | 40.5 | 45% | 0.453 | 27% | 0.271 | S | S | . | . | H | α-helix | trans | -85.3 | -10 | 178.3 | -70.5 | 177.7 | -2.8 | 0 | 0 | 113 | H328 H332 C333 | H328-Q336 PolarHBondContact NE2-NE2 3.02Å; H332-Q336 PolarHBondContact O-N 3.44Å; C333-Q336 PolarHBondContact O-N 3.33Å; C333-Q336 VanDerWaalsContact O-N 3.08Å |
| 337 | G | 64.9 | Low | 65.4 | Low | 4 Ų | 4 | 41.3 Ų | 41.3 | 4% | 0.041 | 26% | 0.261 | C | S | . | . | S | Bend | trans | -59.3 | 163.9 | -178.3 | 0 | 0 | 0 | 0 | 0 | 115.2 | R303 C333 L342 | R303-G337 WeakPolarHBondContact O-CA 3.1Å; C333-G337 PolarHBondContact O-N 2.9Å; G337-L342 WeakPolarHBondContact O-CD1 3.38Å |
| 338 | P | 60.3 | Low | 65.2 | Low | 65 Ų | 65 | 44.9 Ų | 44.9 | 42% | 0.422 | 27% | 0.267 | S | S | . | . | trans | -68.6 | 131.9 | 177.7 | 26.3 | -31.4 | 0 | 0 | 0 | 111.5 | A340 A341 L342 | P338-A340 PolarHBondContact O-N 3.01Å; P338-A341 HydrophobicContact CG-CB 4.17Å; P338-A341 PolarHBondContact O-N 2.89Å; P338-L342 VanDerWaalsContact O-CG 3.31Å; P338-L342 WeakPolarHBondContact O-CG 3.28Å; P338-L342 PolarHBondContact O-N 3.08Å | ||
| 339 | A | 52.5 | Low | 65 | Low | 72 Ų | 72 | 42 Ų | 42 | 60% | 0.595 | 25% | 0.254 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -52.6 | -28.1 | -176.3 | 0 | 0 | 0 | 0 | 0 | 114.5 | L342 A343 | A339-L342 PolarHBondContact O-N 2.99Å; A339-A343 PolarHBondContact O-N 3.39Å |
| 340 | A | 52.3 | Low | 64.5 | Low | 73 Ų | 73 | 41.1 Ų | 41.1 | 60% | 0.603 | 25% | 0.248 | S | C | * | . | T | Hydrogen-bonded Turn | trans | -69.8 | -35.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 113.8 | P338 | P338-A340 PolarHBondContact O-N 3.01Š|
| 341 | A | 51.5 | Low | 63.9 | Low | 32 Ų | 32 | 46.1 Ų | 46.1 | 26% | 0.264 | 27% | 0.267 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -79.2 | -27.2 | 171.7 | 0 | 0 | 0 | 0 | 0 | 111.3 | P338 A343 S345 | P338-A341 HydrophobicContact CG-CB 4.17Å; P338-A341 PolarHBondContact O-N 2.89Å; A341-A343 VanDerWaalsContact C-N 3.31Å; A341-A343 PolarHBondContact O-N 2.78Å; A341-S345 PolarHBondContact O-OG 3.21Å; A341-S345 VanDerWaalsContact O-OG 3.08Å |
| 342 | L | 45.2 | Very low | 63.6 | Low | 16 Ų | 16 | 46 Ų | 46 | 8% | 0.084 | 27% | 0.267 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -76.4 | -5 | -176.3 | -65.2 | 172.7 | 0 | 0 | 0 | 114.9 | A334 G337 P338 A339 Q344 P346 | A334-L342 WeakPolarHBondContact O-CD2 3.49Å; G337-L342 WeakPolarHBondContact O-CD1 3.38Å; P338-L342 VanDerWaalsContact O-CG 3.31Å; P338-L342 WeakPolarHBondContact O-CG 3.28Å; P338-L342 PolarHBondContact O-N 3.08Å; A339-L342 PolarHBondContact O-N 2.99Å; L342-Q344 VanDerWaalsContact C-N 3.34Å; L342-Q344 PolarHBondContact O-N 3.46Å; L342-P346 HydrophobicContact CB-CG 4.28Å; L342-P346 HydrophobicContact CD2-CB 3.81Å; L342-P346 HydrophobicContact CD2-CG 4.24Å; L342-P346 WeakPolarHBondContact O-CD 3.44Å; L342-P346 WeakPolarHBondContact O-CG 3.32Å |
| 343 | A | 41.9 | Very low | 63.5 | Low | 85 Ų | 85 | 44.6 Ų | 44.6 | 70% | 0.702 | 26% | 0.26 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -75 | -23.3 | -178.7 | 0 | 0 | 0 | 0 | 0 | 113.4 | A339 A341 | A339-A343 PolarHBondContact O-N 3.39Å; A341-A343 VanDerWaalsContact C-N 3.31Å; A341-A343 PolarHBondContact O-N 2.78Å |
| 344 | Q | 49.2 | Very low | 63.2 | Low | 147 Ų | 147 | 45.9 Ų | 45.9 | 69% | 0.687 | 27% | 0.267 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -122.1 | -21.6 | -173.5 | -65.6 | -177.9 | -2.7 | 0 | 0 | 114.6 | L342 H348 | L342-Q344 VanDerWaalsContact C-N 3.34Å; L342-Q344 PolarHBondContact O-N 3.46Å; Q344-H348 PolarHBondContact O-ND1 2.85Å |
| 345 | S | 55.5 | Low | 63 | Low | 22 Ų | 22 | 50.9 Ų | 50.9 | 15% | 0.154 | 29% | 0.293 | C | S | . | . | S | Bend | trans | -120 | -11.8 | -167.8 | 67.2 | 0 | 0 | 0 | 0 | 119.5 | G305 A341 E347 H348 V349 | G305-S345 WeakPolarHBondContact O-CB 3.39Å; G305-S345 PolarHBondContact O-OG 2.95Å; A341-S345 PolarHBondContact O-OG 3.21Å; A341-S345 VanDerWaalsContact O-OG 3.08Å; S345-E347 VanDerWaalsContact C-N 3.32Å; S345-E347 PolarHBondContact O-N 2.93Å; S345-H348 PolarHBondContact O-N 3.08Å; S345-V349 WeakPolarHBondContact O-CG2 3.34Å; S345-V349 PolarHBondContact O-N 3.1Å |
| 346 | P | 63.9 | Low | 62.9 | Low | 13 Ų | 13 | 54.3 Ų | 54.3 | 8% | 0.084 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -71.9 | -31.7 | -173.7 | 30.1 | -34.3 | 0 | 0 | 0 | 111.6 | L342 H348 V349 V350 | L342-P346 HydrophobicContact CB-CG 4.28Å; L342-P346 HydrophobicContact CD2-CB 3.81Å; L342-P346 HydrophobicContact CD2-CG 4.24Å; L342-P346 WeakPolarHBondContact O-CD 3.44Å; L342-P346 WeakPolarHBondContact O-CG 3.32Å; P346-H348 VanDerWaalsContact C-N 3.29Å; P346-H348 PolarHBondContact O-N 3.26Å; P346-V349 PolarHBondContact O-N 3.14Å; P346-V350 WeakPolarHBondContact O-CB 3.19Å; P346-V350 WeakPolarHBondContact O-CG2 3.17Å; P346-V350 PolarHBondContact O-N 3.46Å |
| 347 | E | 66.3 | Low | 62.7 | Low | 70 Ų | 70 | 52 Ų | 52 | 33% | 0.327 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -63.3 | -40 | 176.2 | -59.6 | -171.7 | 174.7 | 0 | 0 | 110.9 | S345 R351 F373 S376 L380 | S345-E347 VanDerWaalsContact C-N 3.32Å; S345-E347 PolarHBondContact O-N 2.93Å; E347-R351 WeakPolarHBondContact O-CB 2.93Å; E347-R351 PolarHBondContact O-N 3.08Å; E347-F373 HydrophobicContact CG-CD2 4.49Å; E347-S376 WeakPolarHBondContact OE1-CB 3.12Å; E347-S376 PolarHBondContact OE1-OG 3.07Å; E347-S376 VanDerWaalsContact OE1-OG 3.1Å; E347-S376 PolarHBondContact OE2-OG 3.44Å; E347-L380 HydrophobicContact CB-CD1 4.25Å |
| 348 | H | 71.8 | Confident | 62.7 | Low | 113 Ų | 113 | 52.1 Ų | 52.1 | 52% | 0.523 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -68.4 | -47.3 | 176.4 | -65.2 | 106.1 | 0 | 0 | 0 | 111.8 | A307 Q344 S345 P346 V350 R351 A352 | A307-H348 HydrophobicContact CB-CB 3.71Å; Q344-H348 PolarHBondContact O-ND1 2.85Å; S345-H348 PolarHBondContact O-N 3.08Å; P346-H348 VanDerWaalsContact C-N 3.29Å; P346-H348 PolarHBondContact O-N 3.26Å; H348-V350 VanDerWaalsContact C-N 3.35Å; H348-V350 PolarHBondContact O-N 2.78Å; H348-R351 PolarHBondContact O-N 3.21Å; H348-A352 WeakPolarHBondContact O-CB 3.01Å; H348-A352 PolarHBondContact O-N 3.46Å |
| 349 | V | 74.6 | Confident | 62.8 | Low | 0 Ų | 0 | 53.2 Ų | 53.2 | 0% | 0 | 32% | 0.317 | C | S | . | . | H | α-helix | trans | -59 | -46.3 | 175.9 | 170.5 | 0 | 0 | 0 | 0 | 111.2 | C302 A307 V310 A334 S345 P346 A352 L353 | C302-V349 HydrophobicContact CB-CG1 4.22Å; A307-V349 HydrophobicContact CB-CG2 3.87Å; V310-V349 HydrophobicContact CG1-CG1 4.47Å; V310-V349 HydrophobicContact CG2-CG1 4.2Å; V310-V349 HydrophobicContact CG2-CG2 4.3Å; A334-V349 HydrophobicContact CB-CG1 3.91Å; S345-V349 WeakPolarHBondContact O-CG2 3.34Å; S345-V349 PolarHBondContact O-N 3.1Å; P346-V349 PolarHBondContact O-N 3.14Å; V349-A352 WeakPolarHBondContact O-CB 3.05Å; V349-A352 PolarHBondContact O-N 3.47Å; V349-L353 HydrophobicContact CG1-CD1 4.08Å; V349-L353 WeakPolarHBondContact O-CG 3.2Å; V349-L353 PolarHBondContact O-N 3.43Å |
| 350 | V | 72.4 | Confident | 63 | Low | 1 Ų | 1 | 54.1 Ų | 54.1 | 1% | 0.006 | 31% | 0.305 | C | S | . | . | H | α-helix | trans | -69.5 | -37.9 | -178.4 | 171.7 | 0 | 0 | 0 | 0 | 110.8 | L331 A334 P346 H348 L353 L354 W362 F373 L377 | L331-V350 HydrophobicContact CD1-CB 4.43Å; L331-V350 HydrophobicContact CD1-CG1 4Å; L331-V350 HydrophobicContact CD1-CG2 4.02Å; A334-V350 HydrophobicContact CB-CG2 4.47Å; P346-V350 WeakPolarHBondContact O-CB 3.19Å; P346-V350 WeakPolarHBondContact O-CG2 3.17Å; P346-V350 PolarHBondContact O-N 3.46Å; H348-V350 VanDerWaalsContact C-N 3.35Å; H348-V350 PolarHBondContact O-N 2.78Å; V350-L353 PolarHBondContact O-N 2.87Å; V350-L354 HydrophobicContact CG1-CD1 3.87Å; V350-L354 HydrophobicContact CG1-CG 4.25Å; V350-L354 WeakPolarHBondContact O-CB 3.07Å; V350-L354 WeakPolarHBondContact O-CG 3.31Å; V350-L354 PolarHBondContact O-N 2.88Å; V350-W362 HydrophobicContact CG1-CH2 3.83Å; V350-F373 HydrophobicContact CB-CZ 4.2Å; V350-F373 HydrophobicContact CG1-CZ 4.03Å; V350-F373 HydrophobicContact CG2-CE2 4.18Å; V350-F373 HydrophobicContact CG2-CZ 3.79Å; V350-L377 HydrophobicContact CB-CD1 4.49Å; V350-L377 HydrophobicContact CG1-CD1 3.44Å; V350-L377 VanDerWaalsContact CG1-CD1 3.44Å |
| 351 | R | 70 | Confident | 62.9 | Low | 104 Ų | 104 | 55 Ų | 55 | 39% | 0.392 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -60.3 | -47.3 | 172.5 | -179.1 | -176.8 | 177 | 92 | 3.6 | 111.1 | E347 H348 L354 N355 L380 | E347-R351 WeakPolarHBondContact O-CB 2.93Å; E347-R351 PolarHBondContact O-N 3.08Å; H348-R351 PolarHBondContact O-N 3.21Å; R351-L354 PolarHBondContact O-N 2.85Å; R351-N355 WeakPolarHBondContact O-CB 3.49Å; R351-N355 PolarHBondContact O-N 3.38Å; R351-N355 PolarHBondContact O-ND2 3.34Å; R351-L380 PolarHBondContact NH1-O 3.13Å |
| 352 | A | 71.3 | Confident | 63 | Low | 0 Ų | 0 | 55.9 Ų | 55.9 | 0% | 0 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -55.6 | -54.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 110.9 | V310 E311 L314 H348 V349 L354 N355 H356 | V310-A352 HydrophobicContact CG1-CB 4.04Å; E311-A352 VanDerWaalsContact CD-CB 3.45Å; E311-A352 HydrophobicContact CG-CB 3.96Å; E311-A352 WeakPolarHBondContact OE1-CA 3.45Å; E311-A352 WeakPolarHBondContact OE1-CB 3.29Å; L314-A352 HydrophobicContact CD1-CB 4.13Å; H348-A352 WeakPolarHBondContact O-CB 3.01Å; H348-A352 PolarHBondContact O-N 3.46Å; V349-A352 WeakPolarHBondContact O-CB 3.05Å; V349-A352 PolarHBondContact O-N 3.47Å; A352-L354 VanDerWaalsContact C-N 3.35Å; A352-L354 PolarHBondContact O-N 3.46Å; A352-N355 PolarHBondContact O-N 3.49Å; A352-H356 PolarHBondContact O-CD2 3.2Å; A352-H356 VanDerWaalsContact O-CD2 3.29Å; A352-H356 PolarHBondContact O-N 3.46Å; A352-H356 VanDerWaalsContact O-N 3.1Å |
| 353 | L | 72.7 | Confident | 63 | Low | 0 Ų | 0 | 57.3 Ų | 57.3 | 0% | 0 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -57.7 | -44 | 178.7 | -70.7 | 172.8 | 0 | 0 | 0 | 112.7 | L298 V310 L314 A320 P330 L331 V349 V350 H356 G357 A358 | L298-L353 HydrophobicContact CD1-CD2 4.39Å; L298-L353 HydrophobicContact CD2-CD2 4.36Å; V310-L353 HydrophobicContact CG1-CD2 4.38Å; V310-L353 HydrophobicContact CG1-CG 4.42Å; L314-L353 HydrophobicContact CD1-CD2 4.31Å; A320-L353 HydrophobicContact CB-CD2 4.15Å; P330-L353 HydrophobicContact CB-CD1 4.42Å; P330-L353 HydrophobicContact CB-CD2 4.1Å; L331-L353 HydrophobicContact CB-CD1 4.24Å; L331-L353 HydrophobicContact CD1-CD1 3.99Å; V349-L353 HydrophobicContact CG1-CD1 4.08Å; V349-L353 WeakPolarHBondContact O-CG 3.2Å; V349-L353 PolarHBondContact O-N 3.43Å; V350-L353 PolarHBondContact O-N 2.87Å; L353-H356 CarbonylContact O-C 3.53Å; L353-H356 PolarHBondContact O-N 3.34Å; L353-G357 PolarHBondContact O-N 2.98Å; L353-A358 HydrophobicContact CB-CB 3.89Å; L353-A358 WeakPolarHBondContact O-CB 3.33Å; L353-A358 PolarHBondContact O-N 3.27Å |
| 354 | L | 71.8 | Confident | 63.1 | Low | 28 Ų | 28 | 55.7 Ų | 55.7 | 15% | 0.147 | 30% | 0.3 | C | S | . | . | H | α-helix | trans | -67.6 | -36.5 | 179.5 | -72.7 | 175.3 | 0 | 0 | 0 | 112.7 | V350 R351 A352 H356 G357 R360 L377 | V350-L354 HydrophobicContact CG1-CD1 3.87Å; V350-L354 HydrophobicContact CG1-CG 4.25Å; V350-L354 WeakPolarHBondContact O-CB 3.07Å; V350-L354 WeakPolarHBondContact O-CG 3.31Å; V350-L354 PolarHBondContact O-N 2.88Å; R351-L354 PolarHBondContact O-N 2.85Å; A352-L354 VanDerWaalsContact C-N 3.35Å; A352-L354 PolarHBondContact O-N 3.46Å; L354-H356 VanDerWaalsContact C-N 3.27Å; L354-H356 PolarHBondContact O-N 3.24Å; L354-G357 PolarHBondContact O-N 2.98Å; L354-R360 HydrophobicContact CD2-CG 3.92Å; L354-L377 HydrophobicContact CD1-CD1 4.34Å; L354-L377 HydrophobicContact CD1-CD2 4.4Å |
| 355 | N | 72.9 | Confident | 62.8 | Low | 106 Ų | 106 | 52 Ų | 52 | 57% | 0.567 | 30% | 0.295 | S | S | * | . | H | α-helix | trans | -65.4 | -34.2 | 175.7 | -70.3 | -17.3 | 0 | 0 | 0 | 111.5 | R351 A352 G357 | R351-N355 WeakPolarHBondContact O-CB 3.49Å; R351-N355 PolarHBondContact O-N 3.38Å; R351-N355 PolarHBondContact O-ND2 3.34Å; A352-N355 PolarHBondContact O-N 3.49Å; N355-G357 VanDerWaalsContact C-N 3.3Å; N355-G357 PolarHBondContact O-N 3.41Å |
| 356 | H | 69.6 | Low | 62.4 | Low | 92 Ų | 92 | 51.4 Ų | 51.4 | 43% | 0.426 | 29% | 0.29 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -90.1 | 17.4 | 177.7 | -72.7 | -93.9 | 0 | 0 | 0 | 113.9 | E311 L314 A352 L353 L354 | E311-H356 IonicContact OE2-NE2 2.8Å; L314-H356 HydrophobicContact CB-CB 4.5Å; L314-H356 HydrophobicContact CD1-CB 4.05Å; L314-H356 HydrophobicContact CD2-CB 4.03Å; L314-H356 HydrophobicContact CG-CB 4.43Å; A352-H356 PolarHBondContact O-CD2 3.2Å; A352-H356 VanDerWaalsContact O-CD2 3.29Å; A352-H356 PolarHBondContact O-N 3.46Å; A352-H356 VanDerWaalsContact O-N 3.1Å; L353-H356 CarbonylContact O-C 3.53Å; L353-H356 PolarHBondContact O-N 3.34Å; L354-H356 VanDerWaalsContact C-N 3.27Å; L354-H356 PolarHBondContact O-N 3.24Å |
| 357 | G | 66 | Low | 61.6 | Low | 48 Ų | 48 | 53.1 Ų | 53.1 | 50% | 0.495 | 30% | 0.301 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 84.8 | 25.3 | 169.3 | 0 | 0 | 0 | 0 | 0 | 115.7 | N321 L353 L354 N355 V359 | N321-G357 PolarHBondContact ND2-O 3.34Å; L353-G357 PolarHBondContact O-N 2.98Å; L354-G357 PolarHBondContact O-N 2.98Å; N355-G357 VanDerWaalsContact C-N 3.3Å; N355-G357 PolarHBondContact O-N 3.41Å; G357-V359 PolarHBondContact O-N 3.32Å |
| 358 | A | 65.9 | Low | 60.6 | Low | 8 Ų | 8 | 58.8 Ų | 58.8 | 7% | 0.066 | 33% | 0.325 | C | S | . | . | trans | -60.9 | 128.9 | 172.1 | 0 | 0 | 0 | 0 | 0 | 111.9 | A320 N321 L353 | A320-A358 HydrophobicContact CB-CB 4.11Å; N321-A358 VanDerWaalsContact OD1-CA 3.28Å; N321-A358 WeakPolarHBondContact OD1-CA 3.4Å; L353-A358 HydrophobicContact CB-CB 3.89Å; L353-A358 WeakPolarHBondContact O-CB 3.33Å; L353-A358 PolarHBondContact O-N 3.27Å | ||
| 359 | V | 60.4 | Low | 59.3 | Low | 87 Ų | 87 | 59.7 Ų | 59.7 | 53% | 0.527 | 33% | 0.327 | S | S | . | . | trans | -70.6 | 130.8 | 179.2 | -175.9 | 0 | 0 | 0 | 0 | 109.3 | N321 G357 V361 | N321-V359 PolarHBondContact OD1-N 2.89Å; G357-V359 PolarHBondContact O-N 3.32Å; V359-V361 HydrophobicContact CG1-CG2 3.94Å; V359-V361 PolarHBondContact O-N 2.67Å | ||
| 360 | R | 57.8 | Low | 58.1 | Low | 91 Ų | 91 | 62 Ų | 62 | 34% | 0.343 | 34% | 0.338 | S | S | . | . | trans | -77.3 | 56.7 | -176.1 | -68.6 | 178.2 | 169.3 | 160 | -3 | 112.8 | L354 W362 R385 | L354-R360 HydrophobicContact CD2-CG 3.92Å; R360-W362 PolarHBondContact O-N 3.16Å; R360-R385 VanDerWaalsContact CZ-CZ 3.41Å | ||
| 361 | V | 51 | Low | 56.8 | Low | 91 Ų | 91 | 70.1 Ų | 70.1 | 55% | 0.552 | 38% | 0.376 | S | S | * | . | trans | -89.5 | 96.5 | 167.8 | -173.3 | 0 | 0 | 0 | 0 | 107.4 | V359 P363 | V359-V361 HydrophobicContact CG1-CG2 3.94Å; V359-V361 PolarHBondContact O-N 2.67Å; V361-P363 WeakPolarHBondContact O-CD 3.42Å | ||
| 362 | W | 52.7 | Low | 55.7 | Low | 52 Ų | 52 | 75.5 Ų | 75.5 | 20% | 0.197 | 40% | 0.396 | C | S | . | . | trans | -92.6 | 117.3 | -178 | -65.9 | 104.9 | 0 | 0 | 0 | 109.5 | L331 L335 V350 R360 G364 L366 F373 L377 | L331-W362 HydrophobicContact CD1-CH2 4.31Å; L331-W362 HydrophobicContact CD1-CZ3 4.24Å; L331-W362 HydrophobicContact CD2-CE3 4.23Å; L331-W362 HydrophobicContact CD2-CH2 4.33Å; L331-W362 HydrophobicContact CD2-CZ3 4.13Å; L331-W362 HydrophobicContact CG-CZ3 4.35Å; L335-W362 HydrophobicContact CD1-CE3 4.46Å; V350-W362 HydrophobicContact CG1-CH2 3.83Å; R360-W362 PolarHBondContact O-N 3.16Å; W362-G364 PolarHBondContact O-N 3.48Å; W362-L366 HydrophobicContact CB-CD1 3.54Å; W362-L366 HydrophobicContact CD2-CD1 3.99Å; W362-L366 HydrophobicContact CE3-CD1 3.38Å; W362-L366 HydrophobicContact CE3-CD2 4.49Å; W362-L366 HydrophobicContact CG-CD1 4.11Å; W362-L366 HydrophobicContact CZ3-CD1 4.35Å; W362-F373 HydrophobicContact CH2-CE1 4.1Å; W362-F373 HydrophobicContact CH2-CZ 4.42Å; W362-F373 AromaticContact CZ3-CE1 3.87Å; W362-F373 HydrophobicContact CZ3-CE1 3.87Å; W362-F373 HydrophobicContact CZ3-CZ 4.31Å; W362-L377 HydrophobicContact CH2-CD1 3.77Å; W362-L377 HydrophobicContact CZ2-CD1 4.27Å; W362-L377 HydrophobicContact CZ2-CD2 4.31Å | ||
| 363 | P | 44.8 | Very low | 54.6 | Low | 46 Ų | 46 | 76 Ų | 76 | 30% | 0.299 | 40% | 0.399 | S | S | . | . | trans | -63 | 129.9 | 174.6 | 21.8 | -32.3 | 0 | 0 | 0 | 110.6 | L335 V361 A365 L366 | L335-P363 HydrophobicContact CD1-CG 4.28Å; V361-P363 WeakPolarHBondContact O-CD 3.42Å; P363-A365 PolarHBondContact O-N 2.96Å; P363-L366 HydrophobicContact CG-CD1 4.03Å; P363-L366 HydrophobicContact CG-CG 4.36Å; P363-L366 WeakPolarHBondContact O-CB 3.3Å; P363-L366 VanDerWaalsContact O-CD1 3.3Å; P363-L366 WeakPolarHBondContact O-CD1 3.46Å; P363-L366 WeakPolarHBondContact O-CG 3.49Å; P363-L366 PolarHBondContact O-N 3.1Å | ||
| 364 | G | 43.9 | Very low | 53.3 | Low | 50 Ų | 50 | 78.3 Ų | 78.3 | 52% | 0.515 | 41% | 0.407 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -58.4 | -3.3 | -177.8 | 0 | 0 | 0 | 0 | 0 | 116.2 | W362 L366 P367 | W362-G364 PolarHBondContact O-N 3.48Å; G364-L366 VanDerWaalsContact C-N 3.33Å; G364-P367 VanDerWaalsContact O-CD 3.26Å; G364-P367 WeakPolarHBondContact O-CD 3.48Å |
| 365 | A | 44.3 | Very low | 51.9 | Low | 70 Ų | 70 | 80.8 Ų | 80.8 | 58% | 0.579 | 43% | 0.427 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -77.3 | -14.5 | 171.6 | 0 | 0 | 0 | 0 | 0 | 114 | P363 P367 K368 | P363-A365 PolarHBondContact O-N 2.96Å; A365-P367 VanDerWaalsContact C-CD 3.46Å; A365-K368 PolarHBondContact O-N 2.67Å |
| 366 | L | 46.9 | Very low | 50.5 | Low | 10 Ų | 10 | 77.2 Ų | 77.2 | 5% | 0.052 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -54.6 | -44.8 | -178.8 | -87.4 | 158.4 | 0 | 0 | 0 | 116.7 | L335 W362 P363 G364 K368 K369 H370 Y374 | L335-L366 HydrophobicContact CD1-CD1 3.95Å; L335-L366 HydrophobicContact CD1-CD2 3.5Å; L335-L366 HydrophobicContact CD1-CG 3.97Å; L335-L366 HydrophobicContact CD2-CD2 3.51Å; L335-L366 HydrophobicContact CG-CD2 4.04Å; W362-L366 HydrophobicContact CB-CD1 3.54Å; W362-L366 HydrophobicContact CD2-CD1 3.99Å; W362-L366 HydrophobicContact CE3-CD1 3.38Å; W362-L366 HydrophobicContact CE3-CD2 4.49Å; W362-L366 HydrophobicContact CG-CD1 4.11Å; W362-L366 HydrophobicContact CZ3-CD1 4.35Å; P363-L366 HydrophobicContact CG-CD1 4.03Å; P363-L366 HydrophobicContact CG-CG 4.36Å; P363-L366 WeakPolarHBondContact O-CB 3.3Å; P363-L366 VanDerWaalsContact O-CD1 3.3Å; P363-L366 WeakPolarHBondContact O-CD1 3.46Å; P363-L366 WeakPolarHBondContact O-CG 3.49Å; P363-L366 PolarHBondContact O-N 3.1Å; G364-L366 VanDerWaalsContact C-N 3.33Å; L366-K368 PolarHBondContact O-N 3.1Å; L366-K369 PolarHBondContact O-N 3.3Å; L366-H370 PolarHBondContact O-N 3.37Å; L366-Y374 HydrophobicContact CB-CE2 4.07Å |
| 367 | P | 46.2 | Very low | 49.2 | Very low | 49 Ų | 49 | 73.4 Ų | 73.4 | 32% | 0.318 | 39% | 0.393 | S | S | . | . | H | α-helix | trans | -65.4 | -25.3 | -177.3 | -16.8 | 29.9 | 0 | 0 | 0 | 112.6 | G364 A365 Q371 | G364-P367 VanDerWaalsContact O-CD 3.26Å; G364-P367 WeakPolarHBondContact O-CD 3.48Å; A365-P367 VanDerWaalsContact C-CD 3.46Å; P367-Q371 WeakPolarHBondContact O-CG 3.45Å |
| 368 | K | 46 | Very low | 48.3 | Very low | 189 Ų | 189 | 73.9 Ų | 73.9 | 82% | 0.822 | 38% | 0.382 | S | S | * | . | H | α-helix | trans | -80.5 | -33.5 | -174.8 | -65.8 | -175.9 | 178.9 | -179.9 | 0 | 112.9 | A365 L366 | A365-K368 PolarHBondContact O-N 2.67Å; L366-K368 PolarHBondContact O-N 3.1Å |
| 369 | K | 43.3 | Very low | 47.4 | Very low | 131 Ų | 131 | 76.9 Ų | 76.9 | 57% | 0.57 | 41% | 0.407 | S | S | * | . | H | α-helix | trans | -90.7 | -38.7 | -173.7 | -149.3 | 178.2 | 177.2 | -170 | 0 | 112.1 | L366 | L366-K369 PolarHBondContact O-N 3.3Å |
| 370 | H | 49.7 | Very low | 46.4 | Very low | 49 Ų | 49 | 75.6 Ų | 75.6 | 23% | 0.227 | 40% | 0.397 | C | S | . | . | trans | -137 | 75.6 | -173.1 | -60.3 | -23 | 0 | 0 | 0 | 112.5 | L366 R372 F373 | L366-H370 PolarHBondContact O-N 3.37Å; H370-R372 PolarHBondContact O-N 3Å; H370-F373 HydrophobicContact CB-CB 3.74Å; H370-F373 VanDerWaalsContact O-CB 3.31Å; H370-F373 WeakPolarHBondContact O-CB 3.5Å; H370-F373 PolarHBondContact O-N 3.27Å; H370-F373 VanDerWaalsContact O-N 3.13Å | ||
| 371 | Q | 46.2 | Very low | 45.9 | Very low | 171 Ų | 171 | 73.5 Ų | 73.5 | 80% | 0.799 | 39% | 0.394 | S | S | * | . | H | α-helix | trans | -57.2 | -31.6 | -179 | -79.7 | 178.9 | -22.6 | 0 | 0 | 114.3 | P367 | P367-Q371 WeakPolarHBondContact O-CG 3.45Å |
| 372 | R | 47.2 | Very low | 45.4 | Very low | 218 Ų | 218 | 80.6 Ų | 80.6 | 82% | 0.823 | 41% | 0.411 | S | S | * | . | H | α-helix | trans | -83.4 | -12.2 | -179.4 | -64.9 | -175.2 | -179.9 | 177.8 | 0.1 | 114.5 | H370 S375 S376 | H370-R372 PolarHBondContact O-N 3Å; R372-S375 WeakPolarHBondContact CA-OG 3.23Å; R372-S375 PolarHBondContact O-N 3.27Å; R372-S375 PolarHBondContact O-OG 3.01Å; R372-S376 PolarHBondContact O-N 3.36Å |
| 373 | F | 46.3 | Very low | 44.9 | Very low | 11 Ų | 11 | 85.4 Ų | 85.4 | 5% | 0.048 | 44% | 0.435 | C | S | . | . | H | α-helix | trans | -67 | -40.7 | -174.4 | 176.5 | -102.2 | 0 | 0 | 0 | 112.1 | L335 E347 V350 W362 H370 S376 L377 | L335-F373 HydrophobicContact CD2-CE1 4.4Å; L335-F373 HydrophobicContact CD2-CZ 4.27Å; E347-F373 HydrophobicContact CG-CD2 4.49Å; V350-F373 HydrophobicContact CB-CZ 4.2Å; V350-F373 HydrophobicContact CG1-CZ 4.03Å; V350-F373 HydrophobicContact CG2-CE2 4.18Å; V350-F373 HydrophobicContact CG2-CZ 3.79Å; W362-F373 HydrophobicContact CH2-CE1 4.1Å; W362-F373 HydrophobicContact CH2-CZ 4.42Å; W362-F373 AromaticContact CZ3-CE1 3.87Å; W362-F373 HydrophobicContact CZ3-CE1 3.87Å; W362-F373 HydrophobicContact CZ3-CZ 4.31Å; H370-F373 HydrophobicContact CB-CB 3.74Å; H370-F373 VanDerWaalsContact O-CB 3.31Å; H370-F373 WeakPolarHBondContact O-CB 3.5Å; H370-F373 PolarHBondContact O-N 3.27Å; H370-F373 VanDerWaalsContact O-N 3.13Å; F373-S376 PolarHBondContact O-N 3.43Å; F373-L377 HydrophobicContact CE1-CD1 3.71Å; F373-L377 HydrophobicContact CE2-CD1 4.37Å; F373-L377 HydrophobicContact CZ-CD1 3.62Å; F373-L377 VanDerWaalsContact O-CB 3.29Å; F373-L377 WeakPolarHBondContact O-CB 3.06Å; F373-L377 PolarHBondContact O-N 3.25Å |
| 374 | Y | 46.2 | Very low | 44.8 | Very low | 47 Ų | 47 | 86.6 Ų | 86.6 | 18% | 0.184 | 44% | 0.443 | C | S | . | . | H | α-helix | trans | -67.7 | -39.6 | 177.4 | -78.6 | -70.8 | 0 | 0 | 0 | 112.5 | L366 S376 L377 F378 | L366-Y374 HydrophobicContact CB-CE2 4.07Å; Y374-S376 VanDerWaalsContact C-N 3.28Å; Y374-S376 PolarHBondContact O-N 2.81Å; Y374-L377 PolarHBondContact O-N 3.17Å; Y374-F378 HydrophobicContact CD1-CD2 4.35Å; Y374-F378 AromaticContact CD1-CE2 3.58Å; Y374-F378 HydrophobicContact CD1-CE2 3.58Å; Y374-F378 HydrophobicContact CD1-CZ 4.32Å; Y374-F378 HydrophobicContact CE1-CE2 4.47Å; Y374-F378 HydrophobicContact CG-CE2 4.26Å; Y374-F378 WeakPolarHBondContact O-CD2 3.31Å; Y374-F378 PolarHBondContact O-N 3.02Å |
| 375 | S | 42.6 | Very low | 45.2 | Very low | 81 Ų | 81 | 89.8 Ų | 89.8 | 57% | 0.566 | 44% | 0.439 | S | S | * | . | H | α-helix | trans | -58.5 | -39.1 | 177 | 39.5 | 0 | 0 | 0 | 0 | 112.8 | R372 A379 | R372-S375 WeakPolarHBondContact CA-OG 3.23Å; R372-S375 PolarHBondContact O-N 3.27Å; R372-S375 PolarHBondContact O-OG 3.01Å; S375-A379 PolarHBondContact O-N 3.32Å |
| 376 | S | 43.3 | Very low | 45.7 | Very low | 31 Ų | 31 | 88.9 Ų | 88.9 | 22% | 0.217 | 43% | 0.429 | C | S | . | . | H | α-helix | trans | -74.2 | -43.8 | 176.3 | -168.8 | 0 | 0 | 0 | 0 | 112 | E347 R372 F373 Y374 F378 A379 L380 | E347-S376 WeakPolarHBondContact OE1-CB 3.12Å; E347-S376 PolarHBondContact OE1-OG 3.07Å; E347-S376 VanDerWaalsContact OE1-OG 3.1Å; E347-S376 PolarHBondContact OE2-OG 3.44Å; R372-S376 PolarHBondContact O-N 3.36Å; F373-S376 PolarHBondContact O-N 3.43Å; Y374-S376 VanDerWaalsContact C-N 3.28Å; Y374-S376 PolarHBondContact O-N 2.81Å; S376-F378 VanDerWaalsContact C-N 3.31Å; S376-F378 PolarHBondContact O-N 3.48Å; S376-A379 WeakPolarHBondContact O-CB 3.29Å; S376-A379 PolarHBondContact O-N 3.28Å; S376-A379 VanDerWaalsContact O-N 3.1Å; S376-L380 WeakPolarHBondContact O-CB 3.3Å; S376-L380 WeakPolarHBondContact O-CD1 3.37Å; S376-L380 WeakPolarHBondContact O-CG 3.37Å; S376-L380 PolarHBondContact O-N 3.37Å; S376-L380 WeakPolarHBondContact OG-CD1 3.07Å |
| 377 | L | 43.3 | Very low | 45.8 | Very low | 11 Ų | 11 | 94.9 Ų | 94.9 | 6% | 0.058 | 46% | 0.46 | C | S | . | . | H | α-helix | trans | -62.7 | -34.9 | -177.5 | -166 | 136.4 | 0 | 0 | 0 | 113.1 | V350 L354 W362 F373 Y374 V381 | V350-L377 HydrophobicContact CB-CD1 4.49Å; V350-L377 HydrophobicContact CG1-CD1 3.44Å; V350-L377 VanDerWaalsContact CG1-CD1 3.44Å; L354-L377 HydrophobicContact CD1-CD1 4.34Å; L354-L377 HydrophobicContact CD1-CD2 4.4Å; W362-L377 HydrophobicContact CH2-CD1 3.77Å; W362-L377 HydrophobicContact CZ2-CD1 4.27Å; W362-L377 HydrophobicContact CZ2-CD2 4.31Å; F373-L377 HydrophobicContact CE1-CD1 3.71Å; F373-L377 HydrophobicContact CE2-CD1 4.37Å; F373-L377 HydrophobicContact CZ-CD1 3.62Å; F373-L377 VanDerWaalsContact O-CB 3.29Å; F373-L377 WeakPolarHBondContact O-CB 3.06Å; F373-L377 PolarHBondContact O-N 3.25Å; Y374-L377 PolarHBondContact O-N 3.17Å; L377-V381 VanDerWaalsContact O-CG2 3.23Å; L377-V381 WeakPolarHBondContact O-CG2 3.48Å; L377-V381 PolarHBondContact O-N 2.7Å |
| 378 | F | 47 | Very low | 46.3 | Very low | 58 Ų | 58 | 98.8 Ų | 98.8 | 25% | 0.254 | 47% | 0.474 | S | S | . | . | H | α-helix | trans | -76.8 | -29.4 | 175.3 | -73.9 | -68.9 | 0 | 0 | 0 | 113.3 | Y374 S376 F424 L428 | Y374-F378 HydrophobicContact CD1-CD2 4.35Å; Y374-F378 AromaticContact CD1-CE2 3.58Å; Y374-F378 HydrophobicContact CD1-CE2 3.58Å; Y374-F378 HydrophobicContact CD1-CZ 4.32Å; Y374-F378 HydrophobicContact CE1-CE2 4.47Å; Y374-F378 HydrophobicContact CG-CE2 4.26Å; Y374-F378 WeakPolarHBondContact O-CD2 3.31Å; Y374-F378 PolarHBondContact O-N 3.02Å; S376-F378 VanDerWaalsContact C-N 3.31Å; S376-F378 PolarHBondContact O-N 3.48Å; F378-F424 HydrophobicContact CD1-CE1 4.3Å; F378-F424 AromaticContact CD1-CZ 3.91Å; F378-F424 HydrophobicContact CD1-CZ 3.91Å; F378-F424 AromaticContact CD2-CE1 3.62Å; F378-F424 HydrophobicContact CD2-CE1 3.62Å; F378-F424 HydrophobicContact CD2-CZ 4.02Å; F378-F424 HydrophobicContact CE1-CE1 4.21Å; F378-F424 AromaticContact CE1-CZ 4Å; F378-F424 HydrophobicContact CE1-CZ 4Å; F378-F424 AromaticContact CE2-CE1 3.55Å; F378-F424 HydrophobicContact CE2-CE1 3.55Å; F378-F424 HydrophobicContact CE2-CZ 4.14Å; F378-F424 HydrophobicContact CG-CE1 4.04Å; F378-F424 AromaticContact CG-CZ 3.95Å; F378-F424 HydrophobicContact CG-CZ 3.95Å; F378-F424 AromaticContact CZ-CE1 3.87Å; F378-F424 HydrophobicContact CZ-CE1 3.87Å; F378-F424 HydrophobicContact CZ-CZ 4.14Å; F378-L428 HydrophobicContact CE2-CD1 4.27Å; F378-L428 HydrophobicContact CZ-CD1 4.14Å; F378-L428 HydrophobicContact CZ-CD2 3.87Å |
| 379 | A | 46.4 | Very low | 47 | Very low | 72 Ų | 72 | 91.6 Ų | 91.6 | 60% | 0.595 | 44% | 0.444 | S | S | * | . | H | α-helix | trans | -70.3 | -34.4 | 171.8 | 0 | 0 | 0 | 0 | 0 | 112.2 | S375 S376 | S375-A379 PolarHBondContact O-N 3.32Å; S376-A379 WeakPolarHBondContact O-CB 3.29Å; S376-A379 PolarHBondContact O-N 3.28Å; S376-A379 VanDerWaalsContact O-N 3.1Å |
| 380 | L | 40.4 | Very low | 47.6 | Very low | 60 Ų | 60 | 89.6 Ų | 89.6 | 31% | 0.314 | 44% | 0.439 | S | S | . | . | H | α-helix | trans | -74.2 | -26.3 | -176.4 | -85.8 | 156.9 | 0 | 0 | 0 | 114.6 | E347 R351 S376 | E347-L380 HydrophobicContact CB-CD1 4.25Å; R351-L380 PolarHBondContact NH1-O 3.13Å; S376-L380 WeakPolarHBondContact O-CB 3.3Å; S376-L380 WeakPolarHBondContact O-CD1 3.37Å; S376-L380 WeakPolarHBondContact O-CG 3.37Å; S376-L380 PolarHBondContact O-N 3.37Å; S376-L380 WeakPolarHBondContact OG-CD1 3.07Å |
| 381 | V | 45.3 | Very low | 48.1 | Very low | 46 Ų | 46 | 89.8 Ų | 89.8 | 28% | 0.279 | 45% | 0.445 | S | S | . | . | trans | -84.2 | -21.5 | -168.3 | 169.9 | 0 | 0 | 0 | 0 | 113.9 | L377 Q383 | L377-V381 VanDerWaalsContact O-CG2 3.23Å; L377-V381 WeakPolarHBondContact O-CG2 3.48Å; L377-V381 PolarHBondContact O-N 2.7Å; V381-Q383 HydrophobicContact CG1-CB 4.17Å; V381-Q383 VanDerWaalsContact O-CB 3.3Å; V381-Q383 WeakPolarHBondContact O-CB 3.26Å; V381-Q383 WeakPolarHBondContact O-CG 3.43Å; V381-Q383 PolarHBondContact O-N 3.42Å | ||
| 382 | R | 40.6 | Very low | 49.3 | Very low | 240 Ų | 240 | 82.1 Ų | 82.1 | 91% | 0.906 | 41% | 0.409 | S | S | * | . | trans | 34.4 | 27 | 177 | -76.3 | -163 | 179.1 | -168.7 | 1.5 | 116.9 | ||||
| 383 | Q | 42.7 | Very low | 50.1 | Low | 154 Ų | 154 | 74.5 Ų | 74.5 | 72% | 0.72 | 39% | 0.389 | S | S | * | . | S | Bend | trans | -137.4 | 111.9 | -175.1 | -77.5 | -103.6 | -11.3 | 0 | 0 | 107.3 | V381 | V381-Q383 HydrophobicContact CG1-CB 4.17Å; V381-Q383 VanDerWaalsContact O-CB 3.3Å; V381-Q383 WeakPolarHBondContact O-CB 3.26Å; V381-Q383 WeakPolarHBondContact O-CG 3.43Å; V381-Q383 PolarHBondContact O-N 3.42Å |
| 384 | P | 43.6 | Very low | 50.9 | Low | 71 Ų | 71 | 76.3 Ų | 76.3 | 46% | 0.461 | 41% | 0.406 | S | S | . | . | trans | -73.5 | 131.3 | -179.5 | 25.8 | -30.2 | 0 | 0 | 0 | 112 | S386 L390 | P384-S386 VanDerWaalsContact C-N 3.34Å; P384-S386 PolarHBondContact O-N 3.13Å; P384-L390 HydrophobicContact CB-CD1 3.58Å; P384-L390 HydrophobicContact CB-CD2 3.38Å; P384-L390 HydrophobicContact CB-CG 3.36Å; P384-L390 HydrophobicContact CG-CD1 3.44Å; P384-L390 VanDerWaalsContact CG-CD1 3.44Å; P384-L390 HydrophobicContact CG-CD2 3.79Å; P384-L390 HydrophobicContact CG-CG 3.82Å | ||
| 385 | R | 51 | Low | 51.9 | Low | 116 Ų | 116 | 77.7 Ų | 77.7 | 44% | 0.438 | 42% | 0.416 | S | S | . | . | S | Bend | trans | -70.1 | -20.5 | -174.9 | -62.9 | -175.7 | -175.4 | -159.9 | -3.3 | 114.7 | R360 | R360-R385 VanDerWaalsContact CZ-CZ 3.41Š|
| 386 | S | 54.9 | Low | 53.3 | Low | 51 Ų | 51 | 77.2 Ų | 77.2 | 36% | 0.357 | 40% | 0.402 | S | S | . | . | trans | -168.4 | 156.4 | 173.3 | 71.6 | 0 | 0 | 0 | 0 | 111.7 | P384 Q388 H389 L390 | P384-S386 VanDerWaalsContact C-N 3.34Å; P384-S386 PolarHBondContact O-N 3.13Å; S386-Q388 PolarHBondContact O-N 3.42Å; S386-H389 PolarHBondContact O-N 3.22Å; S386-H389 VanDerWaalsContact O-N 3.07Å; S386-H389 PolarHBondContact OG-N 3.31Å; S386-L390 PolarHBondContact O-N 3.19Å | ||
| 387 | L | 49.4 | Very low | 54.5 | Low | 136 Ų | 136 | 79.1 Ų | 79.1 | 71% | 0.712 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -58.7 | -34.3 | 175.3 | -165.8 | 147.8 | 0 | 0 | 0 | 111.5 | H389 L390 S391 | L387-H389 VanDerWaalsContact C-N 3.35Å; L387-H389 PolarHBondContact O-N 2.88Å; L387-L390 PolarHBondContact O-N 3.23Å; L387-S391 WeakPolarHBondContact O-CB 3.49Å; L387-S391 PolarHBondContact O-N 3.06Å; L387-S391 PolarHBondContact O-OG 3.35Å |
| 388 | Q | 56.9 | Low | 55.9 | Low | 131 Ų | 131 | 86.7 Ų | 86.7 | 61% | 0.612 | 45% | 0.45 | S | S | * | . | H | α-helix | trans | -63.6 | -37 | 175.3 | -69.5 | -179.1 | -9.5 | 0 | 0 | 113.1 | S386 R392 | S386-Q388 PolarHBondContact O-N 3.42Å; Q388-R392 WeakPolarHBondContact O-CB 3.43Å; Q388-R392 PolarHBondContact O-N 3.47Å |
| 389 | H | 60.9 | Low | 56.9 | Low | 39 Ų | 39 | 85.7 Ų | 85.7 | 18% | 0.181 | 45% | 0.447 | C | S | . | . | H | α-helix | trans | -71.2 | -40.3 | 177.2 | -171.9 | 74.4 | 0 | 0 | 0 | 111.6 | S386 L387 R392 C393 | S386-H389 PolarHBondContact O-N 3.22Å; S386-H389 VanDerWaalsContact O-N 3.07Å; S386-H389 PolarHBondContact OG-N 3.31Å; L387-H389 VanDerWaalsContact C-N 3.35Å; L387-H389 PolarHBondContact O-N 2.88Å; H389-R392 WeakPolarHBondContact O-CB 3.41Å; H389-R392 PolarHBondContact O-N 2.99Å; H389-C393 PolarHBondContact O-N 3.4Å; H389-C393 PolarHBondContact O-SG 3.14Å; H389-C393 VanDerWaalsContact O-SG 3.38Å |
| 390 | L | 55.4 | Low | 57.6 | Low | 89 Ų | 89 | 90 Ų | 90 | 47% | 0.466 | 46% | 0.455 | S | S | . | . | H | α-helix | trans | -61.7 | -49.2 | 172.7 | -75.1 | 172.1 | 0 | 0 | 0 | 112.1 | P384 S386 L387 R392 C393 A394 | P384-L390 HydrophobicContact CB-CD1 3.58Å; P384-L390 HydrophobicContact CB-CD2 3.38Å; P384-L390 HydrophobicContact CB-CG 3.36Å; P384-L390 HydrophobicContact CG-CD1 3.44Å; P384-L390 VanDerWaalsContact CG-CD1 3.44Å; P384-L390 HydrophobicContact CG-CD2 3.79Å; P384-L390 HydrophobicContact CG-CG 3.82Å; S386-L390 PolarHBondContact O-N 3.19Å; L387-L390 PolarHBondContact O-N 3.23Å; L390-R392 PolarHBondContact O-N 3.31Å; L390-C393 PolarHBondContact O-N 2.92Å; L390-C393 VanDerWaalsContact O-N 3.14Å; L390-A394 WeakPolarHBondContact O-CB 3.33Å; L390-A394 PolarHBondContact O-N 2.9Å |
| 391 | S | 60.1 | Low | 58.9 | Low | 52 Ų | 52 | 91 Ų | 91 | 36% | 0.364 | 48% | 0.48 | S | S | . | . | H | α-helix | trans | -59.5 | -38.3 | 179 | -59.7 | 0 | 0 | 0 | 0 | 111.4 | L387 L395 | L387-S391 WeakPolarHBondContact O-CB 3.49Å; L387-S391 PolarHBondContact O-N 3.06Å; L387-S391 PolarHBondContact O-OG 3.35Å; S391-L395 VanDerWaalsContact O-CB 3.31Å; S391-L395 WeakPolarHBondContact O-CB 3.41Å; S391-L395 WeakPolarHBondContact O-CD1 3.19Å; S391-L395 WeakPolarHBondContact O-CG 3.48Å; S391-L395 PolarHBondContact O-N 2.88Å |
| 392 | R | 72.8 | Confident | 60.1 | Low | 10 Ų | 10 | 91.1 Ų | 91.1 | 4% | 0.038 | 48% | 0.483 | C | S | . | . | H | α-helix | trans | -63.6 | -49.6 | 173.3 | 164.4 | -172.1 | 173.7 | 113.8 | 21.6 | 112.3 | Q388 H389 L390 A394 L395 R396 Y419 L420 L422 V427 | Q388-R392 WeakPolarHBondContact O-CB 3.43Å; Q388-R392 PolarHBondContact O-N 3.47Å; H389-R392 WeakPolarHBondContact O-CB 3.41Å; H389-R392 PolarHBondContact O-N 2.99Å; L390-R392 PolarHBondContact O-N 3.31Å; R392-A394 VanDerWaalsContact C-N 3.31Å; R392-A394 PolarHBondContact O-N 3.38Å; R392-L395 PolarHBondContact O-N 3.08Å; R392-R396 WeakPolarHBondContact O-CB 3.31Å; R392-R396 WeakPolarHBondContact O-CG 3.49Å; R392-R396 PolarHBondContact O-N 3.49Å; R392-Y419 HydrophobicContact CB-CE1 4.05Å; R392-Y419 HydrophobicContact CG-CE1 4.33Å; R392-Y419 VanDerWaalsContact NH1-C 3.32Å; R392-Y419 PolarHBondContact NH1-O 3.13Å; R392-L420 HydrophobicContact CB-CD2 4.11Å; R392-L420 HydrophobicContact CG-CD2 4.02Å; R392-L422 PolarHBondContact NH2-O 3.02Å; R392-V427 VanDerWaalsContact CZ-CG2 3.46Å |
| 393 | C | 63 | Low | 61.6 | Low | 58 Ų | 58 | 81 Ų | 81 | 39% | 0.392 | 45% | 0.447 | S | S | . | . | H | α-helix | trans | -62.1 | -40.6 | -179.9 | -73 | 0 | 0 | 0 | 0 | 111.3 | H389 L390 S397 | H389-C393 PolarHBondContact O-N 3.4Å; H389-C393 PolarHBondContact O-SG 3.14Å; H389-C393 VanDerWaalsContact O-SG 3.38Å; L390-C393 PolarHBondContact O-N 2.92Å; L390-C393 VanDerWaalsContact O-N 3.14Å; C393-S397 WeakPolarHBondContact O-CB 3.44Å; C393-S397 PolarHBondContact O-N 3.28Å; C393-S397 PolarHBondContact O-OG 2.94Å |
| 394 | A | 62.4 | Low | 62.9 | Low | 50 Ų | 50 | 78.6 Ų | 78.6 | 41% | 0.413 | 44% | 0.444 | S | S | . | . | H | α-helix | trans | -63.6 | -44.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 112 | L390 R392 S397 H398 | L390-A394 WeakPolarHBondContact O-CB 3.33Å; L390-A394 PolarHBondContact O-N 2.9Å; R392-A394 VanDerWaalsContact C-N 3.31Å; R392-A394 PolarHBondContact O-N 3.38Å; A394-S397 WeakPolarHBondContact CA-OG 3.46Å; A394-S397 PolarHBondContact O-OG 2.76Å; A394-H398 WeakPolarHBondContact O-CB 3.41Å; A394-H398 PolarHBondContact O-N 3.47Å |
| 395 | L | 67.6 | Low | 64.4 | Low | 75 Ų | 75 | 82.4 Ų | 82.4 | 39% | 0.393 | 46% | 0.456 | S | S | . | . | H | α-helix | trans | -67.4 | -39.4 | 178.5 | -75.1 | 169.2 | 0 | 0 | 0 | 112.6 | S391 R392 L399 L420 | S391-L395 VanDerWaalsContact O-CB 3.31Å; S391-L395 WeakPolarHBondContact O-CB 3.41Å; S391-L395 WeakPolarHBondContact O-CD1 3.19Å; S391-L395 WeakPolarHBondContact O-CG 3.48Å; S391-L395 PolarHBondContact O-N 2.88Å; R392-L395 PolarHBondContact O-N 3.08Å; L395-L399 VanDerWaalsContact O-CB 3.29Å; L395-L399 WeakPolarHBondContact O-CB 3.42Å; L395-L399 WeakPolarHBondContact O-CD1 3.45Å; L395-L399 VanDerWaalsContact O-CG 3.22Å; L395-L399 WeakPolarHBondContact O-CG 3.32Å; L395-L399 PolarHBondContact O-N 3.02Å; L395-L420 HydrophobicContact CB-CD2 4.41Å; L395-L420 HydrophobicContact CD1-CD2 4.39Å |
| 396 | R | 72.3 | Confident | 65.4 | Low | 71 Ų | 71 | 77.9 Ų | 77.9 | 27% | 0.268 | 44% | 0.443 | S | S | . | . | H | α-helix | trans | -71.4 | -36.2 | 178.8 | -75.2 | -171.2 | 66.8 | 131 | -8.5 | 112.9 | R392 L399 E400 L403 L420 L422 | R392-R396 WeakPolarHBondContact O-CB 3.31Å; R392-R396 WeakPolarHBondContact O-CG 3.49Å; R392-R396 PolarHBondContact O-N 3.49Å; R396-L399 CarbonylContact O-C 3.55Å; R396-L399 PolarHBondContact O-N 3.3Å; R396-E400 PolarHBondContact O-N 3Å; R396-E400 VanDerWaalsContact O-N 3.13Å; R396-L403 HydrophobicContact CG-CD1 3.95Å; R396-L420 PolarHBondContact NH1-O 2.96Å; R396-L422 PolarHBondContact NH1-O 3.32Å |
| 397 | S | 69.4 | Low | 66.3 | Low | 71 Ų | 71 | 75.9 Ų | 75.9 | 50% | 0.497 | 43% | 0.428 | S | S | . | . | H | α-helix | trans | -69.1 | -38.7 | 173.4 | 49.9 | 0 | 0 | 0 | 0 | 111.7 | C393 A394 L399 E400 | C393-S397 WeakPolarHBondContact O-CB 3.44Å; C393-S397 PolarHBondContact O-N 3.28Å; C393-S397 PolarHBondContact O-OG 2.94Å; A394-S397 WeakPolarHBondContact CA-OG 3.46Å; A394-S397 PolarHBondContact O-OG 2.76Å; S397-L399 VanDerWaalsContact C-N 3.3Å; S397-L399 PolarHBondContact O-N 2.92Å; S397-E400 WeakPolarHBondContact O-CB 3.5Å; S397-E400 PolarHBondContact O-N 3.47Å |
| 398 | H | 71.3 | Confident | 67.5 | Low | 170 Ų | 170 | 74.2 Ų | 74.2 | 79% | 0.787 | 43% | 0.426 | S | S | * | . | H | α-helix | trans | -67.5 | -29.1 | 174.4 | -107.1 | -56.6 | 0 | 0 | 0 | 114.1 | A394 | A394-H398 WeakPolarHBondContact O-CB 3.41Å; A394-H398 PolarHBondContact O-N 3.47Å |
| 399 | L | 69.5 | Low | 68.5 | Low | 37 Ų | 37 | 78.5 Ų | 78.5 | 19% | 0.194 | 44% | 0.437 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -102.5 | 17 | -178.3 | -62.6 | 171.4 | 0 | 0 | 0 | 112.6 | L395 R396 S397 G401 S402 L403 A406 L410 | L395-L399 VanDerWaalsContact O-CB 3.29Å; L395-L399 WeakPolarHBondContact O-CB 3.42Å; L395-L399 WeakPolarHBondContact O-CD1 3.45Å; L395-L399 VanDerWaalsContact O-CG 3.22Å; L395-L399 WeakPolarHBondContact O-CG 3.32Å; L395-L399 PolarHBondContact O-N 3.02Å; R396-L399 CarbonylContact O-C 3.55Å; R396-L399 PolarHBondContact O-N 3.3Å; S397-L399 VanDerWaalsContact C-N 3.3Å; S397-L399 PolarHBondContact O-N 2.92Å; L399-G401 PolarHBondContact O-N 3.37Å; L399-S402 PolarHBondContact O-N 2.85Å; L399-S402 PolarHBondContact O-OG 3.26Å; L399-L403 HydrophobicContact CB-CD1 3.96Å; L399-L403 HydrophobicContact CD1-CD1 4.37Å; L399-L403 PolarHBondContact O-N 2.69Å; L399-A406 HydrophobicContact CD1-CB 4.47Å; L399-A406 HydrophobicContact CD2-CB 4.07Å; L399-L410 HydrophobicContact CD1-CD1 4.22Å |
| 400 | E | 60.8 | Low | 69.3 | Low | 162 Ų | 162 | 79.1 Ų | 79.1 | 76% | 0.757 | 44% | 0.441 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -58.6 | 128.8 | -177.9 | -163.9 | 165.4 | -166.5 | 0 | 0 | 110.2 | R396 S397 S402 | R396-E400 PolarHBondContact O-N 3Å; R396-E400 VanDerWaalsContact O-N 3.13Å; S397-E400 WeakPolarHBondContact O-CB 3.5Å; S397-E400 PolarHBondContact O-N 3.47Å; E400-S402 VanDerWaalsContact C-N 3.31Å; E400-S402 PolarHBondContact O-N 2.88Å |
| 401 | G | 67.6 | Low | 70.4 | Confident | 83 Ų | 83 | 81 Ų | 81 | 86% | 0.856 | 46% | 0.459 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 82.8 | -17.2 | -174.4 | 0 | 0 | 0 | 0 | 0 | 116.6 | L399 | L399-G401 PolarHBondContact O-N 3.37Š|
| 402 | S | 70.9 | Confident | 71.3 | Confident | 47 Ų | 47 | 81.5 Ų | 81.5 | 33% | 0.329 | 46% | 0.457 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -120.3 | -0.8 | -179.5 | 62.6 | 0 | 0 | 0 | 0 | 114.4 | L399 E400 Q405 A406 | L399-S402 PolarHBondContact O-N 2.85Å; L399-S402 PolarHBondContact O-OG 3.26Å; E400-S402 VanDerWaalsContact C-N 3.31Å; E400-S402 PolarHBondContact O-N 2.88Å; S402-Q405 PolarHBondContact O-N 2.99Å; S402-A406 WeakPolarHBondContact O-CB 3.36Å; S402-A406 PolarHBondContact O-N 3.04Å |
| 403 | L | 71.8 | Confident | 71.7 | Confident | 29 Ų | 29 | 84.5 Ų | 84.5 | 15% | 0.152 | 48% | 0.478 | C | S | . | . | H | α-helix | trans | -44.4 | -53.2 | -178.6 | -162.6 | 84.6 | 0 | 0 | 0 | 114.7 | R396 L399 Q405 A406 L407 | R396-L403 HydrophobicContact CG-CD1 3.95Å; L399-L403 HydrophobicContact CB-CD1 3.96Å; L399-L403 HydrophobicContact CD1-CD1 4.37Å; L399-L403 PolarHBondContact O-N 2.69Å; L403-Q405 VanDerWaalsContact C-N 3.26Å; L403-Q405 PolarHBondContact O-N 3.27Å; L403-A406 PolarHBondContact O-N 2.55Å; L403-L407 HydrophobicContact CD2-CD1 4.31Å; L403-L407 HydrophobicContact CG-CD1 3.91Å; L403-L407 HydrophobicContact CG-CG 4.24Å; L403-L407 WeakPolarHBondContact O-CB 3.37Å; L403-L407 WeakPolarHBondContact O-CD1 3.43Å; L403-L407 WeakPolarHBondContact O-CG 3.45Å; L403-L407 PolarHBondContact O-N 3.01Å |
| 404 | P | 69 | Low | 72.3 | Confident | 103 Ų | 103 | 86.8 Ų | 86.8 | 67% | 0.669 | 49% | 0.492 | S | S | * | . | H | α-helix | trans | -66.1 | -25.4 | -178 | 24.5 | -33.1 | 0 | 0 | 0 | 113.8 | ||
| 405 | Q | 74.9 | Confident | 72.7 | Confident | 151 Ų | 151 | 94.9 Ų | 94.9 | 71% | 0.706 | 51% | 0.512 | S | S | * | . | H | α-helix | trans | -86.9 | -30.6 | 178.1 | -63.9 | 178.1 | 1.1 | 0 | 0 | 112.4 | S402 L403 | S402-Q405 PolarHBondContact O-N 2.99Å; L403-Q405 VanDerWaalsContact C-N 3.26Å; L403-Q405 PolarHBondContact O-N 3.27Å |
| 406 | A | 73.4 | Confident | 72.8 | Confident | 21 Ų | 21 | 94.7 Ų | 94.7 | 17% | 0.174 | 51% | 0.511 | C | S | . | . | H | α-helix | trans | -83.8 | -32.6 | -177.6 | 0 | 0 | 0 | 0 | 0 | 113.4 | L399 S402 L403 R409 L410 | L399-A406 HydrophobicContact CD1-CB 4.47Å; L399-A406 HydrophobicContact CD2-CB 4.07Å; S402-A406 WeakPolarHBondContact O-CB 3.36Å; S402-A406 PolarHBondContact O-N 3.04Å; L403-A406 PolarHBondContact O-N 2.55Å; A406-R409 PolarHBondContact O-N 2.99Å; A406-L410 PolarHBondContact O-N 3.06Å |
| 407 | L | 73.2 | Confident | 73 | Confident | 8 Ų | 8 | 93 Ų | 93 | 4% | 0.042 | 51% | 0.506 | C | S | . | . | G | 310 helix | trans | -52.1 | -47.1 | -177.8 | -81 | 165 | 0 | 0 | 0 | 115.5 | L403 R409 L410 L417 L420 Q421 | L403-L407 HydrophobicContact CD2-CD1 4.31Å; L403-L407 HydrophobicContact CG-CD1 3.91Å; L403-L407 HydrophobicContact CG-CG 4.24Å; L403-L407 WeakPolarHBondContact O-CB 3.37Å; L403-L407 WeakPolarHBondContact O-CD1 3.43Å; L403-L407 WeakPolarHBondContact O-CG 3.45Å; L403-L407 PolarHBondContact O-N 3.01Å; L407-R409 PolarHBondContact O-N 2.58Å; L407-L410 PolarHBondContact O-N 2.86Å; L407-L417 HydrophobicContact CD2-CD2 4.19Å; L407-L417 VanDerWaalsContact O-CD2 3.3Å; L407-L417 WeakPolarHBondContact O-CD2 3.14Å; L407-L420 HydrophobicContact CD2-CB 3.85Å; L407-L420 HydrophobicContact CD2-CD1 4.22Å; L407-Q421 HydrophobicContact CD1-CG 3.43Å; L407-Q421 VanDerWaalsContact CD1-CG 3.43Å; L407-Q421 HydrophobicContact CD2-CG 4.41Å |
| 408 | P | 73.8 | Confident | 73.2 | Confident | 102 Ų | 102 | 98.3 Ų | 98.3 | 66% | 0.662 | 52% | 0.516 | S | S | * | . | G | 310 helix | trans | -71.6 | -10.8 | 179.7 | 26.6 | -33.3 | 0 | 0 | 0 | 114 | ||
| 409 | R | 77.9 | Confident | 73.2 | Confident | 221 Ų | 221 | 92.9 Ų | 92.9 | 83% | 0.834 | 49% | 0.489 | S | S | * | . | G | 310 helix | trans | -96.3 | -10 | 179.4 | -63.7 | -177.2 | 174.8 | 174.8 | -0.5 | 113.3 | A406 L407 | A406-R409 PolarHBondContact O-N 2.99Å; L407-R409 PolarHBondContact O-N 2.58Å |
| 410 | L | 77.5 | Confident | 73.2 | Confident | 51 Ų | 51 | 91.5 Ų | 91.5 | 27% | 0.267 | 48% | 0.482 | S | S | . | . | S | Bend | trans | -79.2 | 130.1 | 178.6 | -71.4 | 169.7 | 0 | 0 | 0 | 110.1 | L399 A406 L407 L412 L417 | L399-L410 HydrophobicContact CD1-CD1 4.22Å; A406-L410 PolarHBondContact O-N 3.06Å; L407-L410 PolarHBondContact O-N 2.86Å; L410-L412 HydrophobicContact CB-CD1 4.18Å; L410-L412 HydrophobicContact CB-CG 4.24Å; L410-L412 HydrophobicContact CD1-CD1 4.33Å; L410-L412 PolarHBondContact O-N 3.07Å; L410-L417 HydrophobicContact CB-CD2 4.19Å |
| 411 | P | 79.9 | Confident | 73.8 | Confident | 130 Ų | 130 | 89.1 Ų | 89.1 | 84% | 0.844 | 47% | 0.47 | S | S | * | . | trans | -78.2 | 59.7 | 178.5 | 34.1 | -36.1 | 0 | 0 | 0 | 110.7 | ||||
| 412 | L | 79.1 | Confident | 73.8 | Confident | 62 Ų | 62 | 88 Ų | 88 | 33% | 0.325 | 45% | 0.445 | S | S | . | . | trans | -114.9 | 148 | -178.2 | -67.6 | 175.2 | 0 | 0 | 0 | 111.2 | L410 L416 L417 L420 | L410-L412 HydrophobicContact CB-CD1 4.18Å; L410-L412 HydrophobicContact CB-CG 4.24Å; L410-L412 HydrophobicContact CD1-CD1 4.33Å; L410-L412 PolarHBondContact O-N 3.07Å; L412-L416 HydrophobicContact CB-CB 4.47Å; L412-L417 HydrophobicContact CB-CD2 3.92Å; L412-L417 HydrophobicContact CB-CG 4.07Å; L412-L417 HydrophobicContact CD1-CD2 4.39Å; L412-L420 HydrophobicContact CD1-CD1 3.73Å | ||
| 413 | P | 81.3 | Confident | 73.2 | Confident | 73 Ų | 73 | 91.2 Ų | 91.2 | 47% | 0.474 | 46% | 0.458 | S | S | . | . | trans | -54 | 145.4 | 172.4 | -22.6 | 29.7 | 0 | 0 | 0 | 111.9 | R415 L416 L417 | P413-R415 PolarHBondContact O-N 2.96Å; P413-L416 HydrophobicContact CG-CD1 4.31Å; P413-L416 WeakPolarHBondContact O-CA 3.49Å; P413-L416 PolarHBondContact O-N 2.93Å; P413-L417 PolarHBondContact O-N 3.46Å | ||
| 414 | P | 75.3 | Confident | 72.2 | Confident | 106 Ų | 106 | 94.2 Ų | 94.2 | 69% | 0.688 | 47% | 0.47 | S | S | * | . | H | α-helix | trans | -59.2 | -28.3 | -177 | 20.5 | -31.6 | 0 | 0 | 0 | 113.2 | R418 | P414-R418 WeakPolarHBondContact O-CB 3.22Å; P414-R418 PolarHBondContact O-N 3.47Å |
| 415 | R | 70.6 | Confident | 70.9 | Confident | 219 Ų | 219 | 96.5 Ų | 96.5 | 83% | 0.826 | 47% | 0.472 | S | S | * | . | H | α-helix | trans | -64.6 | -38.9 | 172.8 | -68.8 | -175.3 | 177.9 | 177.4 | -0.8 | 112.7 | P413 Y419 | P413-R415 PolarHBondContact O-N 2.96Å; R415-Y419 WeakPolarHBondContact O-CB 3.29Å; R415-Y419 PolarHBondContact O-N 3.23Å |
| 416 | L | 69.6 | Low | 69.3 | Low | 72 Ų | 72 | 90.6 Ų | 90.6 | 38% | 0.377 | 45% | 0.451 | S | S | . | . | H | α-helix | trans | -78.6 | -31.9 | 178.4 | -69.3 | -176.4 | 0 | 0 | 0 | 112.2 | L412 P413 Y419 L420 | L412-L416 HydrophobicContact CB-CB 4.47Å; P413-L416 HydrophobicContact CG-CD1 4.31Å; P413-L416 WeakPolarHBondContact O-CA 3.49Å; P413-L416 PolarHBondContact O-N 2.93Å; L416-Y419 WeakPolarHBondContact O-CB 3.3Å; L416-Y419 PolarHBondContact O-N 3.46Å; L416-L420 VanDerWaalsContact O-CG 3.32Å; L416-L420 WeakPolarHBondContact O-CG 3.36Å; L416-L420 PolarHBondContact O-N 3.04Å |
| 417 | L | 75.6 | Confident | 68.1 | Low | 34 Ų | 34 | 91.3 Ų | 91.3 | 18% | 0.178 | 45% | 0.454 | C | S | . | . | H | α-helix | trans | -64.4 | -46.2 | 170.9 | -67.1 | 175.8 | 0 | 0 | 0 | 111.3 | L407 L410 L412 P413 Y419 L420 Q421 | L407-L417 HydrophobicContact CD2-CD2 4.19Å; L407-L417 VanDerWaalsContact O-CD2 3.3Å; L407-L417 WeakPolarHBondContact O-CD2 3.14Å; L410-L417 HydrophobicContact CB-CD2 4.19Å; L412-L417 HydrophobicContact CB-CD2 3.92Å; L412-L417 HydrophobicContact CB-CG 4.07Å; L412-L417 HydrophobicContact CD1-CD2 4.39Å; P413-L417 PolarHBondContact O-N 3.46Å; L417-Y419 VanDerWaalsContact C-N 3.3Å; L417-Y419 PolarHBondContact O-N 3.46Å; L417-L420 PolarHBondContact O-N 3.33Å; L417-Q421 WeakPolarHBondContact O-CG 3.44Å; L417-Q421 PolarHBondContact O-N 3.29Å |
| 418 | R | 74.3 | Confident | 66.6 | Low | 184 Ų | 184 | 94.7 Ų | 94.7 | 69% | 0.694 | 47% | 0.471 | S | S | * | . | H | α-helix | trans | -62.5 | -40.2 | 174 | -167.4 | 175.6 | -174.8 | 179.9 | 0.9 | 111.1 | P414 Q421 L422 | P414-R418 WeakPolarHBondContact O-CB 3.22Å; P414-R418 PolarHBondContact O-N 3.47Å; R418-Q421 PolarHBondContact O-N 2.95Å; R418-L422 WeakPolarHBondContact O-CG 3.36Å; R418-L422 PolarHBondContact O-N 3.42Å |
| 419 | Y | 70.6 | Confident | 64.9 | Low | 55 Ų | 55 | 100.1 Ų | 100.1 | 22% | 0.216 | 48% | 0.48 | C | S | . | . | H | α-helix | trans | -55.6 | -59.5 | 171.8 | -174.5 | -116.2 | 0 | 0 | 0 | 109.6 | R392 R415 L416 L417 Q421 L422 V427 | R392-Y419 HydrophobicContact CB-CE1 4.05Å; R392-Y419 HydrophobicContact CG-CE1 4.33Å; R392-Y419 VanDerWaalsContact NH1-C 3.32Å; R392-Y419 PolarHBondContact NH1-O 3.13Å; R415-Y419 WeakPolarHBondContact O-CB 3.29Å; R415-Y419 PolarHBondContact O-N 3.23Å; L416-Y419 WeakPolarHBondContact O-CB 3.3Å; L416-Y419 PolarHBondContact O-N 3.46Å; L417-Y419 VanDerWaalsContact C-N 3.3Å; L417-Y419 PolarHBondContact O-N 3.46Å; Y419-Q421 PolarHBondContact O-N 3.01Å; Y419-L422 HydrophobicContact CD2-CD1 4.17Å; Y419-L422 WeakPolarHBondContact O-CB 3.48Å; Y419-L422 PolarHBondContact O-N 2.81Å; Y419-V427 HydrophobicContact CE2-CG1 3.94Å; Y419-V427 HydrophobicContact CE2-CG2 4.43Å |
| 420 | L | 70.8 | Confident | 64.2 | Low | 9 Ų | 9 | 94.1 Ų | 94.1 | 5% | 0.047 | 46% | 0.463 | C | S | . | . | H | α-helix | trans | -54.7 | -25.1 | 179.5 | -71.2 | 170.8 | 0 | 0 | 0 | 114.6 | R392 L395 R396 L407 L412 L416 L417 | R392-L420 HydrophobicContact CB-CD2 4.11Å; R392-L420 HydrophobicContact CG-CD2 4.02Å; L395-L420 HydrophobicContact CB-CD2 4.41Å; L395-L420 HydrophobicContact CD1-CD2 4.39Å; R396-L420 PolarHBondContact NH1-O 2.96Å; L407-L420 HydrophobicContact CD2-CB 3.85Å; L407-L420 HydrophobicContact CD2-CD1 4.22Å; L412-L420 HydrophobicContact CD1-CD1 3.73Å; L416-L420 VanDerWaalsContact O-CG 3.32Å; L416-L420 WeakPolarHBondContact O-CG 3.36Å; L416-L420 PolarHBondContact O-N 3.04Å; L417-L420 PolarHBondContact O-N 3.33Å |
| 421 | Q | 71.9 | Confident | 63.5 | Low | 111 Ų | 111 | 96.4 Ų | 96.4 | 52% | 0.519 | 47% | 0.473 | S | S | . | . | H | α-helix | trans | -80.4 | -28.4 | 177.2 | -77.2 | 172.7 | -11.7 | 0 | 0 | 114.9 | L407 L417 R418 Y419 D423 | L407-Q421 HydrophobicContact CD1-CG 3.43Å; L407-Q421 VanDerWaalsContact CD1-CG 3.43Å; L407-Q421 HydrophobicContact CD2-CG 4.41Å; L417-Q421 WeakPolarHBondContact O-CG 3.44Å; L417-Q421 PolarHBondContact O-N 3.29Å; R418-Q421 PolarHBondContact O-N 2.95Å; Y419-Q421 PolarHBondContact O-N 3.01Å; Q421-D423 PolarHBondContact O-N 3.39Å |
| 422 | L | 69.1 | Low | 62.6 | Low | 61 Ų | 61 | 94.5 Ų | 94.5 | 32% | 0.319 | 45% | 0.452 | S | S | . | . | S | Bend | trans | -53.3 | 141.7 | -179 | -68.6 | 165.1 | 0 | 0 | 0 | 110.2 | R392 R396 R418 Y419 V427 | R392-L422 PolarHBondContact NH2-O 3.02Å; R396-L422 PolarHBondContact NH1-O 3.32Å; R418-L422 WeakPolarHBondContact O-CG 3.36Å; R418-L422 PolarHBondContact O-N 3.42Å; Y419-L422 HydrophobicContact CD2-CD1 4.17Å; Y419-L422 WeakPolarHBondContact O-CB 3.48Å; Y419-L422 PolarHBondContact O-N 2.81Å; L422-V427 HydrophobicContact CB-CG2 3.92Å; L422-V427 HydrophobicContact CD1-CG2 4.3Å |
| 423 | D | 58.8 | Low | 61.7 | Low | 113 Ų | 113 | 96.4 Ų | 96.4 | 60% | 0.604 | 46% | 0.46 | S | S | * | . | trans | -73 | 164.1 | 166 | -68.6 | -39.5 | 0 | 0 | 0 | 109.9 | Q421 E425 G426 V427 | Q421-D423 PolarHBondContact O-N 3.39Å; D423-E425 PolarHBondContact O-N 3.41Å; D423-E425 VanDerWaalsContact O-N 3.08Å; D423-G426 PolarHBondContact O-N 3.24Å; D423-V427 PolarHBondContact O-N 3.04Å | ||
| 424 | F | 48.8 | Very low | 60.4 | Low | 93 Ų | 93 | 97.9 Ų | 97.9 | 41% | 0.408 | 46% | 0.459 | S | S | . | . | G | 310 helix | trans | -54.8 | -33.6 | -174.1 | -169.3 | -94.8 | 0 | 0 | 0 | 112.2 | F378 V427 | F378-F424 HydrophobicContact CD1-CE1 4.3Å; F378-F424 AromaticContact CD1-CZ 3.91Å; F378-F424 HydrophobicContact CD1-CZ 3.91Å; F378-F424 AromaticContact CD2-CE1 3.62Å; F378-F424 HydrophobicContact CD2-CE1 3.62Å; F378-F424 HydrophobicContact CD2-CZ 4.02Å; F378-F424 HydrophobicContact CE1-CE1 4.21Å; F378-F424 AromaticContact CE1-CZ 4Å; F378-F424 HydrophobicContact CE1-CZ 4Å; F378-F424 AromaticContact CE2-CE1 3.55Å; F378-F424 HydrophobicContact CE2-CE1 3.55Å; F378-F424 HydrophobicContact CE2-CZ 4.14Å; F378-F424 HydrophobicContact CG-CE1 4.04Å; F378-F424 AromaticContact CG-CZ 3.95Å; F378-F424 HydrophobicContact CG-CZ 3.95Å; F378-F424 AromaticContact CZ-CE1 3.87Å; F378-F424 HydrophobicContact CZ-CE1 3.87Å; F378-F424 HydrophobicContact CZ-CZ 4.14Å; F424-V427 PolarHBondContact O-N 3.03Å |
| 425 | E | 42.2 | Very low | 59.5 | Low | 150 Ų | 150 | 97.3 Ų | 97.3 | 70% | 0.701 | 44% | 0.444 | S | S | * | . | G | 310 helix | trans | -68.7 | -34.7 | 174.9 | -61.8 | -175 | 168.5 | 0 | 0 | 113.6 | D423 V427 L428 | D423-E425 PolarHBondContact O-N 3.41Å; D423-E425 VanDerWaalsContact O-N 3.08Å; E425-V427 PolarHBondContact O-N 3.3Å; E425-L428 PolarHBondContact O-N 3.26Å |
| 426 | G | 41.3 | Very low | 58.7 | Low | 27 Ų | 27 | 88.6 Ų | 88.6 | 28% | 0.278 | 42% | 0.416 | S | S | . | . | G | 310 helix | trans | -75.5 | -5.5 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114.4 | D423 | D423-G426 PolarHBondContact O-N 3.24Š|
| 427 | V | 49 | Very low | 57.8 | Low | 37 Ų | 37 | 89.9 Ų | 89.9 | 22% | 0.224 | 42% | 0.419 | C | S | . | . | G | 310 helix | trans | -90.9 | -13.7 | 173.8 | -178.1 | 0 | 0 | 0 | 0 | 111.5 | R392 Y419 L422 D423 F424 E425 | R392-V427 VanDerWaalsContact CZ-CG2 3.46Å; Y419-V427 HydrophobicContact CE2-CG1 3.94Å; Y419-V427 HydrophobicContact CE2-CG2 4.43Å; L422-V427 HydrophobicContact CB-CG2 3.92Å; L422-V427 HydrophobicContact CD1-CG2 4.3Å; D423-V427 PolarHBondContact O-N 3.04Å; F424-V427 PolarHBondContact O-N 3.03Å; E425-V427 PolarHBondContact O-N 3.3Å |
| 428 | L | 41.8 | Very low | 56.3 | Low | 79 Ų | 79 | 94.6 Ų | 94.6 | 41% | 0.414 | 44% | 0.439 | S | S | . | . | trans | -91.6 | -16.2 | -178 | -62.3 | 172.8 | 0 | 0 | 0 | 113.2 | F378 E425 | F378-L428 HydrophobicContact CE2-CD1 4.27Å; F378-L428 HydrophobicContact CZ-CD1 4.14Å; F378-L428 HydrophobicContact CZ-CD2 3.87Å; E425-L428 PolarHBondContact O-N 3.26Å | ||
| 429 | Y | 37.8 | Very low | 54.7 | Low | 216 Ų | 216 | 86.5 Ų | 86.5 | 85% | 0.847 | 42% | 0.416 | S | S | * | . | trans | -109.3 | 0 | 173 | -68.4 | -84.7 | 0 | 0 | 0 | 109.6 |
Retrieved 429 of 429 residues in 102.6 ms
(Link to these results)