| 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 | N | 34.3 | Very low | 30.8 | Very low | 214 Ų | 214 | 151.6 Ų | 151.6 | 100% | 1.144 | 80% | 0.796 | S | S | * | * | 0 | 112.2 | 0 | -65.1 | -3.6 | 0 | 0 | 0 | 108.7 | |||||
| 2 | M | 33.8 | Very low | 30.4 | Very low | 178 Ų | 178 | 151.6 Ų | 151.6 | 88% | 0.877 | 78% | 0.784 | S | S | * | * | cis | -170.1 | 127.9 | 2.3 | -168.7 | 162 | 164.7 | 0 | 0 | 106.9 | ||||
| 3 | A | 33.2 | Very low | 30.8 | Very low | 79 Ų | 79 | 147.5 Ų | 147.5 | 65% | 0.653 | 79% | 0.787 | S | S | * | * | trans | 64.3 | 140.9 | 151.1 | 0 | 0 | 0 | 0 | 0 | 118.6 | ||||
| 4 | E | 33.6 | Very low | 30.6 | Very low | 148 Ų | 148 | 145.4 Ų | 145.4 | 69% | 0.692 | 79% | 0.789 | S | S | * | * | cis | 177.7 | 155.3 | 4.7 | -115 | 178.8 | 128.6 | 0 | 0 | 103 | ||||
| 5 | K | 30.3 | Very low | 30.3 | Very low | 173 Ų | 173 | 145.7 Ų | 145.7 | 75% | 0.752 | 79% | 0.79 | S | S | * | * | cis | -166.1 | 147.6 | 10.8 | -141.3 | 163.3 | -171.9 | 159.9 | 0 | 107 | ||||
| 6 | V | 31.7 | Very low | 30.8 | Very low | 116 Ų | 116 | 141.4 Ų | 141.4 | 70% | 0.703 | 79% | 0.791 | S | S | * | * | trans | -76.9 | 142.9 | 168.9 | 179.3 | 0 | 0 | 0 | 0 | 108.1 | ||||
| 7 | D | 27.7 | Very low | 30.8 | Very low | 148 Ų | 148 | 144.2 Ų | 144.2 | 79% | 0.791 | 80% | 0.796 | S | S | * | * | 172.7 | 154.5 | 112.1 | -102.6 | -47.5 | 0 | 0 | 0 | 115.6 | |||||
| 8 | L | 28.4 | Very low | 30.7 | Very low | 140 Ų | 140 | 141.6 Ų | 141.6 | 73% | 0.733 | 80% | 0.797 | S | S | * | * | trans | -75.2 | 162.1 | -171.3 | -79.9 | 130.2 | 0 | 0 | 0 | 115.7 | ||||
| 9 | E | 28.5 | Very low | 30.8 | Very low | 175 Ų | 175 | 143.2 Ų | 143.2 | 82% | 0.818 | 80% | 0.796 | S | S | * | * | trans | 67.7 | 117.4 | 150.1 | -76.3 | -179.3 | 177.8 | 0 | 0 | 120.6 | ||||
| 10 | E | 25.7 | Very low | 30.7 | Very low | 152 Ų | 152 | 147.4 Ų | 147.4 | 71% | 0.71 | 80% | 0.799 | S | S | * | * | -153.1 | 107.4 | 124.5 | -114.9 | -168.4 | 168.3 | 0 | 0 | 110.3 | K12 | E10-K12 VanDerWaalsContact CD-NZ 3.31Å; E10-K12 PolarHBondContact O-N 3.12Å; E10-K12 IonicContact OE1-NZ 2.78Å; E10-K12 PolarHBondContact OE1-NZ 3.13Å; E10-K12 IonicContact OE2-NZ 3.13Å; E10-K12 PolarHBondContact OE2-NZ 2.78Å; E10-K12 VanDerWaalsContact OE2-NZ 3.13Å | |||
| 11 | V | 31.7 | Very low | 30.6 | Very low | 145 Ų | 145 | 147.8 Ų | 147.8 | 88% | 0.879 | 80% | 0.801 | S | S | * | * | trans | -67.6 | 112.7 | 154.9 | 169.8 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 12 | K | 26.4 | Very low | 30.4 | Very low | 151 Ų | 151 | 145.5 Ų | 145.5 | 66% | 0.657 | 78% | 0.784 | S | S | * | * | trans | -134.8 | 118.6 | 163.5 | -107.5 | 171.8 | -172.9 | 142.4 | 0 | 110 | E10 S14 | E10-K12 VanDerWaalsContact CD-NZ 3.31Å; E10-K12 PolarHBondContact O-N 3.12Å; E10-K12 IonicContact OE1-NZ 2.78Å; E10-K12 PolarHBondContact OE1-NZ 3.13Å; E10-K12 IonicContact OE2-NZ 3.13Å; E10-K12 PolarHBondContact OE2-NZ 2.78Å; E10-K12 VanDerWaalsContact OE2-NZ 3.13Å; K12-S14 PolarHBondContact O-N 3.28Å | ||
| 13 | A | 35.4 | Very low | 30 | Very low | 99 Ų | 99 | 148.4 Ų | 148.4 | 82% | 0.818 | 79% | 0.785 | S | S | * | * | trans | -48.2 | 123.6 | 162.1 | 0 | 0 | 0 | 0 | 0 | 109.5 | ||||
| 14 | S | 27.9 | Very low | 30 | Very low | 118 Ų | 118 | 151.8 Ų | 151.8 | 83% | 0.825 | 79% | 0.791 | S | S | * | * | trans | -123.2 | 111.1 | 166.8 | -171.7 | 0 | 0 | 0 | 0 | 108.5 | K12 | K12-S14 PolarHBondContact O-N 3.28Š| ||
| 15 | N | 25.4 | Very low | 30 | Very low | 149 Ų | 149 | 149.5 Ų | 149.5 | 80% | 0.797 | 80% | 0.797 | S | S | * | * | trans | -49 | 155.7 | 170.7 | -70.8 | -34.6 | 0 | 0 | 0 | 112.2 | E17 | N15-E17 PolarHBondContact O-N 3.15Š| ||
| 16 | G | 38.3 | Very low | 30 | Very low | 78 Ų | 78 | 147.7 Ų | 147.7 | 80% | 0.804 | 80% | 0.796 | S | S | * | * | trans | -52.3 | 131.2 | -177.7 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||||
| 17 | E | 31.9 | Very low | 30.1 | Very low | 189 Ų | 189 | 145.7 Ų | 145.7 | 88% | 0.883 | 80% | 0.798 | S | S | * | * | trans | -171.9 | 76.4 | 150.5 | -106.3 | 178.7 | 179.1 | 0 | 0 | 107.1 | N15 | N15-E17 PolarHBondContact O-N 3.15Š| ||
| 18 | A | 28.3 | Very low | 30.7 | Very low | 97 Ų | 97 | 147.5 Ų | 147.5 | 80% | 0.802 | 80% | 0.799 | S | S | * | * | trans | -132.7 | 61.3 | 169.5 | 0 | 0 | 0 | 0 | 0 | 109 | ||||
| 19 | H | 32.3 | Very low | 30.9 | Very low | 171 Ų | 171 | 145.6 Ų | 145.6 | 79% | 0.792 | 80% | 0.804 | S | S | * | * | trans | -158.2 | 65.2 | 166.2 | -114.7 | -63.1 | 0 | 0 | 0 | 109.8 | ||||
| 20 | R | 30.1 | Very low | 31.1 | Very low | 228 Ų | 228 | 140.7 Ų | 140.7 | 86% | 0.86 | 80% | 0.801 | S | S | * | * | trans | -148.3 | 69.7 | 164.4 | -81.6 | -165 | 175.2 | 174.4 | 1.2 | 110.1 | ||||
| 21 | D | 28.1 | Very low | 31.6 | Very low | 155 Ų | 155 | 141.8 Ų | 141.8 | 83% | 0.829 | 81% | 0.806 | S | S | * | * | trans | -155.2 | 34.8 | 154.3 | -103.9 | -20.9 | 0 | 0 | 0 | 113.1 | ||||
| 22 | E | 30.4 | Very low | 31.9 | Very low | 167 Ų | 167 | 146.4 Ų | 146.4 | 78% | 0.78 | 81% | 0.807 | S | S | * | * | trans | -97.9 | 100.9 | 152.3 | -82.5 | -173.8 | 151.9 | 0 | 0 | 107.8 | L24 | E22-L24 PolarHBondContact O-N 3.26Š| ||
| 23 | R | 25.4 | Very low | 32.8 | Very low | 238 Ų | 238 | 149.6 Ų | 149.6 | 90% | 0.898 | 82% | 0.821 | S | S | * | * | trans | -60.3 | 92.8 | 165 | -77.3 | 179.6 | 176.9 | 172.8 | -0.3 | 108.2 | A25 | R23-A25 PolarHBondContact O-N 2.76Š| ||
| 24 | L | 31.6 | Very low | 33.1 | Very low | 151 Ų | 151 | 148 Ų | 148 | 79% | 0.791 | 82% | 0.815 | S | S | * | * | trans | -42.9 | 107.5 | 159.4 | -78.5 | 154.4 | 0 | 0 | 0 | 108.6 | E22 N26 | E22-L24 PolarHBondContact O-N 3.26Å; L24-N26 PolarHBondContact O-N 2.78Å | ||
| 25 | A | 33.7 | Very low | 34.5 | Very low | 99 Ų | 99 | 147.6 Ų | 147.6 | 82% | 0.818 | 81% | 0.812 | S | S | * | * | S | Bend | trans | -69.5 | 68 | 165.9 | 0 | 0 | 0 | 0 | 0 | 108.9 | R23 | R23-A25 PolarHBondContact O-N 2.76Š|
| 26 | N | 30.3 | Very low | 36.2 | Very low | 136 Ų | 136 | 146.5 Ų | 146.5 | 73% | 0.727 | 81% | 0.813 | S | S | * | * | trans | -144.3 | 87.4 | 171.3 | -87.4 | -33.6 | 0 | 0 | 0 | 107.5 | L24 F28 | L24-N26 PolarHBondContact O-N 2.78Å; N26-F28 VanDerWaalsContact C-N 3.3Å; N26-F28 PolarHBondContact O-N 3.36Å | ||
| 27 | G | 35.3 | Very low | 37.8 | Very low | 73 Ų | 73 | 147.2 Ų | 147.2 | 75% | 0.753 | 80% | 0.795 | S | S | * | * | trans | -69.6 | 87 | 170.7 | 0 | 0 | 0 | 0 | 0 | 110.6 | ||||
| 28 | F | 39.8 | Very low | 40.3 | Very low | 186 Ų | 186 | 141.5 Ų | 141.5 | 82% | 0.816 | 78% | 0.775 | S | S | * | * | trans | -149.4 | 70.1 | 153.5 | -92.1 | -76.2 | 0 | 0 | 0 | 109.1 | N26 | N26-F28 VanDerWaalsContact C-N 3.3Å; N26-F28 PolarHBondContact O-N 3.36Å | ||
| 29 | A | 32.7 | Very low | 42.7 | Very low | 101 Ų | 101 | 144.6 Ų | 144.6 | 84% | 0.835 | 77% | 0.774 | S | S | * | * | S | Bend | trans | -105.5 | 113.2 | 159.8 | 0 | 0 | 0 | 0 | 0 | 107.9 | ||
| 30 | G | 33.2 | Very low | 45.1 | Very low | 72 Ų | 72 | 139.9 Ų | 139.9 | 74% | 0.742 | 76% | 0.761 | S | S | * | * | trans | 54.7 | 95.6 | 164.6 | 0 | 0 | 0 | 0 | 0 | 116.4 | R32 | G30-R32 VanDerWaalsContact C-N 3.29Å; G30-R32 PolarHBondContact O-N 2.93Å | ||
| 31 | Q | 34.7 | Very low | 47.7 | Very low | 175 Ų | 175 | 134 Ų | 134 | 82% | 0.818 | 74% | 0.743 | S | S | * | * | trans | -61 | 91.2 | 164 | -78.5 | -174.1 | -15.3 | 0 | 0 | 110.4 | ||||
| 32 | R | 38.2 | Very low | 50.1 | Low | 241 Ų | 241 | 134.5 Ų | 134.5 | 91% | 0.909 | 73% | 0.733 | S | S | * | * | trans | -72.6 | 124.7 | 141.3 | -79 | -177.5 | 174.2 | 177.1 | -1.1 | 105.9 | G30 G34 | G30-R32 VanDerWaalsContact C-N 3.29Å; G30-R32 PolarHBondContact O-N 2.93Å; R32-G34 VanDerWaalsContact C-N 3.29Å; R32-G34 PolarHBondContact O-N 3.45Å | ||
| 33 | K | 45.5 | Very low | 52.5 | Low | 219 Ų | 219 | 130.2 Ų | 130.2 | 95% | 0.952 | 72% | 0.718 | S | S | * | * | trans | -54.3 | 91.4 | 173.5 | -84.8 | 176.7 | 171.2 | 176.2 | 0 | 109.5 | ||||
| 34 | G | 42 | Very low | 55.4 | Low | 66 Ų | 66 | 125.7 Ų | 125.7 | 68% | 0.68 | 71% | 0.705 | S | S | * | * | P | Polyproline II helix | trans | -80.5 | 143.6 | 168.9 | 0 | 0 | 0 | 0 | 0 | 109.7 | R32 | R32-G34 VanDerWaalsContact C-N 3.29Å; R32-G34 PolarHBondContact O-N 3.45Å |
| 35 | S | 57 | Low | 57.7 | Low | 108 Ų | 108 | 124.8 Ų | 124.8 | 76% | 0.755 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -48.3 | 146.6 | 172.9 | 45.3 | 0 | 0 | 0 | 0 | 112.1 | E37 | S35-E37 PolarHBondContact O-N 2.7Š|
| 36 | P | 62.4 | Low | 59.7 | Low | 127 Ų | 127 | 124.5 Ų | 124.5 | 83% | 0.825 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 127.8 | 179.5 | 24.1 | -32.1 | 0 | 0 | 0 | 110.1 | ||
| 37 | E | 71.1 | Confident | 62 | Low | 93 Ų | 93 | 121 Ų | 121 | 44% | 0.435 | 66% | 0.658 | S | S | . | * | P | Polyproline II helix | trans | -55 | 139.5 | 177.3 | -68.7 | -178.1 | 159.2 | 0 | 0 | 110.7 | S35 M39 R45 | S35-E37 PolarHBondContact O-N 2.7Å; E37-M39 PolarHBondContact O-N 2.98Å; E37-R45 IonicContact OE1-CZ 3Å; E37-R45 VanDerWaalsContact OE1-CZ 3.3Å; E37-R45 IonicContact OE1-NH1 3.95Å; E37-R45 PolarHBondContact OE1-NH1 2.93Å; E37-R45 IonicContact OE1-NH2 3.05Å; E37-R45 PolarHBondContact OE1-NH2 3.43Å; E37-R45 IonicContact OE2-CZ 3.38Å; E37-R45 VanDerWaalsContact OE2-CZ 3.27Å; E37-R45 IonicContact OE2-NH1 2.94Å; E37-R45 PolarHBondContact OE2-NH1 3.3Å; E37-R45 IonicContact OE2-NH2 3.29Å; E37-R45 PolarHBondContact OE2-NH2 3.03Å |
| 38 | P | 84.1 | Confident | 64 | Low | 69 Ų | 69 | 125.5 Ų | 125.5 | 45% | 0.448 | 66% | 0.657 | S | S | . | * | P | Polyproline II helix | trans | -60.6 | 137.5 | 177.1 | 22.6 | -30.2 | 0 | 0 | 0 | 110.7 | S40 E41 R42 | P38-S40 PolarHBondContact O-N 3.49Å; P38-E41 HydrophobicContact CG-CB 4.16Å; P38-E41 HydrophobicContact CG-CG 3.88Å; P38-E41 PolarHBondContact O-N 3.41Å; P38-R42 PolarHBondContact O-N 3.05Å |
| 39 | M | 78.4 | Confident | 65.3 | Low | 162 Ų | 162 | 120.6 Ų | 120.6 | 80% | 0.798 | 65% | 0.651 | S | S | * | * | H | α-helix | trans | -52.1 | -35 | -174.5 | -167.9 | -168 | -68.7 | 0 | 0 | 112.5 | E37 E41 R42 V43 | E37-M39 PolarHBondContact O-N 2.98Å; M39-E41 PolarHBondContact O-N 3.29Å; M39-R42 PolarHBondContact O-N 2.93Å; M39-V43 HydrophobicContact CG-CG2 4.49Å; M39-V43 WeakPolarHBondContact O-CB 3.32Å; M39-V43 VanDerWaalsContact O-CG2 3.25Å; M39-V43 WeakPolarHBondContact O-CG2 3.25Å; M39-V43 PolarHBondContact O-N 2.93Å |
| 40 | S | 82.4 | Confident | 67.1 | Low | 72 Ų | 72 | 118.4 Ų | 118.4 | 50% | 0.503 | 63% | 0.625 | S | S | . | * | H | α-helix | trans | -64.6 | -36.3 | 177.3 | 57.6 | 0 | 0 | 0 | 0 | 114.1 | P38 K44 | P38-S40 PolarHBondContact O-N 3.49Å; S40-K44 WeakPolarHBondContact O-CB 3.36Å; S40-K44 VanDerWaalsContact O-CG 3.27Å; S40-K44 WeakPolarHBondContact O-CG 3.38Å; S40-K44 PolarHBondContact O-N 3.21Å |
| 41 | E | 84.6 | Confident | 69.3 | Low | 105 Ų | 105 | 118 Ų | 118 | 49% | 0.491 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -74.7 | -37.5 | 178.1 | -73.6 | -172.4 | 167.2 | 0 | 0 | 111.3 | P38 M39 K44 R45 | P38-E41 HydrophobicContact CG-CB 4.16Å; P38-E41 HydrophobicContact CG-CG 3.88Å; P38-E41 PolarHBondContact O-N 3.41Å; M39-E41 PolarHBondContact O-N 3.29Å; E41-K44 PolarHBondContact O-N 2.91Å; E41-R45 WeakPolarHBondContact O-CB 3.49Å; E41-R45 PolarHBondContact O-N 3Å |
| 42 | R | 79 | Confident | 70.9 | Confident | 165 Ų | 165 | 112.1 Ų | 112.1 | 62% | 0.623 | 58% | 0.58 | S | S | * | * | H | α-helix | trans | -62.6 | -44.8 | 173.4 | -164.5 | 173.8 | -177.8 | -178.7 | 0.3 | 111.3 | P38 M39 R45 I46 | P38-R42 PolarHBondContact O-N 3.05Å; M39-R42 PolarHBondContact O-N 2.93Å; R42-R45 PolarHBondContact O-N 3.41Å; R42-I46 HydrophobicContact CG-CD1 4.25Å; R42-I46 VanDerWaalsContact O-CG1 3.28Å; R42-I46 WeakPolarHBondContact O-CG1 3Å; R42-I46 PolarHBondContact O-N 2.8Å |
| 43 | V | 81.9 | Confident | 72.2 | Confident | 77 Ų | 77 | 102.5 Ų | 102.5 | 47% | 0.467 | 55% | 0.547 | S | S | . | . | H | α-helix | trans | -63.6 | -48.3 | 174.9 | 171.8 | 0 | 0 | 0 | 0 | 111 | M39 R45 I46 V47 | M39-V43 HydrophobicContact CG-CG2 4.49Å; M39-V43 WeakPolarHBondContact O-CB 3.32Å; M39-V43 VanDerWaalsContact O-CG2 3.25Å; M39-V43 WeakPolarHBondContact O-CG2 3.25Å; M39-V43 PolarHBondContact O-N 2.93Å; V43-R45 VanDerWaalsContact C-N 3.26Å; V43-R45 PolarHBondContact O-N 2.8Å; V43-I46 PolarHBondContact O-N 3.21Å; V43-V47 HydrophobicContact CG1-CG2 4.11Å; V43-V47 WeakPolarHBondContact O-CB 3.15Å; V43-V47 VanDerWaalsContact O-CG2 3.27Å; V43-V47 WeakPolarHBondContact O-CG2 3.47Å; V43-V47 PolarHBondContact O-N 3.41Å |
| 44 | K | 84.5 | Confident | 73.6 | Confident | 142 Ų | 142 | 95.9 Ų | 95.9 | 62% | 0.617 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -57.2 | -39.1 | 177 | -79.8 | 176.9 | -178.2 | 179.5 | 0 | 112.5 | S40 E41 K48 | S40-K44 WeakPolarHBondContact O-CB 3.36Å; S40-K44 VanDerWaalsContact O-CG 3.27Å; S40-K44 WeakPolarHBondContact O-CG 3.38Å; S40-K44 PolarHBondContact O-N 3.21Å; E41-K44 PolarHBondContact O-N 2.91Å; K44-K48 WeakPolarHBondContact O-CB 3.5Å; K44-K48 WeakPolarHBondContact O-CG 2.94Å; K44-K48 PolarHBondContact O-N 3.28Å |
| 45 | R | 79.9 | Confident | 75.4 | Confident | 132 Ų | 132 | 96 Ų | 96 | 50% | 0.498 | 51% | 0.506 | S | S | . | . | H | α-helix | trans | -65.3 | -47.7 | 177 | -171.3 | -177.9 | -51.6 | 171.7 | 6.6 | 111.7 | E37 E41 R42 V43 V47 K48 A49 | E37-R45 IonicContact OE1-CZ 3Å; E37-R45 VanDerWaalsContact OE1-CZ 3.3Å; E37-R45 IonicContact OE1-NH1 3.95Å; E37-R45 PolarHBondContact OE1-NH1 2.93Å; E37-R45 IonicContact OE1-NH2 3.05Å; E37-R45 PolarHBondContact OE1-NH2 3.43Å; E37-R45 IonicContact OE2-CZ 3.38Å; E37-R45 VanDerWaalsContact OE2-CZ 3.27Å; E37-R45 IonicContact OE2-NH1 2.94Å; E37-R45 PolarHBondContact OE2-NH1 3.3Å; E37-R45 IonicContact OE2-NH2 3.29Å; E37-R45 PolarHBondContact OE2-NH2 3.03Å; E41-R45 WeakPolarHBondContact O-CB 3.49Å; E41-R45 PolarHBondContact O-N 3Å; R42-R45 PolarHBondContact O-N 3.41Å; V43-R45 VanDerWaalsContact C-N 3.26Å; V43-R45 PolarHBondContact O-N 2.8Å; R45-V47 VanDerWaalsContact C-N 3.34Å; R45-V47 PolarHBondContact O-N 3.03Å; R45-K48 PolarHBondContact O-N 3.19Å; R45-A49 WeakPolarHBondContact O-CB 3.48Å; R45-A49 PolarHBondContact O-N 3.43Å |
| 46 | I | 75.8 | Confident | 76.1 | Confident | 93 Ų | 93 | 91.7 Ų | 91.7 | 48% | 0.477 | 48% | 0.475 | S | S | . | . | H | α-helix | trans | -61.9 | -44.1 | 177.9 | -67.7 | 166.1 | 0 | 0 | 0 | 110.6 | R42 V43 A49 N50 | R42-I46 HydrophobicContact CG-CD1 4.25Å; R42-I46 VanDerWaalsContact O-CG1 3.28Å; R42-I46 WeakPolarHBondContact O-CG1 3Å; R42-I46 PolarHBondContact O-N 2.8Å; V43-I46 PolarHBondContact O-N 3.21Å; I46-A49 PolarHBondContact O-N 3.31Å; I46-N50 PolarHBondContact O-N 2.96Å; I46-N50 VanDerWaalsContact O-N 3.08Å; I46-N50 PolarHBondContact O-ND2 3.49Å |
| 47 | V | 80.3 | Confident | 76.6 | Confident | 63 Ų | 63 | 87.8 Ų | 87.8 | 38% | 0.382 | 45% | 0.449 | S | S | . | . | H | α-helix | trans | -63.5 | -45.5 | 178.4 | 171.4 | 0 | 0 | 0 | 0 | 111.1 | V43 R45 A49 N50 L51 I54 | V43-V47 HydrophobicContact CG1-CG2 4.11Å; V43-V47 WeakPolarHBondContact O-CB 3.15Å; V43-V47 VanDerWaalsContact O-CG2 3.27Å; V43-V47 WeakPolarHBondContact O-CG2 3.47Å; V43-V47 PolarHBondContact O-N 3.41Å; R45-V47 VanDerWaalsContact C-N 3.34Å; R45-V47 PolarHBondContact O-N 3.03Å; V47-A49 PolarHBondContact O-N 3.32Å; V47-N50 CarbonylContact O-C 3.58Å; V47-N50 PolarHBondContact O-N 3.17Å; V47-L51 VanDerWaalsContact O-CA 3.31Å; V47-L51 WeakPolarHBondContact O-CA 3.27Å; V47-L51 WeakPolarHBondContact O-CB 3.16Å; V47-L51 PolarHBondContact O-N 3.25Å; V47-I54 HydrophobicContact CB-CD1 4.44Å; V47-I54 HydrophobicContact CG1-CD1 4.22Å; V47-I54 HydrophobicContact CG2-CD1 4.45Å |
| 48 | K | 77.4 | Confident | 77.1 | Confident | 168 Ų | 168 | 85.5 Ų | 85.5 | 73% | 0.73 | 45% | 0.446 | S | S | * | . | H | α-helix | trans | -63.6 | -40.6 | 176.9 | -77.5 | -174.3 | 177.1 | -171.1 | 0 | 112.4 | K44 R45 N50 | K44-K48 WeakPolarHBondContact O-CB 3.5Å; K44-K48 WeakPolarHBondContact O-CG 2.94Å; K44-K48 PolarHBondContact O-N 3.28Å; R45-K48 PolarHBondContact O-N 3.19Å; K48-N50 VanDerWaalsContact C-N 3.29Å; K48-N50 PolarHBondContact O-N 2.98Å |
| 49 | A | 66.1 | Low | 77 | Confident | 82 Ų | 82 | 82.5 Ų | 82.5 | 68% | 0.678 | 43% | 0.428 | S | S | * | . | H | α-helix | trans | -66.8 | -30.2 | 179.9 | 0 | 0 | 0 | 0 | 0 | 113.1 | R45 I46 V47 | R45-A49 WeakPolarHBondContact O-CB 3.48Å; R45-A49 PolarHBondContact O-N 3.43Å; I46-A49 PolarHBondContact O-N 3.31Å; V47-A49 PolarHBondContact O-N 3.32Å |
| 50 | N | 71.6 | Confident | 76.8 | Confident | 56 Ų | 56 | 76 Ų | 76 | 30% | 0.299 | 40% | 0.397 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -111.9 | 20.1 | -177.8 | -60.2 | -80 | 0 | 0 | 0 | 112.7 | I46 V47 K48 L52 V53 I54 | I46-N50 PolarHBondContact O-N 2.96Å; I46-N50 VanDerWaalsContact O-N 3.08Å; I46-N50 PolarHBondContact O-ND2 3.49Å; V47-N50 CarbonylContact O-C 3.58Å; V47-N50 PolarHBondContact O-N 3.17Å; K48-N50 VanDerWaalsContact C-N 3.29Å; K48-N50 PolarHBondContact O-N 2.98Å; N50-L52 VanDerWaalsContact C-N 3.35Å; N50-L52 PolarHBondContact O-N 2.93Å; N50-V53 WeakPolarHBondContact O-CB 3.27Å; N50-V53 PolarHBondContact O-N 2.91Å; N50-V53 VanDerWaalsContact O-N 3.12Å; N50-I54 HydrophobicContact CB-CD1 4.28Å; N50-I54 WeakPolarHBondContact O-CG1 3.46Å; N50-I54 PolarHBondContact O-N 3.39Å |
| 51 | L | 78.5 | Confident | 76.8 | Confident | 64 Ų | 64 | 76 Ų | 76 | 34% | 0.335 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -57.8 | -45.6 | -169.7 | 178.9 | 58.8 | 0 | 0 | 0 | 112.4 | V47 V53 I54 L55 W268 | V47-L51 VanDerWaalsContact O-CA 3.31Å; V47-L51 WeakPolarHBondContact O-CA 3.27Å; V47-L51 WeakPolarHBondContact O-CB 3.16Å; V47-L51 PolarHBondContact O-N 3.25Å; L51-V53 VanDerWaalsContact C-N 3.28Å; L51-V53 PolarHBondContact O-N 3.18Å; L51-I54 PolarHBondContact O-N 3.04Å; L51-L55 HydrophobicContact CD1-CD1 4.05Å; L51-L55 HydrophobicContact CD1-CG 4.04Å; L51-L55 HydrophobicContact CG-CD1 3.94Å; L51-L55 HydrophobicContact CG-CG 4.36Å; L51-L55 WeakPolarHBondContact O-CB 3.28Å; L51-L55 VanDerWaalsContact O-CG 3.27Å; L51-L55 WeakPolarHBondContact O-CG 3.31Å; L51-L55 PolarHBondContact O-N 3.28Å; L51-W268 HydrophobicContact CD2-CH2 3.95Å; L51-W268 HydrophobicContact CD2-CZ3 4.21Å; L51-W268 HydrophobicContact CG-CH2 4.41Å; L51-W268 HydrophobicContact CG-CZ3 4.5Å |
| 52 | L | 68.4 | Low | 77 | Confident | 51 Ų | 51 | 74 Ų | 74 | 27% | 0.267 | 39% | 0.389 | S | S | . | . | H | α-helix | trans | -60.8 | -39.1 | 179.9 | -175.3 | 66.4 | 0 | 0 | 0 | 112.3 | N50 L55 T56 M267 W268 P271 | N50-L52 VanDerWaalsContact C-N 3.35Å; N50-L52 PolarHBondContact O-N 2.93Å; L52-L55 PolarHBondContact O-N 3.12Å; L52-T56 WeakPolarHBondContact O-CG2 3.22Å; L52-T56 PolarHBondContact O-N 3.01Å; L52-T56 PolarHBondContact O-OG1 3.49Å; L52-M267 WeakPolarHBondContact CD1-O 3.44Å; L52-M267 HydrophobicContact CD2-CB 4.28Å; L52-W268 HydrophobicContact CD1-CE3 4.5Å; L52-P271 HydrophobicContact CD1-CG 4.24Å |
| 53 | V | 65.4 | Low | 77.4 | Confident | 39 Ų | 39 | 66.2 Ų | 66.2 | 24% | 0.236 | 36% | 0.359 | C | S | . | . | H | α-helix | trans | -68.5 | -44.9 | 178.2 | 180 | 0 | 0 | 0 | 0 | 110.4 | N50 L51 L55 T56 V57 | N50-V53 WeakPolarHBondContact O-CB 3.27Å; N50-V53 PolarHBondContact O-N 2.91Å; N50-V53 VanDerWaalsContact O-N 3.12Å; L51-V53 VanDerWaalsContact C-N 3.28Å; L51-V53 PolarHBondContact O-N 3.18Å; V53-L55 VanDerWaalsContact C-N 3.3Å; V53-L55 PolarHBondContact O-N 2.86Å; V53-T56 VanDerWaalsContact CA-OG1 3.31Å; V53-T56 WeakPolarHBondContact CA-OG1 3.28Å; V53-T56 PolarHBondContact O-N 3.27Å; V53-T56 PolarHBondContact O-OG1 3.19Å; V53-V57 WeakPolarHBondContact O-CG2 3.49Å; V53-V57 PolarHBondContact O-N 3.32Å |
| 54 | I | 75.6 | Confident | 77.5 | Confident | 79 Ų | 79 | 63.8 Ų | 63.8 | 41% | 0.405 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -61.7 | -42.8 | 177.4 | -65.9 | 165.8 | 0 | 0 | 0 | 110.1 | V47 N50 L51 A58 | V47-I54 HydrophobicContact CB-CD1 4.44Å; V47-I54 HydrophobicContact CG1-CD1 4.22Å; V47-I54 HydrophobicContact CG2-CD1 4.45Å; N50-I54 HydrophobicContact CB-CD1 4.28Å; N50-I54 WeakPolarHBondContact O-CG1 3.46Å; N50-I54 PolarHBondContact O-N 3.39Å; L51-I54 PolarHBondContact O-N 3.04Å; I54-A58 WeakPolarHBondContact O-CB 3.24Å; I54-A58 PolarHBondContact O-N 3.4Å |
| 55 | L | 79.1 | Confident | 77.7 | Confident | 68 Ų | 68 | 64 Ų | 64 | 36% | 0.356 | 35% | 0.346 | S | S | . | . | H | α-helix | trans | -65.5 | -40.6 | 178 | -71.9 | 173.5 | 0 | 0 | 0 | 112.5 | L51 L52 V53 G59 W268 P271 | L51-L55 HydrophobicContact CD1-CD1 4.05Å; L51-L55 HydrophobicContact CD1-CG 4.04Å; L51-L55 HydrophobicContact CG-CD1 3.94Å; L51-L55 HydrophobicContact CG-CG 4.36Å; L51-L55 WeakPolarHBondContact O-CB 3.28Å; L51-L55 VanDerWaalsContact O-CG 3.27Å; L51-L55 WeakPolarHBondContact O-CG 3.31Å; L51-L55 PolarHBondContact O-N 3.28Å; L52-L55 PolarHBondContact O-N 3.12Å; V53-L55 VanDerWaalsContact C-N 3.3Å; V53-L55 PolarHBondContact O-N 2.86Å; L55-G59 PolarHBondContact O-N 2.94Å; L55-W268 HydrophobicContact CD1-CZ3 4.14Å; L55-P271 HydrophobicContact CB-CB 3.96Å; L55-P271 HydrophobicContact CB-CG 3.76Å |
| 56 | T | 70.6 | Confident | 78.1 | Confident | 18 Ų | 18 | 60.4 Ų | 60.4 | 11% | 0.11 | 34% | 0.336 | C | S | . | . | H | α-helix | trans | -67.5 | -45.5 | 177.3 | 42.6 | 0 | 0 | 0 | 0 | 111.8 | L52 V53 A58 G59 V60 P271 I274 | L52-T56 WeakPolarHBondContact O-CG2 3.22Å; L52-T56 PolarHBondContact O-N 3.01Å; L52-T56 PolarHBondContact O-OG1 3.49Å; V53-T56 VanDerWaalsContact CA-OG1 3.31Å; V53-T56 WeakPolarHBondContact CA-OG1 3.28Å; V53-T56 PolarHBondContact O-N 3.27Å; V53-T56 PolarHBondContact O-OG1 3.19Å; T56-A58 PolarHBondContact O-N 3.24Å; T56-G59 PolarHBondContact O-N 2.94Å; T56-G59 VanDerWaalsContact O-N 3.16Å; T56-V60 WeakPolarHBondContact O-CG2 3.36Å; T56-V60 PolarHBondContact O-N 3.04Å; T56-P271 HydrophobicContact CG2-CB 4.45Å; T56-P271 HydrophobicContact CG2-CG 3.89Å; T56-I274 HydrophobicContact CG2-CD1 4.23Å |
| 57 | V | 74.7 | Confident | 78.5 | Confident | 45 Ų | 45 | 56 Ų | 56 | 27% | 0.273 | 31% | 0.313 | S | S | . | . | H | α-helix | trans | -61.1 | -45.1 | 174.7 | 174.3 | 0 | 0 | 0 | 0 | 110.9 | V53 G59 V60 V61 W454 | V53-V57 WeakPolarHBondContact O-CG2 3.49Å; V53-V57 PolarHBondContact O-N 3.32Å; V57-G59 VanDerWaalsContact C-N 3.32Å; V57-G59 PolarHBondContact O-N 3.38Å; V57-V60 PolarHBondContact O-N 3.45Å; V57-V61 WeakPolarHBondContact O-CG2 3.37Å; V57-V61 PolarHBondContact O-N 2.97Å; V57-W454 HydrophobicContact CG2-CD2 3.7Å; V57-W454 HydrophobicContact CG2-CE3 3.54Å; V57-W454 HydrophobicContact CG2-CG 4.44Å; V57-W454 HydrophobicContact CG2-CH2 3.89Å; V57-W454 HydrophobicContact CG2-CZ2 4.03Å; V57-W454 HydrophobicContact CG2-CZ3 3.64Å |
| 58 | A | 81.3 | Confident | 78.8 | Confident | 45 Ų | 45 | 56.7 Ų | 56.7 | 37% | 0.372 | 32% | 0.315 | S | S | . | . | H | α-helix | trans | -60.9 | -42.1 | 174.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | I54 T56 V60 V61 V62 | I54-A58 WeakPolarHBondContact O-CB 3.24Å; I54-A58 PolarHBondContact O-N 3.4Å; T56-A58 PolarHBondContact O-N 3.24Å; A58-V60 PolarHBondContact O-N 2.94Å; A58-V61 PolarHBondContact O-N 3.41Å; A58-V62 WeakPolarHBondContact O-CB 3.45Å; A58-V62 VanDerWaalsContact O-CG2 3.22Å; A58-V62 WeakPolarHBondContact O-CG2 3.4Å; A58-V62 PolarHBondContact O-N 3.1Å |
| 59 | G | 81.6 | Confident | 79.3 | Confident | 6 Ų | 6 | 50.9 Ų | 50.9 | 6% | 0.062 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -59.8 | -43.9 | 176.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | L55 T56 V57 G63 M275 | L55-G59 PolarHBondContact O-N 2.94Å; T56-G59 PolarHBondContact O-N 2.94Å; T56-G59 VanDerWaalsContact O-N 3.16Å; V57-G59 VanDerWaalsContact C-N 3.32Å; V57-G59 PolarHBondContact O-N 3.38Å; G59-G63 WeakPolarHBondContact O-CA 3.29Å; G59-G63 PolarHBondContact O-N 2.97Å; G59-M275 WeakPolarHBondContact O-CA 3.34Å; G59-M275 VanDerWaalsContact O-CB 3.31Å; G59-M275 WeakPolarHBondContact O-CB 3.34Å; G59-M275 WeakPolarHBondContact O-CG 3.27Å |
| 60 | V | 74.8 | Confident | 80.3 | Confident | 25 Ų | 25 | 48.4 Ų | 48.4 | 15% | 0.152 | 28% | 0.279 | C | S | . | . | H | α-helix | trans | -61 | -51.8 | 173.6 | 173.6 | 0 | 0 | 0 | 0 | 110.4 | T56 V57 A58 V62 G63 V64 I274 A451 | T56-V60 WeakPolarHBondContact O-CG2 3.36Å; T56-V60 PolarHBondContact O-N 3.04Å; V57-V60 PolarHBondContact O-N 3.45Å; A58-V60 PolarHBondContact O-N 2.94Å; V60-V62 PolarHBondContact O-N 3.43Å; V60-G63 PolarHBondContact O-N 3.16Å; V60-G63 VanDerWaalsContact O-N 3.15Å; V60-V64 WeakPolarHBondContact O-CG2 3.33Å; V60-V64 PolarHBondContact O-N 3.3Å; V60-I274 HydrophobicContact CG2-CG2 3.57Å; V60-A451 WeakPolarHBondContact CG2-O 3.4Å |
| 61 | V | 82.6 | Confident | 80.7 | Confident | 73 Ų | 73 | 49.9 Ų | 49.9 | 44% | 0.442 | 28% | 0.28 | S | S | . | . | H | α-helix | trans | -59.2 | -48 | -178.4 | 171.6 | 0 | 0 | 0 | 0 | 111.3 | V57 A58 G63 V64 F65 | V57-V61 WeakPolarHBondContact O-CG2 3.37Å; V57-V61 PolarHBondContact O-N 2.97Å; A58-V61 PolarHBondContact O-N 3.41Å; V61-G63 VanDerWaalsContact C-N 3.33Å; V61-G63 PolarHBondContact O-N 3.34Å; V61-V64 PolarHBondContact O-N 3.42Å; V61-F65 HydrophobicContact CG1-CD2 3.93Å; V61-F65 HydrophobicContact CG1-CE2 3.54Å; V61-F65 WeakPolarHBondContact O-CD2 3.2Å; V61-F65 PolarHBondContact O-N 3.46Å |
| 62 | V | 89 | Confident | 81 | Confident | 64 Ų | 64 | 50.8 Ų | 50.8 | 39% | 0.388 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -63.4 | -41 | 176.5 | 174.1 | 0 | 0 | 0 | 0 | 110.7 | A58 V60 V64 F65 I66 M275 | A58-V62 WeakPolarHBondContact O-CB 3.45Å; A58-V62 VanDerWaalsContact O-CG2 3.22Å; A58-V62 WeakPolarHBondContact O-CG2 3.4Å; A58-V62 PolarHBondContact O-N 3.1Å; V60-V62 PolarHBondContact O-N 3.43Å; V62-V64 VanDerWaalsContact C-N 3.31Å; V62-V64 PolarHBondContact O-N 2.95Å; V62-F65 PolarHBondContact O-N 3.2Å; V62-I66 HydrophobicContact CG1-CD1 3.68Å; V62-I66 HydrophobicContact CG1-CG1 4.17Å; V62-I66 WeakPolarHBondContact O-CG1 3.28Å; V62-I66 PolarHBondContact O-N 3.15Å; V62-M275 HydrophobicContact CB-CG 4.4Å; V62-M275 HydrophobicContact CB-SD 4.13Å; V62-M275 HydrophobicContact CG1-CG 4.19Å; V62-M275 HydrophobicContact CG1-SD 3.56Å; V62-M275 VanDerWaalsContact CG1-SD 3.56Å |
| 63 | G | 85.6 | Confident | 81.7 | Confident | 0 Ų | 0 | 52.2 Ų | 52.2 | 0% | 0 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -59.5 | -39.8 | 176 | 0 | 0 | 0 | 0 | 0 | 112.7 | G59 V60 V61 I66 G67 M275 A279 | G59-G63 WeakPolarHBondContact O-CA 3.29Å; G59-G63 PolarHBondContact O-N 2.97Å; V60-G63 PolarHBondContact O-N 3.16Å; V60-G63 VanDerWaalsContact O-N 3.15Å; V61-G63 VanDerWaalsContact C-N 3.33Å; V61-G63 PolarHBondContact O-N 3.34Å; G63-I66 PolarHBondContact O-N 2.98Å; G63-G67 PolarHBondContact O-N 3.39Å; G63-M275 VanDerWaalsContact CA-O 3.24Å; G63-M275 WeakPolarHBondContact CA-O 3.29Å; G63-A279 WeakPolarHBondContact O-CA 3.11Å; G63-A279 WeakPolarHBondContact O-CB 3.02Å |
| 64 | V | 83.8 | Confident | 82.4 | Confident | 27 Ų | 27 | 55.3 Ų | 55.3 | 16% | 0.164 | 34% | 0.34 | C | S | . | . | H | α-helix | trans | -62 | -47.4 | 173.3 | 175.7 | 0 | 0 | 0 | 0 | 111.3 | V60 V61 V62 G67 L68 V278 I282 F292 | V60-V64 WeakPolarHBondContact O-CG2 3.33Å; V60-V64 PolarHBondContact O-N 3.3Å; V61-V64 PolarHBondContact O-N 3.42Å; V62-V64 VanDerWaalsContact C-N 3.31Å; V62-V64 PolarHBondContact O-N 2.95Å; V64-G67 PolarHBondContact O-N 3.16Å; V64-L68 HydrophobicContact CG1-CD1 3.92Å; V64-L68 HydrophobicContact CG1-CG 4.39Å; V64-L68 WeakPolarHBondContact O-CB 3.12Å; V64-L68 VanDerWaalsContact O-CG 3.31Å; V64-L68 WeakPolarHBondContact O-CG 3.41Å; V64-L68 PolarHBondContact O-N 2.88Å; V64-V278 HydrophobicContact CG2-CG1 3.77Å; V64-I282 HydrophobicContact CB-CD1 4.1Å; V64-I282 HydrophobicContact CG1-CD1 4.14Å; V64-I282 HydrophobicContact CG2-CD1 3.91Å; V64-F292 HydrophobicContact CG1-CE2 4.41Å; V64-F292 HydrophobicContact CG1-CZ 3.92Å; V64-F292 HydrophobicContact CG2-CE1 4.38Å; V64-F292 HydrophobicContact CG2-CZ 3.8Å |
| 65 | F | 88.8 | Confident | 82.6 | Confident | 147 Ų | 147 | 52.5 Ų | 52.5 | 65% | 0.645 | 33% | 0.326 | S | S | * | . | H | α-helix | trans | -63.7 | -42.6 | 178.3 | -73.6 | -64.1 | 0 | 0 | 0 | 112.6 | V61 V62 G69 | V61-F65 HydrophobicContact CG1-CD2 3.93Å; V61-F65 HydrophobicContact CG1-CE2 3.54Å; V61-F65 WeakPolarHBondContact O-CD2 3.2Å; V61-F65 PolarHBondContact O-N 3.46Å; V62-F65 PolarHBondContact O-N 3.2Å; F65-G69 PolarHBondContact O-N 3.22Å |
| 66 | I | 88.8 | Confident | 82.8 | Confident | 56 Ų | 56 | 53.2 Ų | 53.2 | 29% | 0.287 | 33% | 0.333 | S | S | . | . | H | α-helix | trans | -62.5 | -48.3 | 175.4 | -67.7 | 172.5 | 0 | 0 | 0 | 109.9 | V62 G63 L68 G69 V70 M275 A279 | V62-I66 HydrophobicContact CG1-CD1 3.68Å; V62-I66 HydrophobicContact CG1-CG1 4.17Å; V62-I66 WeakPolarHBondContact O-CG1 3.28Å; V62-I66 PolarHBondContact O-N 3.15Å; G63-I66 PolarHBondContact O-N 2.98Å; I66-L68 PolarHBondContact O-N 3.3Å; I66-G69 PolarHBondContact O-N 3.37Å; I66-V70 HydrophobicContact CG2-CG2 4.03Å; I66-V70 WeakPolarHBondContact O-CB 3.1Å; I66-V70 VanDerWaalsContact O-CG2 3.24Å; I66-V70 WeakPolarHBondContact O-CG2 3.39Å; I66-V70 PolarHBondContact O-N 3.08Å; I66-M275 HydrophobicContact CD1-CG 4.3Å; I66-M275 HydrophobicContact CD1-SD 4.08Å; I66-A279 HydrophobicContact CB-CB 4.22Å; I66-A279 HydrophobicContact CG2-CB 3.96Å |
| 67 | G | 85.3 | Confident | 83.1 | Confident | 0 Ų | 0 | 58.4 Ų | 58.4 | 0% | 0 | 36% | 0.36 | C | S | . | . | H | α-helix | trans | -59.1 | -45.9 | 179.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | G63 V64 R71 V283 | G63-G67 PolarHBondContact O-N 3.39Å; V64-G67 PolarHBondContact O-N 3.16Å; G67-R71 WeakPolarHBondContact O-CB 3.42Å; G67-R71 PolarHBondContact O-N 3.44Å; G67-V283 WeakPolarHBondContact O-CG2 3.45Å |
| 68 | L | 85.9 | Confident | 83.5 | Confident | 77 Ų | 77 | 59.9 Ų | 59.9 | 40% | 0.403 | 37% | 0.369 | S | S | . | . | H | α-helix | trans | -64.4 | -42 | 176 | -71.2 | 174.4 | 0 | 0 | 0 | 112.4 | V64 I66 A72 I282 V288 | V64-L68 HydrophobicContact CG1-CD1 3.92Å; V64-L68 HydrophobicContact CG1-CG 4.39Å; V64-L68 WeakPolarHBondContact O-CB 3.12Å; V64-L68 VanDerWaalsContact O-CG 3.31Å; V64-L68 WeakPolarHBondContact O-CG 3.41Å; V64-L68 PolarHBondContact O-N 2.88Å; I66-L68 PolarHBondContact O-N 3.3Å; L68-A72 PolarHBondContact O-N 3.15Å; L68-A72 VanDerWaalsContact O-N 3.14Å; L68-I282 HydrophobicContact CD2-CG2 4.15Å; L68-I282 HydrophobicContact CG-CG2 4.38Å; L68-V288 HydrophobicContact CD2-CG1 4.09Å; L68-V288 HydrophobicContact CD2-CG2 4.06Å |
| 69 | G | 87.5 | Confident | 83.6 | Confident | 46 Ų | 46 | 62.5 Ų | 62.5 | 47% | 0.474 | 37% | 0.374 | S | S | . | . | H | α-helix | trans | -66.8 | -45.1 | 178.7 | 0 | 0 | 0 | 0 | 0 | 112.8 | F65 I66 A72 | F65-G69 PolarHBondContact O-N 3.22Å; I66-G69 PolarHBondContact O-N 3.37Å; G69-A72 WeakPolarHBondContact O-CB 3.26Å; G69-A72 PolarHBondContact O-N 3.42Å |
| 70 | V | 86.6 | Confident | 83.4 | Confident | 31 Ų | 31 | 64.6 Ų | 64.6 | 19% | 0.188 | 38% | 0.382 | C | S | . | . | H | α-helix | trans | -62.1 | -44.8 | 175.4 | 166.8 | 0 | 0 | 0 | 0 | 110.2 | I66 A72 A73 P75 I83 V283 | I66-V70 HydrophobicContact CG2-CG2 4.03Å; I66-V70 WeakPolarHBondContact O-CB 3.1Å; I66-V70 VanDerWaalsContact O-CG2 3.24Å; I66-V70 WeakPolarHBondContact O-CG2 3.39Å; I66-V70 PolarHBondContact O-N 3.08Å; V70-A72 VanDerWaalsContact C-N 3.27Å; V70-A72 PolarHBondContact O-N 2.83Å; V70-A73 WeakPolarHBondContact O-CB 3.1Å; V70-A73 PolarHBondContact O-N 3.23Å; V70-P75 HydrophobicContact CG1-CB 4.46Å; V70-P75 HydrophobicContact CG1-CG 3.83Å; V70-P75 VanDerWaalsContact O-CD 3.27Å; V70-P75 WeakPolarHBondContact O-CD 3.43Å; V70-I83 HydrophobicContact CB-CD1 4.43Å; V70-I83 HydrophobicContact CG1-CD1 3.5Å; V70-I83 VanDerWaalsContact CG1-CD1 3.5Å; V70-I83 HydrophobicContact CG2-CD1 4.03Å; V70-V283 HydrophobicContact CB-CG2 3.94Å; V70-V283 HydrophobicContact CG1-CG1 4.27Å; V70-V283 HydrophobicContact CG1-CG2 3.61Å |
| 71 | R | 81.5 | Confident | 83.6 | Confident | 87 Ų | 87 | 68.1 Ų | 68.1 | 33% | 0.328 | 40% | 0.399 | S | S | . | . | H | α-helix | trans | -58.6 | -38.8 | 178.2 | 179.7 | 176.9 | 160.1 | 153.2 | 0.3 | 112.3 | G67 A73 S74 V283 M285 E286 | G67-R71 WeakPolarHBondContact O-CB 3.42Å; G67-R71 PolarHBondContact O-N 3.44Å; R71-A73 PolarHBondContact O-N 2.72Å; R71-S74 PolarHBondContact O-N 3.3Å; R71-S74 VanDerWaalsContact O-N 3.1Å; R71-V283 HydrophobicContact CB-CG2 4.35Å; R71-M285 PolarHBondContact NH1-O 3.06Å; R71-E286 PolarHBondContact NH1-O 2.9Å; R71-E286 VanDerWaalsContact NH1-O 3.16Å; R71-E286 PolarHBondContact NH2-O 3.39Å |
| 72 | A | 84.3 | Confident | 83.8 | Confident | 83 Ų | 83 | 72.6 Ų | 72.6 | 69% | 0.686 | 41% | 0.409 | S | S | * | . | H | α-helix | trans | -61.5 | -26 | 176.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | L68 G69 V70 S74 | L68-A72 PolarHBondContact O-N 3.15Å; L68-A72 VanDerWaalsContact O-N 3.14Å; G69-A72 WeakPolarHBondContact O-CB 3.26Å; G69-A72 PolarHBondContact O-N 3.42Å; V70-A72 VanDerWaalsContact C-N 3.27Å; V70-A72 PolarHBondContact O-N 2.83Å; A72-S74 VanDerWaalsContact C-N 3.3Å; A72-S74 PolarHBondContact O-N 2.91Å |
| 73 | A | 83.6 | Confident | 83.6 | Confident | 80 Ų | 80 | 71.6 Ų | 71.6 | 66% | 0.661 | 40% | 0.401 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -82.5 | -0.9 | 177.8 | 0 | 0 | 0 | 0 | 0 | 114.2 | V70 R71 | V70-A73 WeakPolarHBondContact O-CB 3.1Å; V70-A73 PolarHBondContact O-N 3.23Å; R71-A73 PolarHBondContact O-N 2.72Å |
| 74 | S | 79.9 | Confident | 83.3 | Confident | 105 Ų | 105 | 72.4 Ų | 72.4 | 73% | 0.734 | 41% | 0.409 | S | S | * | . | trans | 50.8 | 57.8 | 179.2 | -51.3 | 0 | 0 | 0 | 0 | 114.1 | R71 A72 | R71-S74 PolarHBondContact O-N 3.3Å; R71-S74 VanDerWaalsContact O-N 3.1Å; A72-S74 VanDerWaalsContact C-N 3.3Å; A72-S74 PolarHBondContact O-N 2.91Å | ||
| 75 | P | 78.6 | Confident | 83.4 | Confident | 20 Ų | 20 | 76 Ų | 76 | 13% | 0.13 | 42% | 0.423 | C | S | . | . | trans | -69.1 | 151 | -173.4 | 30.6 | -37.8 | 0 | 0 | 0 | 112.3 | V70 Q79 Q80 V283 | V70-P75 HydrophobicContact CG1-CB 4.46Å; V70-P75 HydrophobicContact CG1-CG 3.83Å; V70-P75 VanDerWaalsContact O-CD 3.27Å; V70-P75 WeakPolarHBondContact O-CD 3.43Å; P75-Q79 HydrophobicContact CB-CB 4.08Å; P75-Q80 HydrophobicContact CB-CG 4.25Å; P75-Q80 HydrophobicContact CG-CG 3.82Å; P75-Q80 PolarHBondContact O-NE2 3.44Å; P75-Q80 VanDerWaalsContact O-NE2 3.15Å; P75-V283 HydrophobicContact CG-CG1 3.87Å | ||
| 76 | T | 83.9 | Confident | 83.3 | Confident | 82 Ų | 82 | 70.4 Ų | 70.4 | 50% | 0.503 | 40% | 0.401 | S | S | . | . | trans | -68.6 | 154.3 | 172.7 | 60.4 | 0 | 0 | 0 | 0 | 111.2 | T78 Q79 Q80 | T76-T78 PolarHBondContact O-N 3.1Å; T76-T78 VanDerWaalsContact O-N 3.13Å; T76-Q79 VanDerWaalsContact N-OE1 3.12Å; T76-Q79 WeakPolarHBondContact O-CA 3.36Å; T76-Q79 WeakPolarHBondContact O-CB 3.44Å; T76-Q79 PolarHBondContact O-N 3.42Å; T76-Q79 WeakPolarHBondContact OG1-CG 3.42Å; T76-Q79 PolarHBondContact OG1-OE1 3.17Å; T76-Q80 WeakPolarHBondContact O-CG 3.47Å; T76-Q80 PolarHBondContact O-N 3.48Å; T76-Q80 VanDerWaalsContact O-N 3.08Å | ||
| 77 | L | 76.9 | Confident | 82.5 | Confident | 127 Ų | 127 | 67.7 Ų | 67.7 | 67% | 0.665 | 39% | 0.387 | S | S | * | . | H | α-helix | trans | -51.9 | -39.5 | -178.8 | -173.2 | 67.3 | 0 | 0 | 0 | 112.8 | Q79 Q80 I81 | L77-Q79 PolarHBondContact O-N 2.87Å; L77-Q80 WeakPolarHBondContact O-CB 3.24Å; L77-Q80 PolarHBondContact O-N 2.89Å; L77-I81 WeakPolarHBondContact O-CG1 3.47Å; L77-I81 PolarHBondContact O-N 2.88Å; L77-I81 VanDerWaalsContact O-N 3.12Å |
| 78 | T | 83.3 | Confident | 82 | Confident | 77 Ų | 77 | 71 Ų | 71 | 47% | 0.472 | 40% | 0.403 | S | S | . | . | H | α-helix | trans | -62 | -41.5 | 176.2 | -49.8 | 0 | 0 | 0 | 0 | 112.5 | T76 Q80 I81 Y82 | T76-T78 PolarHBondContact O-N 3.1Å; T76-T78 VanDerWaalsContact O-N 3.13Å; T78-Q80 VanDerWaalsContact C-N 3.33Å; T78-I81 PolarHBondContact O-N 2.84Å; T78-Y82 HydrophobicContact CG2-CD2 4.26Å; T78-Y82 HydrophobicContact CG2-CE1 4.32Å; T78-Y82 HydrophobicContact CG2-CE2 3.62Å; T78-Y82 PolarHBondContact O-N 3.08Å; T78-Y82 VanDerWaalsContact O-N 3.14Å |
| 79 | Q | 83.8 | Confident | 81.9 | Confident | 99 Ų | 99 | 70 Ų | 70 | 46% | 0.463 | 40% | 0.397 | S | S | . | . | H | α-helix | trans | -67.5 | -35.7 | 177.1 | -69.4 | 173.6 | -38.1 | 0 | 0 | 111.5 | P75 T76 L77 Y82 I83 | P75-Q79 HydrophobicContact CB-CB 4.08Å; T76-Q79 VanDerWaalsContact N-OE1 3.12Å; T76-Q79 WeakPolarHBondContact O-CA 3.36Å; T76-Q79 WeakPolarHBondContact O-CB 3.44Å; T76-Q79 PolarHBondContact O-N 3.42Å; T76-Q79 WeakPolarHBondContact OG1-CG 3.42Å; T76-Q79 PolarHBondContact OG1-OE1 3.17Å; L77-Q79 PolarHBondContact O-N 2.87Å; Q79-Y82 PolarHBondContact O-N 3.42Å; Q79-I83 VanDerWaalsContact O-CG1 3.25Å; Q79-I83 WeakPolarHBondContact O-CG1 3.31Å; Q79-I83 PolarHBondContact O-N 3.18Å |
| 80 | Q | 76.3 | Confident | 81.3 | Confident | 50 Ų | 50 | 68 Ų | 68 | 23% | 0.234 | 38% | 0.375 | C | S | . | . | H | α-helix | trans | -61.7 | -45 | 175.8 | -58.4 | -178.8 | 5.1 | 0 | 0 | 111.4 | P75 T76 L77 T78 Y82 I83 G84 V283 | P75-Q80 HydrophobicContact CB-CG 4.25Å; P75-Q80 HydrophobicContact CG-CG 3.82Å; P75-Q80 PolarHBondContact O-NE2 3.44Å; P75-Q80 VanDerWaalsContact O-NE2 3.15Å; T76-Q80 WeakPolarHBondContact O-CG 3.47Å; T76-Q80 PolarHBondContact O-N 3.48Å; T76-Q80 VanDerWaalsContact O-N 3.08Å; L77-Q80 WeakPolarHBondContact O-CB 3.24Å; L77-Q80 PolarHBondContact O-N 2.89Å; T78-Q80 VanDerWaalsContact C-N 3.33Å; Q80-Y82 PolarHBondContact O-N 3.31Å; Q80-I83 PolarHBondContact O-N 3.11Å; Q80-G84 PolarHBondContact O-N 2.9Å; Q80-G84 VanDerWaalsContact O-N 3.16Å; Q80-V283 HydrophobicContact CB-CG1 4.26Å; Q80-V283 HydrophobicContact CG-CG1 3.56Å |
| 81 | I | 79.4 | Confident | 80.3 | Confident | 100 Ų | 100 | 68.3 Ų | 68.3 | 51% | 0.513 | 38% | 0.376 | S | S | . | . | H | α-helix | trans | -60.8 | -45.3 | 176.5 | -65.8 | 168.3 | 0 | 0 | 0 | 110.8 | L77 T78 I83 G84 F85 | L77-I81 WeakPolarHBondContact O-CG1 3.47Å; L77-I81 PolarHBondContact O-N 2.88Å; L77-I81 VanDerWaalsContact O-N 3.12Å; T78-I81 PolarHBondContact O-N 2.84Å; I81-I83 VanDerWaalsContact C-N 3.32Å; I81-I83 PolarHBondContact O-N 3.03Å; I81-G84 PolarHBondContact O-N 2.76Å; I81-F85 PolarHBondContact O-N 2.75Å |
| 82 | Y | 87.4 | Confident | 80.1 | Confident | 166 Ų | 166 | 71.8 Ų | 71.8 | 65% | 0.651 | 39% | 0.389 | S | S | * | . | H | α-helix | trans | -65.7 | -33.1 | 179.9 | -65.6 | -17.7 | 0 | 0 | 0 | 113.5 | T78 Q79 Q80 G84 F85 | T78-Y82 HydrophobicContact CG2-CD2 4.26Å; T78-Y82 HydrophobicContact CG2-CE1 4.32Å; T78-Y82 HydrophobicContact CG2-CE2 3.62Å; T78-Y82 PolarHBondContact O-N 3.08Å; T78-Y82 VanDerWaalsContact O-N 3.14Å; Q79-Y82 PolarHBondContact O-N 3.42Å; Q80-Y82 PolarHBondContact O-N 3.31Å; Y82-G84 VanDerWaalsContact C-N 3.34Å; Y82-F85 WeakPolarHBondContact O-CB 3.5Å; Y82-F85 PolarHBondContact O-N 3.28Å |
| 83 | I | 83.8 | Confident | 79.7 | Confident | 44 Ų | 44 | 70.3 Ų | 70.3 | 23% | 0.226 | 37% | 0.369 | C | S | . | . | H | α-helix | trans | -67.5 | -37.2 | 174.9 | -70.1 | 169 | 0 | 0 | 0 | 110.9 | V70 Q79 Q80 I81 F85 F276 | V70-I83 HydrophobicContact CB-CD1 4.43Å; V70-I83 HydrophobicContact CG1-CD1 3.5Å; V70-I83 VanDerWaalsContact CG1-CD1 3.5Å; V70-I83 HydrophobicContact CG2-CD1 4.03Å; Q79-I83 VanDerWaalsContact O-CG1 3.25Å; Q79-I83 WeakPolarHBondContact O-CG1 3.31Å; Q79-I83 PolarHBondContact O-N 3.18Å; Q80-I83 PolarHBondContact O-N 3.11Å; I81-I83 VanDerWaalsContact C-N 3.32Å; I81-I83 PolarHBondContact O-N 3.03Å; I83-F85 VanDerWaalsContact C-N 3.28Å; I83-F85 PolarHBondContact O-N 3.41Å; I83-F276 HydrophobicContact CG2-CD1 4.46Å; I83-F276 WeakPolarHBondContact O-CD1 3.38Å |
| 84 | G | 79.3 | Confident | 78.8 | Confident | 16 Ų | 16 | 67.6 Ų | 67.6 | 17% | 0.165 | 34% | 0.343 | C | S | . | . | H | α-helix | trans | -74.7 | -10.2 | 177.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | Q80 I81 Y82 G87 E88 | Q80-G84 PolarHBondContact O-N 2.9Å; Q80-G84 VanDerWaalsContact O-N 3.16Å; I81-G84 PolarHBondContact O-N 2.76Å; Y82-G84 VanDerWaalsContact C-N 3.34Å; G84-G87 CarbonylContact O-C 3.6Å; G84-G87 VanDerWaalsContact O-CA 3.3Å; G84-G87 WeakPolarHBondContact O-CA 3.22Å; G84-G87 PolarHBondContact O-N 3.01Å; G84-E88 PolarHBondContact O-N 2.89Å |
| 85 | F | 86.9 | Confident | 78 | Confident | 104 Ų | 104 | 66.2 Ų | 66.2 | 46% | 0.456 | 32% | 0.324 | S | S | . | . | H | α-helix | trans | -58.9 | -43.5 | -169.5 | -178.6 | -110.7 | 0 | 0 | 0 | 115.5 | I81 Y82 I83 G87 E88 I89 | I81-F85 PolarHBondContact O-N 2.75Å; Y82-F85 WeakPolarHBondContact O-CB 3.5Å; Y82-F85 PolarHBondContact O-N 3.28Å; I83-F85 VanDerWaalsContact C-N 3.28Å; I83-F85 PolarHBondContact O-N 3.41Å; F85-G87 PolarHBondContact O-N 2.9Å; F85-E88 WeakPolarHBondContact O-CB 3.31Å; F85-E88 PolarHBondContact O-N 3.08Å; F85-I89 HydrophobicContact CD1-CD1 4.04Å; F85-I89 HydrophobicContact CE1-CD1 3.52Å; F85-I89 HydrophobicContact CE1-CG1 4.15Å; F85-I89 HydrophobicContact CE2-CG1 4.38Å; F85-I89 HydrophobicContact CZ-CD1 3.85Å; F85-I89 HydrophobicContact CZ-CG1 4.05Å; F85-I89 PolarHBondContact O-N 2.92Å |
| 86 | P | 86.1 | Confident | 78.1 | Confident | 28 Ų | 28 | 70.8 Ų | 70.8 | 18% | 0.182 | 35% | 0.345 | C | S | . | . | H | α-helix | trans | -61 | -31.9 | 174.1 | -22.5 | 34.7 | 0 | 0 | 0 | 112.4 | L90 Y269 F276 | P86-L90 PolarHBondContact O-N 2.95Å; P86-Y269 WeakPolarHBondContact CA-OH 3.34Å; P86-Y269 PolarHBondContact O-OH 3.21Å; P86-F276 HydrophobicContact CB-CB 4.02Å; P86-F276 HydrophobicContact CB-CD2 3.59Å; P86-F276 HydrophobicContact CB-CE2 4.25Å; P86-F276 HydrophobicContact CB-CG 3.93Å; P86-F276 HydrophobicContact CG-CB 4.22Å; P86-F276 HydrophobicContact CG-CD1 4.28Å; P86-F276 HydrophobicContact CG-CD2 3.67Å; P86-F276 HydrophobicContact CG-CE2 4.02Å; P86-F276 HydrophobicContact CG-CG 3.81Å; P86-F276 HydrophobicContact CG-CZ 4.47Å |
| 87 | G | 72.5 | Confident | 77.8 | Confident | 0 Ų | 0 | 67 Ų | 67 | 0% | 0 | 32% | 0.322 | C | S | . | . | H | α-helix | trans | -66.3 | -42.1 | 172 | 0 | 0 | 0 | 0 | 0 | 113.1 | G84 F85 I89 L90 I91 G273 L277 | G84-G87 CarbonylContact O-C 3.6Å; G84-G87 VanDerWaalsContact O-CA 3.3Å; G84-G87 WeakPolarHBondContact O-CA 3.22Å; G84-G87 PolarHBondContact O-N 3.01Å; F85-G87 PolarHBondContact O-N 2.9Å; G87-I89 VanDerWaalsContact C-N 3.35Å; G87-I89 PolarHBondContact O-N 2.93Å; G87-L90 WeakPolarHBondContact O-CB 3.11Å; G87-L90 PolarHBondContact O-N 2.89Å; G87-I91 PolarHBondContact O-N 3.49Å; G87-G273 WeakPolarHBondContact CA-O 3.33Å; G87-L277 VanDerWaalsContact CA-CG 3.49Å |
| 88 | E | 75.6 | Confident | 77.5 | Confident | 69 Ų | 69 | 61.2 Ų | 61.2 | 32% | 0.322 | 29% | 0.292 | S | S | . | . | H | α-helix | trans | -61.5 | -41.3 | 174.8 | -166.4 | -166.3 | 153.2 | 0 | 0 | 112.1 | G84 F85 L90 I91 R92 | G84-E88 PolarHBondContact O-N 2.89Å; F85-E88 WeakPolarHBondContact O-CB 3.31Å; F85-E88 PolarHBondContact O-N 3.08Å; E88-L90 VanDerWaalsContact C-N 3.29Å; E88-L90 PolarHBondContact O-N 3.22Å; E88-I91 PolarHBondContact O-N 2.76Å; E88-I91 VanDerWaalsContact O-N 3.15Å; E88-R92 WeakPolarHBondContact O-CG 3.33Å; E88-R92 PolarHBondContact O-N 3.02Å; E88-R92 IonicContact OE1-CZ 2.91Å; E88-R92 IonicContact OE1-NE 2.92Å; E88-R92 PolarHBondContact OE1-NE 3.37Å; E88-R92 IonicContact OE1-NH2 3.17Å; E88-R92 PolarHBondContact OE1-NH2 3.08Å |
| 89 | I | 82.8 | Confident | 77.3 | Confident | 57 Ų | 57 | 60.1 Ų | 60.1 | 29% | 0.292 | 28% | 0.282 | S | S | . | . | H | α-helix | trans | -57 | -44.4 | 174.6 | -69.3 | 174.1 | 0 | 0 | 0 | 110.6 | F85 G87 I91 R92 L93 Y269 | F85-I89 HydrophobicContact CD1-CD1 4.04Å; F85-I89 HydrophobicContact CE1-CD1 3.52Å; F85-I89 HydrophobicContact CE1-CG1 4.15Å; F85-I89 HydrophobicContact CE2-CG1 4.38Å; F85-I89 HydrophobicContact CZ-CD1 3.85Å; F85-I89 HydrophobicContact CZ-CG1 4.05Å; F85-I89 PolarHBondContact O-N 2.92Å; G87-I89 VanDerWaalsContact C-N 3.35Å; G87-I89 PolarHBondContact O-N 2.93Å; I89-I91 VanDerWaalsContact C-N 3.34Å; I89-I91 PolarHBondContact O-N 3.01Å; I89-R92 PolarHBondContact O-N 3.15Å; I89-L93 HydrophobicContact CG2-CD1 3.91Å; I89-L93 HydrophobicContact CG2-CG 4.25Å; I89-L93 WeakPolarHBondContact O-CG 3.24Å; I89-L93 PolarHBondContact O-N 3Å; I89-Y269 HydrophobicContact CB-CE1 4.35Å; I89-Y269 HydrophobicContact CG2-CE1 3.95Å |
| 90 | L | 75.1 | Confident | 77.2 | Confident | 2 Ų | 2 | 57.1 Ų | 57.1 | 1% | 0.01 | 27% | 0.271 | C | S | . | . | H | α-helix | trans | -57.7 | -48.1 | 176.6 | 177.2 | 63.1 | 0 | 0 | 0 | 110.8 | P86 G87 E88 R92 L93 L94 I266 Y269 A270 I274 L277 L450 | P86-L90 PolarHBondContact O-N 2.95Å; G87-L90 WeakPolarHBondContact O-CB 3.11Å; G87-L90 PolarHBondContact O-N 2.89Å; E88-L90 VanDerWaalsContact C-N 3.29Å; E88-L90 PolarHBondContact O-N 3.22Å; L90-R92 VanDerWaalsContact C-N 3.33Å; L90-R92 PolarHBondContact O-N 3.38Å; L90-L93 PolarHBondContact O-N 3.33Å; L90-L94 HydrophobicContact CD1-CD1 4.26Å; L90-L94 HydrophobicContact CD1-CG 4.22Å; L90-L94 HydrophobicContact CG-CD1 4.12Å; L90-L94 HydrophobicContact CG-CG 4.46Å; L90-L94 VanDerWaalsContact O-CG 3.28Å; L90-L94 WeakPolarHBondContact O-CG 3.17Å; L90-L94 PolarHBondContact O-N 3.18Å; L90-I266 HydrophobicContact CD1-CG2 3.99Å; L90-Y269 HydrophobicContact CB-CD1 4.21Å; L90-Y269 HydrophobicContact CB-CE1 3.91Å; L90-Y269 HydrophobicContact CD1-CD1 4.05Å; L90-A270 HydrophobicContact CD1-CB 4.22Å; L90-A270 HydrophobicContact CD2-CB 4.43Å; L90-I274 HydrophobicContact CD2-CG1 3.92Å; L90-L277 HydrophobicContact CD2-CD1 4.25Å; L90-L450 HydrophobicContact CD2-CD2 3.88Å |
| 91 | I | 66.4 | Low | 77.1 | Confident | 38 Ų | 38 | 55.1 Ų | 55.1 | 20% | 0.195 | 26% | 0.262 | C | S | . | . | H | α-helix | trans | -61.6 | -40.8 | 178.7 | -59.7 | -58.6 | 0 | 0 | 0 | 111.6 | G87 E88 I89 L94 K95 L277 L450 | G87-I91 PolarHBondContact O-N 3.49Å; E88-I91 PolarHBondContact O-N 2.76Å; E88-I91 VanDerWaalsContact O-N 3.15Å; I89-I91 VanDerWaalsContact C-N 3.34Å; I89-I91 PolarHBondContact O-N 3.01Å; I91-L94 PolarHBondContact O-N 3.49Å; I91-K95 HydrophobicContact CG2-CD 4.33Å; I91-K95 HydrophobicContact CG2-CG 4.46Å; I91-K95 WeakPolarHBondContact O-CG 3.14Å; I91-K95 PolarHBondContact O-N 3.31Å; I91-L277 HydrophobicContact CD1-CD1 3.82Å; I91-L277 HydrophobicContact CG1-CD1 4.06Å; I91-L277 HydrophobicContact CG1-CD2 4.21Å; I91-L450 HydrophobicContact CD1-CD2 4.33Å |
| 92 | R | 76.1 | Confident | 76.7 | Confident | 160 Ų | 160 | 50.7 Ų | 50.7 | 60% | 0.604 | 24% | 0.24 | S | C | * | . | H | α-helix | trans | -64.2 | -42.9 | 176.7 | -70.5 | 179.2 | 180 | -143.6 | 2.9 | 112.3 | E88 I89 L90 L94 K95 M96 | E88-R92 WeakPolarHBondContact O-CG 3.33Å; E88-R92 PolarHBondContact O-N 3.02Å; E88-R92 IonicContact OE1-CZ 2.91Å; E88-R92 IonicContact OE1-NE 2.92Å; E88-R92 PolarHBondContact OE1-NE 3.37Å; E88-R92 IonicContact OE1-NH2 3.17Å; E88-R92 PolarHBondContact OE1-NH2 3.08Å; I89-R92 PolarHBondContact O-N 3.15Å; L90-R92 VanDerWaalsContact C-N 3.33Å; L90-R92 PolarHBondContact O-N 3.38Å; R92-L94 VanDerWaalsContact C-N 3.34Å; R92-K95 PolarHBondContact O-N 3.05Å; R92-M96 WeakPolarHBondContact O-CB 3.29Å; R92-M96 PolarHBondContact O-N 3.37Å |
| 93 | L | 76.1 | Confident | 76.4 | Confident | 52 Ų | 52 | 44 Ų | 44 | 27% | 0.272 | 22% | 0.216 | S | C | . | . | H | α-helix | trans | -61.6 | -43.4 | 175.3 | -71.5 | 171.9 | 0 | 0 | 0 | 111.3 | I89 L90 M96 I97 I266 Y269 | I89-L93 HydrophobicContact CG2-CD1 3.91Å; I89-L93 HydrophobicContact CG2-CG 4.25Å; I89-L93 WeakPolarHBondContact O-CG 3.24Å; I89-L93 PolarHBondContact O-N 3Å; L90-L93 PolarHBondContact O-N 3.33Å; L93-M96 HydrophobicContact CD2-CE 4.3Å; L93-M96 PolarHBondContact O-N 2.94Å; L93-I97 PolarHBondContact O-N 3.37Å; L93-I266 HydrophobicContact CB-CD1 4.15Å; L93-I266 HydrophobicContact CB-CG1 4.21Å; L93-I266 HydrophobicContact CB-CG2 4.13Å; L93-Y269 HydrophobicContact CD1-CD1 4.05Å; L93-Y269 HydrophobicContact CD1-CE1 4.38Å |
| 94 | L | 65.3 | Low | 76.4 | Confident | 23 Ų | 23 | 42.2 Ų | 42.2 | 12% | 0.12 | 21% | 0.208 | C | C | . | . | H | α-helix | trans | -64.1 | -42.2 | 175.6 | -67.6 | 177.8 | 0 | 0 | 0 | 111.5 | L90 I91 R92 M96 I97 I98 I266 L430 L450 | L90-L94 HydrophobicContact CD1-CD1 4.26Å; L90-L94 HydrophobicContact CD1-CG 4.22Å; L90-L94 HydrophobicContact CG-CD1 4.12Å; L90-L94 HydrophobicContact CG-CG 4.46Å; L90-L94 VanDerWaalsContact O-CG 3.28Å; L90-L94 WeakPolarHBondContact O-CG 3.17Å; L90-L94 PolarHBondContact O-N 3.18Å; I91-L94 PolarHBondContact O-N 3.49Å; R92-L94 VanDerWaalsContact C-N 3.34Å; L94-M96 PolarHBondContact O-N 3.43Å; L94-I97 HydrophobicContact CD2-CD1 4.28Å; L94-I97 WeakPolarHBondContact O-CG1 3.22Å; L94-I97 PolarHBondContact O-N 2.94Å; L94-I98 WeakPolarHBondContact O-CG1 3.45Å; L94-I266 HydrophobicContact CD2-CG2 3.81Å; L94-I266 HydrophobicContact CG-CG2 4.45Å; L94-L430 HydrophobicContact CB-CD1 3.76Å; L94-L430 HydrophobicContact CD1-CD1 4.34Å; L94-L430 HydrophobicContact CD2-CD1 3.58Å; L94-L430 HydrophobicContact CG-CD1 4.06Å; L94-L450 HydrophobicContact CD1-CD2 4.14Å |
| 95 | K | 63.3 | Low | 76.1 | Confident | 76 Ų | 76 | 42.2 Ų | 42.2 | 33% | 0.33 | 21% | 0.205 | S | C | . | . | H | α-helix | trans | -64.2 | -38 | 176.6 | -75.5 | -174.8 | 176.2 | -167 | 0 | 112.9 | I91 R92 I97 I98 T443 | I91-K95 HydrophobicContact CG2-CD 4.33Å; I91-K95 HydrophobicContact CG2-CG 4.46Å; I91-K95 WeakPolarHBondContact O-CG 3.14Å; I91-K95 PolarHBondContact O-N 3.31Å; R92-K95 PolarHBondContact O-N 3.05Å; K95-I97 VanDerWaalsContact C-N 3.3Å; K95-I97 PolarHBondContact O-N 3.3Å; K95-I98 HydrophobicContact CG-CD1 4.45Å; K95-I98 PolarHBondContact O-N 2.68Å; K95-T443 PolarHBondContact NZ-OG1 3.42Å; K95-T443 VanDerWaalsContact NZ-OG1 3.08Å |
| 96 | M | 80.9 | Confident | 75.5 | Confident | 116 Ų | 116 | 37.5 Ų | 37.5 | 57% | 0.571 | 18% | 0.184 | S | C | * | . | H | α-helix | trans | -60.4 | -36.9 | -180 | -179.2 | -174 | 71.3 | 0 | 0 | 113 | R92 L93 L94 P100 | R92-M96 WeakPolarHBondContact O-CB 3.29Å; R92-M96 PolarHBondContact O-N 3.37Å; L93-M96 HydrophobicContact CD2-CE 4.3Å; L93-M96 PolarHBondContact O-N 2.94Å; L94-M96 PolarHBondContact O-N 3.43Å; M96-P100 WeakPolarHBondContact O-CD 3.49Å |
| 97 | I | 76.4 | Confident | 75.4 | Confident | 3 Ų | 3 | 36.1 Ų | 36.1 | 2% | 0.015 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -81.9 | -12.4 | -177.8 | 56.8 | 163.2 | 0 | 0 | 0 | 113.4 | L93 L94 K95 P100 L101 V263 I266 L430 | L93-I97 PolarHBondContact O-N 3.37Å; L94-I97 HydrophobicContact CD2-CD1 4.28Å; L94-I97 WeakPolarHBondContact O-CG1 3.22Å; L94-I97 PolarHBondContact O-N 2.94Å; K95-I97 VanDerWaalsContact C-N 3.3Å; K95-I97 PolarHBondContact O-N 3.3Å; I97-P100 WeakPolarHBondContact O-CD 3.34Å; I97-P100 WeakPolarHBondContact O-CG 3.18Å; I97-L101 WeakPolarHBondContact O-CB 3.37Å; I97-L101 PolarHBondContact O-N 3.05Å; I97-L101 VanDerWaalsContact O-N 3.1Å; I97-V263 HydrophobicContact CD1-CG2 3.7Å; I97-I266 HydrophobicContact CD1-CD1 4.21Å; I97-I266 HydrophobicContact CG2-CD1 3.62Å; I97-L430 HydrophobicContact CD1-CD1 4.23Å; I97-L430 HydrophobicContact CD1-CD2 3.69Å; I97-L430 HydrophobicContact CG1-CD2 4.05Å |
| 98 | I | 69.9 | Low | 75.7 | Confident | 6 Ų | 6 | 36.5 Ų | 36.5 | 3% | 0.031 | 18% | 0.178 | C | C | . | . | H | α-helix | trans | -62.2 | -54.8 | -173.9 | -69.6 | 172.3 | 0 | 0 | 0 | 111.5 | L94 K95 L101 V102 M222 I224 L430 A433 | L94-I98 WeakPolarHBondContact O-CG1 3.45Å; K95-I98 HydrophobicContact CG-CD1 4.45Å; K95-I98 PolarHBondContact O-N 2.68Å; I98-L101 PolarHBondContact O-N 3.38Å; I98-V102 HydrophobicContact CG2-CG2 3.97Å; I98-V102 VanDerWaalsContact O-CB 3.32Å; I98-V102 WeakPolarHBondContact O-CB 3.39Å; I98-V102 VanDerWaalsContact O-CG2 3.24Å; I98-V102 WeakPolarHBondContact O-CG2 3.22Å; I98-V102 PolarHBondContact O-N 3.13Å; I98-M222 HydrophobicContact CB-CE 4.4Å; I98-M222 HydrophobicContact CD1-CE 4.29Å; I98-M222 HydrophobicContact CG2-CE 4.38Å; I98-I224 HydrophobicContact CG2-CD1 3.99Å; I98-L430 HydrophobicContact CD1-CG 4.48Å; I98-L430 HydrophobicContact CG1-CD2 4.08Å; I98-L430 HydrophobicContact CG1-CG 3.94Å; I98-A433 HydrophobicContact CD1-CB 4.39Å |
| 99 | I | 79.8 | Confident | 75.5 | Confident | 54 Ų | 54 | 34 Ų | 34 | 28% | 0.277 | 17% | 0.171 | S | C | . | . | H | α-helix | trans | -56.6 | -56.2 | -177.4 | -62.2 | 160.2 | 0 | 0 | 0 | 112.1 | L101 V102 V103 A193 M222 L227 | I99-L101 VanDerWaalsContact C-N 3.3Å; I99-L101 PolarHBondContact O-N 2.83Å; I99-V102 PolarHBondContact O-N 3.14Å; I99-V103 HydrophobicContact CG2-CG2 4.46Å; I99-V103 WeakPolarHBondContact O-CB 3.1Å; I99-V103 WeakPolarHBondContact O-CG2 3.47Å; I99-V103 PolarHBondContact O-N 3.37Å; I99-A193 HydrophobicContact CD1-CB 4.08Å; I99-A193 WeakPolarHBondContact CD1-O 3.37Å; I99-M222 HydrophobicContact CD1-SD 3.49Å; I99-M222 WeakPolarHBondContact CD1-SD 3.43Å; I99-M222 HydrophobicContact CG1-SD 3.52Å; I99-M222 VanDerWaalsContact CG1-SD 3.52Å; I99-L227 HydrophobicContact CG2-CD1 4.49Å |
| 100 | P | 81.4 | Confident | 75.2 | Confident | 35 Ų | 35 | 31.8 Ų | 31.8 | 23% | 0.227 | 16% | 0.161 | C | C | . | . | H | α-helix | trans | -61 | -41.1 | -178.7 | 20.3 | -30.8 | 0 | 0 | 0 | 111.9 | M96 I97 C104 F255 T259 | M96-P100 WeakPolarHBondContact O-CD 3.49Å; I97-P100 WeakPolarHBondContact O-CD 3.34Å; I97-P100 WeakPolarHBondContact O-CG 3.18Å; P100-C104 WeakPolarHBondContact O-CB 3.35Å; P100-C104 PolarHBondContact O-N 2.91Å; P100-C104 PolarHBondContact O-SG 3.47Å; P100-F255 HydrophobicContact CB-CE1 3.6Å; P100-F255 HydrophobicContact CB-CZ 4.39Å; P100-T259 HydrophobicContact CB-CG2 4.36Å; P100-T259 HydrophobicContact CG-CG2 4.33Å |
| 101 | L | 74.1 | Confident | 75.5 | Confident | 9 Ų | 9 | 31.9 Ų | 31.9 | 5% | 0.047 | 16% | 0.162 | C | C | . | . | H | α-helix | trans | -65.5 | -51.7 | -179.7 | -174 | 69.6 | 0 | 0 | 0 | 111.5 | I97 I98 I99 S105 N256 T259 M260 L430 | I97-L101 WeakPolarHBondContact O-CB 3.37Å; I97-L101 PolarHBondContact O-N 3.05Å; I97-L101 VanDerWaalsContact O-N 3.1Å; I98-L101 PolarHBondContact O-N 3.38Å; I99-L101 VanDerWaalsContact C-N 3.3Å; I99-L101 PolarHBondContact O-N 2.83Å; L101-S105 WeakPolarHBondContact O-CA 3.38Å; L101-S105 WeakPolarHBondContact O-CB 3.49Å; L101-S105 PolarHBondContact O-N 3.34Å; L101-N256 WeakPolarHBondContact CD1-OD1 3.47Å; L101-T259 HydrophobicContact CB-CG2 4.16Å; L101-T259 HydrophobicContact CD1-CG2 4.3Å; L101-M260 HydrophobicContact CD1-CG 4.46Å; L101-M260 HydrophobicContact CD1-SD 3.65Å; L101-L430 HydrophobicContact CD2-CD2 3.89Å |
| 102 | V | 70.6 | Confident | 75.7 | Confident | 7 Ų | 7 | 33.3 Ų | 33.3 | 4% | 0.042 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -62.3 | -49.5 | -176.5 | 170.4 | 0 | 0 | 0 | 0 | 110.7 | I98 I99 L106 I224 V228 I434 | I98-V102 HydrophobicContact CG2-CG2 3.97Å; I98-V102 VanDerWaalsContact O-CB 3.32Å; I98-V102 WeakPolarHBondContact O-CB 3.39Å; I98-V102 VanDerWaalsContact O-CG2 3.24Å; I98-V102 WeakPolarHBondContact O-CG2 3.22Å; I98-V102 PolarHBondContact O-N 3.13Å; I99-V102 PolarHBondContact O-N 3.14Å; V102-L106 HydrophobicContact CG1-CD1 3.74Å; V102-L106 WeakPolarHBondContact O-CB 3.27Å; V102-L106 VanDerWaalsContact O-CG 3.29Å; V102-L106 WeakPolarHBondContact O-CG 3.47Å; V102-L106 PolarHBondContact O-N 3.36Å; V102-I224 HydrophobicContact CG1-CG2 4.18Å; V102-V228 HydrophobicContact CG1-CG2 3.68Å; V102-I434 HydrophobicContact CG2-CD1 4.29Å |
| 103 | V | 81.9 | Confident | 75.4 | Confident | 25 Ų | 25 | 27.5 Ų | 27.5 | 15% | 0.152 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -66.1 | -49.9 | -177.6 | 176.3 | 0 | 0 | 0 | 0 | 110.5 | I99 V107 L227 F252 | I99-V103 HydrophobicContact CG2-CG2 4.46Å; I99-V103 WeakPolarHBondContact O-CB 3.1Å; I99-V103 WeakPolarHBondContact O-CG2 3.47Å; I99-V103 PolarHBondContact O-N 3.37Å; V103-V107 HydrophobicContact CG1-CG2 4.33Å; V103-V107 WeakPolarHBondContact O-CB 3.46Å; V103-V107 WeakPolarHBondContact O-CG2 3.5Å; V103-V107 PolarHBondContact O-N 3.42Å; V103-L227 HydrophobicContact CG2-CB 4.29Å; V103-F252 HydrophobicContact CG1-CE1 4.45Å |
| 104 | C | 83.1 | Confident | 74.9 | Confident | 7 Ų | 7 | 26.4 Ų | 26.4 | 5% | 0.047 | 15% | 0.15 | C | C | . | . | H | α-helix | trans | -69.3 | -44.2 | -176.4 | -59.3 | 0 | 0 | 0 | 0 | 112.2 | P100 L106 S108 F252 F255 N256 | P100-C104 WeakPolarHBondContact O-CB 3.35Å; P100-C104 PolarHBondContact O-N 2.91Å; P100-C104 PolarHBondContact O-SG 3.47Å; C104-L106 PolarHBondContact O-N 3.07Å; C104-S108 WeakPolarHBondContact O-CB 3.36Å; C104-S108 PolarHBondContact O-N 3.13Å; C104-S108 PolarHBondContact O-OG 3.29Å; C104-S108 VanDerWaalsContact O-OG 3.12Å; C104-F252 HydrophobicContact CB-CD1 4.01Å; C104-F255 HydrophobicContact CB-CD1 4.25Å; C104-F255 WeakPolarHBondContact SG-CD1 3.45Å; C104-N256 HydrophobicContact CB-CB 4.09Å |
| 105 | S | 74.1 | Confident | 74.9 | Confident | 15 Ų | 15 | 29.7 Ų | 29.7 | 11% | 0.105 | 17% | 0.173 | C | C | . | . | H | α-helix | trans | -61.5 | -44.6 | 177.8 | -173.3 | 0 | 0 | 0 | 0 | 111.7 | L101 G109 | L101-S105 WeakPolarHBondContact O-CA 3.38Å; L101-S105 WeakPolarHBondContact O-CB 3.49Å; L101-S105 PolarHBondContact O-N 3.34Å; S105-G109 WeakPolarHBondContact O-CA 3.37Å; S105-G109 PolarHBondContact O-N 3.43Å |
| 106 | L | 74.1 | Confident | 75 | Confident | 5 Ų | 5 | 35.2 Ų | 35.2 | 3% | 0.026 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -72.2 | -39 | 179.7 | -74.5 | 173.3 | 0 | 0 | 0 | 113.4 | V102 C104 S108 G109 A110 V228 A231 I232 V419 G420 | V102-L106 HydrophobicContact CG1-CD1 3.74Å; V102-L106 WeakPolarHBondContact O-CB 3.27Å; V102-L106 VanDerWaalsContact O-CG 3.29Å; V102-L106 WeakPolarHBondContact O-CG 3.47Å; V102-L106 PolarHBondContact O-N 3.36Å; C104-L106 PolarHBondContact O-N 3.07Å; L106-S108 VanDerWaalsContact C-N 3.34Å; L106-G109 PolarHBondContact O-N 3.01Å; L106-A110 WeakPolarHBondContact O-CB 3.4Å; L106-A110 PolarHBondContact O-N 3.44Å; L106-V228 HydrophobicContact CD1-CB 3.88Å; L106-V228 HydrophobicContact CD1-CG1 3.73Å; L106-V228 HydrophobicContact CD1-CG2 3.68Å; L106-A231 HydrophobicContact CB-CB 3.72Å; L106-A231 HydrophobicContact CD1-CB 4.37Å; L106-I232 HydrophobicContact CD2-CG1 4.32Å; L106-V419 HydrophobicContact CD2-CG1 4.28Å; L106-G420 VanDerWaalsContact CD2-CA 3.44Å |
| 107 | V | 84 | Confident | 73.8 | Confident | 0 Ų | 0 | 32.8 Ų | 32.8 | 0% | 0 | 20% | 0.196 | C | C | . | . | H | α-helix | trans | -61.2 | -48.3 | 174.8 | 170.7 | 0 | 0 | 0 | 0 | 109.7 | V103 A111 A231 F234 G235 L238 F252 | V103-V107 HydrophobicContact CG1-CG2 4.33Å; V103-V107 WeakPolarHBondContact O-CB 3.46Å; V103-V107 WeakPolarHBondContact O-CG2 3.5Å; V103-V107 PolarHBondContact O-N 3.42Å; V107-A111 WeakPolarHBondContact O-CB 3.45Å; V107-A111 PolarHBondContact O-N 3.05Å; V107-A231 HydrophobicContact CG2-CB 3.82Å; V107-A231 WeakPolarHBondContact CG2-O 3.22Å; V107-F234 HydrophobicContact CG1-CD1 4.09Å; V107-F234 HydrophobicContact CG2-CD1 3.94Å; V107-G235 WeakPolarHBondContact O-CA 3.26Å; V107-L238 HydrophobicContact CG1-CD1 3.66Å; V107-F252 HydrophobicContact CB-CD1 4.27Å; V107-F252 HydrophobicContact CB-CD2 4.34Å; V107-F252 HydrophobicContact CB-CG 4.14Å; V107-F252 HydrophobicContact CG1-CB 4.25Å; V107-F252 HydrophobicContact CG1-CD1 4.27Å; V107-F252 HydrophobicContact CG1-CD2 3.49Å; V107-F252 VanDerWaalsContact CG1-CD2 3.49Å; V107-F252 HydrophobicContact CG1-CE2 3.86Å; V107-F252 HydrophobicContact CG1-CG 3.74Å; V107-F252 HydrophobicContact CG1-CZ 4.37Å; V107-F252 HydrophobicContact CG2-CE1 4.48Å |
| 108 | S | 78 | Confident | 73.1 | Confident | 7 Ų | 7 | 33.6 Ų | 33.6 | 5% | 0.049 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -61.3 | -46.4 | 176.2 | -76.1 | 0 | 0 | 0 | 0 | 112.9 | C104 L106 A111 S112 F252 N253 | C104-S108 WeakPolarHBondContact O-CB 3.36Å; C104-S108 PolarHBondContact O-N 3.13Å; C104-S108 PolarHBondContact O-OG 3.29Å; C104-S108 VanDerWaalsContact O-OG 3.12Å; L106-S108 VanDerWaalsContact C-N 3.34Å; S108-A111 PolarHBondContact O-N 3.04Å; S108-S112 WeakPolarHBondContact O-CB 3.34Å; S108-S112 PolarHBondContact O-N 3.17Å; S108-F252 WeakPolarHBondContact OG-CB 3.46Å; S108-N253 WeakPolarHBondContact CB-OD1 3.5Å; S108-N253 PolarHBondContact OG-N 2.94Å; S108-N253 PolarHBondContact OG-OD1 3.02Å |
| 109 | G | 72.8 | Confident | 73.1 | Confident | 18 Ų | 18 | 35.4 Ų | 35.4 | 19% | 0.186 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -61.3 | -52.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 111.5 | S105 L106 A111 S112 | S105-G109 WeakPolarHBondContact O-CA 3.37Å; S105-G109 PolarHBondContact O-N 3.43Å; L106-G109 PolarHBondContact O-N 3.01Å; G109-A111 VanDerWaalsContact C-N 3.33Å; G109-A111 PolarHBondContact O-N 3.17Å; G109-S112 PolarHBondContact O-N 2.94Å; G109-S112 PolarHBondContact O-OG 2.85Å |
| 110 | A | 76.8 | Confident | 72.8 | Confident | 9 Ų | 9 | 41.9 Ų | 41.9 | 7% | 0.074 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -64.6 | -35.3 | 178 | 0 | 0 | 0 | 0 | 0 | 112.7 | L106 I113 I232 V236 | L106-A110 WeakPolarHBondContact O-CB 3.4Å; L106-A110 PolarHBondContact O-N 3.44Å; A110-I113 PolarHBondContact O-N 3.43Å; A110-I232 HydrophobicContact CB-CG2 4.38Å; A110-V236 HydrophobicContact CB-CG2 4.39Å |
| 111 | A | 80.4 | Confident | 72.4 | Confident | 4 Ų | 4 | 42.4 Ų | 42.4 | 3% | 0.033 | 25% | 0.247 | C | C | . | . | H | α-helix | trans | -73.5 | -26.1 | 176.5 | 0 | 0 | 0 | 0 | 0 | 113.4 | V107 S108 G109 I113 G235 R239 I249 | V107-A111 WeakPolarHBondContact O-CB 3.45Å; V107-A111 PolarHBondContact O-N 3.05Å; S108-A111 PolarHBondContact O-N 3.04Å; G109-A111 VanDerWaalsContact C-N 3.33Å; G109-A111 PolarHBondContact O-N 3.17Å; A111-I113 PolarHBondContact O-N 3.09Å; A111-G235 WeakPolarHBondContact CA-O 3.47Å; A111-G235 WeakPolarHBondContact CB-O 3.45Å; A111-R239 WeakPolarHBondContact O-CD 3.27Å; A111-I249 HydrophobicContact CB-CD1 3.81Å; A111-I249 HydrophobicContact CB-CG1 3.74Å; A111-I249 HydrophobicContact CB-CG2 4.34Å |
| 112 | S | 70.7 | Confident | 72.5 | Confident | 68 Ų | 68 | 42 Ų | 42 | 48% | 0.476 | 25% | 0.246 | S | C | . | . | H | α-helix | trans | -70.2 | -19.7 | 175.1 | 76.8 | 0 | 0 | 0 | 0 | 113 | S108 G109 D114 | S108-S112 WeakPolarHBondContact O-CB 3.34Å; S108-S112 PolarHBondContact O-N 3.17Å; G109-S112 PolarHBondContact O-N 2.94Å; G109-S112 PolarHBondContact O-OG 2.85Å; S112-D114 PolarHBondContact O-N 3.17Å; S112-D114 VanDerWaalsContact O-N 3.15Å |
| 113 | I | 70 | Confident | 73 | Confident | 39 Ų | 39 | 43.5 Ų | 43.5 | 20% | 0.2 | 26% | 0.262 | C | S | . | . | trans | -77.9 | 98.7 | 175.2 | -59.8 | 172.6 | 0 | 0 | 0 | 108 | A110 A111 P115 L118 M126 | A110-I113 PolarHBondContact O-N 3.43Å; A111-I113 PolarHBondContact O-N 3.09Å; I113-P115 VanDerWaalsContact O-CD 3.31Å; I113-P115 WeakPolarHBondContact O-CD 3.46Å; I113-L118 HydrophobicContact CG2-CD1 3.97Å; I113-L118 HydrophobicContact CG2-CD2 3.6Å; I113-L118 HydrophobicContact CG2-CG 4.42Å; I113-M126 HydrophobicContact CD1-CE 3.81Å; I113-M126 HydrophobicContact CD1-SD 4.25Å | ||
| 114 | D | 65.7 | Low | 73.1 | Confident | 28 Ų | 28 | 49 Ų | 49 | 15% | 0.15 | 28% | 0.28 | C | S | . | . | trans | -85.8 | 112.6 | 173.2 | 179.8 | 5.9 | 0 | 0 | 0 | 111 | S112 K116 A117 L118 R239 | S112-D114 PolarHBondContact O-N 3.17Å; S112-D114 VanDerWaalsContact O-N 3.15Å; D114-K116 PolarHBondContact O-N 3.36Å; D114-K116 VanDerWaalsContact O-N 3.16Å; D114-K116 WeakPolarHBondContact OD1-CB 3.31Å; D114-K116 PolarHBondContact OD1-N 2.97Å; D114-A117 HydrophobicContact CB-CB 3.85Å; D114-A117 VanDerWaalsContact CG-N 3.26Å; D114-A117 PolarHBondContact O-N 3.45Å; D114-A117 PolarHBondContact OD1-N 3.29Å; D114-A117 WeakPolarHBondContact OD2-CB 3.43Å; D114-A117 PolarHBondContact OD2-N 3.02Å; D114-L118 WeakPolarHBondContact O-CB 3.27Å; D114-L118 WeakPolarHBondContact O-CD1 3.44Å; D114-L118 PolarHBondContact O-N 2.93Å; D114-R239 IonicContact OD1-CZ 4Å; D114-R239 IonicContact OD1-NE 2.74Å; D114-R239 IonicContact OD1-NH2 3.74Å; D114-R239 IonicContact OD2-CZ 3.72Å; D114-R239 IonicContact OD2-NE 3.99Å; D114-R239 IonicContact OD2-NH2 3.67Å; D114-R239 PolarHBondContact OD2-NH2 3.35Å | ||
| 115 | P | 64.8 | Low | 73.1 | Confident | 93 Ų | 93 | 49 Ų | 49 | 60% | 0.604 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -60.7 | -27.6 | 178.1 | -20.2 | 32.8 | 0 | 0 | 0 | 113.4 | I113 | I113-P115 VanDerWaalsContact O-CD 3.31Å; I113-P115 WeakPolarHBondContact O-CD 3.46Å |
| 116 | K | 64.6 | Low | 73.6 | Confident | 192 Ų | 192 | 49.5 Ų | 49.5 | 84% | 0.835 | 28% | 0.281 | S | S | * | . | H | α-helix | trans | -81.4 | -42.9 | 179.9 | -68 | -179.6 | 179.2 | 177 | 0 | 111.8 | D114 G119 | D114-K116 PolarHBondContact O-N 3.36Å; D114-K116 VanDerWaalsContact O-N 3.16Å; D114-K116 WeakPolarHBondContact OD1-CB 3.31Å; D114-K116 PolarHBondContact OD1-N 2.97Å; K116-G119 PolarHBondContact O-N 2.95Å |
| 117 | A | 57.2 | Low | 74.3 | Confident | 65 Ų | 65 | 53.7 Ų | 53.7 | 54% | 0.537 | 30% | 0.303 | S | S | . | . | H | α-helix | trans | -79.8 | -26.2 | 176.3 | 0 | 0 | 0 | 0 | 0 | 113.8 | D114 G119 | D114-A117 HydrophobicContact CB-CB 3.85Å; D114-A117 VanDerWaalsContact CG-N 3.26Å; D114-A117 PolarHBondContact O-N 3.45Å; D114-A117 PolarHBondContact OD1-N 3.29Å; D114-A117 WeakPolarHBondContact OD2-CB 3.43Å; D114-A117 PolarHBondContact OD2-N 3.02Å; A117-G119 PolarHBondContact O-N 3.29Å |
| 118 | L | 61.1 | Low | 74.7 | Confident | 20 Ų | 20 | 54.9 Ų | 54.9 | 11% | 0.105 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -58.6 | -36.2 | 169.1 | -105.9 | 62.7 | 0 | 0 | 0 | 109.7 | I113 D114 L121 G122 M126 F370 | I113-L118 HydrophobicContact CG2-CD1 3.97Å; I113-L118 HydrophobicContact CG2-CD2 3.6Å; I113-L118 HydrophobicContact CG2-CG 4.42Å; D114-L118 WeakPolarHBondContact O-CB 3.27Å; D114-L118 WeakPolarHBondContact O-CD1 3.44Å; D114-L118 PolarHBondContact O-N 2.93Å; L118-L121 PolarHBondContact O-N 3.44Å; L118-G122 WeakPolarHBondContact O-CA 3.43Å; L118-G122 PolarHBondContact O-N 3Å; L118-M126 HydrophobicContact CD2-CG 3.83Å; L118-F370 HydrophobicContact CD1-CZ 3.79Å; L118-F370 HydrophobicContact CG-CZ 4.33Å |
| 119 | G | 69.4 | Low | 75.3 | Confident | 44 Ų | 44 | 54.7 Ų | 54.7 | 45% | 0.454 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | 50.6 | -156.8 | -175.8 | 0 | 0 | 0 | 0 | 0 | 112.1 | K116 A117 L121 | K116-G119 PolarHBondContact O-N 2.95Å; A117-G119 PolarHBondContact O-N 3.29Å; G119-L121 VanDerWaalsContact C-N 3.26Å; G119-L121 PolarHBondContact O-N 3.06Å |
| 120 | K | 75.1 | Confident | 76.1 | Confident | 190 Ų | 190 | 58.5 Ų | 58.5 | 83% | 0.826 | 32% | 0.318 | S | S | * | . | H | α-helix | trans | -65.3 | -33.9 | 172.4 | -67.4 | 179.9 | -178.1 | 173.6 | 0 | 111.5 | W124 | K120-W124 PolarHBondContact O-N 3.25Å |
| 121 | L | 72.9 | Confident | 77 | Confident | 45 Ų | 45 | 61.3 Ų | 61.3 | 24% | 0.236 | 34% | 0.335 | C | S | . | . | H | α-helix | trans | -69.5 | -51.7 | -169.9 | -170.5 | 63.3 | 0 | 0 | 0 | 113 | L118 G119 G123 W124 A125 I367 L475 V479 | L118-L121 PolarHBondContact O-N 3.44Å; G119-L121 VanDerWaalsContact C-N 3.26Å; G119-L121 PolarHBondContact O-N 3.06Å; L121-G123 VanDerWaalsContact C-N 3.3Å; L121-G123 PolarHBondContact O-N 3.48Å; L121-W124 WeakPolarHBondContact O-CB 3.47Å; L121-W124 PolarHBondContact O-N 3Å; L121-A125 PolarHBondContact O-N 2.75Å; L121-I367 HydrophobicContact CD2-CG1 4.46Å; L121-L475 HydrophobicContact CD1-CD1 3.68Å; L121-L475 HydrophobicContact CD1-CD2 4.01Å; L121-L475 HydrophobicContact CD1-CG 3.52Å; L121-L475 HydrophobicContact CD2-CD2 4.39Å; L121-L475 HydrophobicContact CG-CD1 4.25Å; L121-L475 HydrophobicContact CG-CD2 3.79Å; L121-L475 HydrophobicContact CG-CG 3.91Å; L121-L475 WeakPolarHBondContact O-CD1 3.38Å; L121-V479 HydrophobicContact CD1-CG2 3.31Å; L121-V479 HydrophobicContact CD2-CG2 3.72Å; L121-V479 HydrophobicContact CG-CG2 4.16Å |
| 122 | G | 74.9 | Confident | 77.6 | Confident | 2 Ų | 2 | 61.2 Ų | 61.2 | 2% | 0.021 | 33% | 0.333 | C | S | . | . | H | α-helix | trans | -70.4 | -25.3 | 177.2 | 0 | 0 | 0 | 0 | 0 | 113.2 | L118 A125 M126 | L118-G122 WeakPolarHBondContact O-CA 3.43Å; L118-G122 PolarHBondContact O-N 3Å; G122-A125 WeakPolarHBondContact O-CB 3.5Å; G122-A125 PolarHBondContact O-N 3.09Å; G122-M126 WeakPolarHBondContact O-CG 3.39Å; G122-M126 PolarHBondContact O-N 3.47Å |
| 123 | G | 81.7 | Confident | 78.8 | Confident | 37 Ų | 37 | 58.1 Ų | 58.1 | 38% | 0.381 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -60.7 | -43.9 | 168.2 | 0 | 0 | 0 | 0 | 0 | 112.7 | L121 A125 M126 L127 | L121-G123 VanDerWaalsContact C-N 3.3Å; L121-G123 PolarHBondContact O-N 3.48Å; G123-A125 VanDerWaalsContact C-N 3.33Å; G123-A125 PolarHBondContact O-N 3.44Å; G123-M126 PolarHBondContact O-N 2.92Å; G123-L127 WeakPolarHBondContact O-CB 3.29Å; G123-L127 PolarHBondContact O-N 2.8Å |
| 124 | W | 83.9 | Confident | 79.9 | Confident | 142 Ų | 142 | 59.9 Ų | 59.9 | 54% | 0.538 | 32% | 0.321 | S | S | . | . | H | α-helix | trans | -63.5 | -37.3 | 172.6 | -78.6 | 109.1 | 0 | 0 | 0 | 112.7 | K120 L121 L127 F128 L475 | K120-W124 PolarHBondContact O-N 3.25Å; L121-W124 WeakPolarHBondContact O-CB 3.47Å; L121-W124 PolarHBondContact O-N 3Å; W124-L127 HydrophobicContact CE3-CD2 4.07Å; W124-L127 HydrophobicContact CZ3-CD2 4.01Å; W124-L127 PolarHBondContact O-N 2.84Å; W124-F128 WeakPolarHBondContact O-CB 3.32Å; W124-F128 PolarHBondContact O-N 2.91Å; W124-L475 HydrophobicContact CB-CD1 4Å |
| 125 | A | 83.8 | Confident | 81.4 | Confident | 7 Ų | 7 | 61.2 Ų | 61.2 | 6% | 0.058 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -65.1 | -45.6 | 176.6 | 0 | 0 | 0 | 0 | 0 | 112.5 | L121 G122 G123 L127 F128 F129 I371 L475 | L121-A125 PolarHBondContact O-N 2.75Å; G122-A125 WeakPolarHBondContact O-CB 3.5Å; G122-A125 PolarHBondContact O-N 3.09Å; G123-A125 VanDerWaalsContact C-N 3.33Å; G123-A125 PolarHBondContact O-N 3.44Å; A125-L127 VanDerWaalsContact C-N 3.33Å; A125-L127 PolarHBondContact O-N 3.16Å; A125-F128 WeakPolarHBondContact O-CB 3.47Å; A125-F128 PolarHBondContact O-N 3.27Å; A125-F129 WeakPolarHBondContact O-CG 3.31Å; A125-F129 PolarHBondContact O-N 3.12Å; A125-I371 HydrophobicContact CB-CD1 3.43Å; A125-I371 VanDerWaalsContact CB-CD1 3.43Å; A125-L475 HydrophobicContact CB-CD1 4.38Å; A125-L475 HydrophobicContact CB-CD2 3.89Å |
| 126 | M | 84.3 | Confident | 82.9 | Confident | 25 Ų | 25 | 56.8 Ų | 56.8 | 12% | 0.123 | 30% | 0.299 | C | S | . | . | H | α-helix | trans | -62.3 | -42.1 | 176 | -70.4 | -58.7 | -58.5 | 0 | 0 | 111.6 | I113 L118 G122 G123 F128 F129 F130 I374 V378 | I113-M126 HydrophobicContact CD1-CE 3.81Å; I113-M126 HydrophobicContact CD1-SD 4.25Å; L118-M126 HydrophobicContact CD2-CG 3.83Å; G122-M126 WeakPolarHBondContact O-CG 3.39Å; G122-M126 PolarHBondContact O-N 3.47Å; G123-M126 PolarHBondContact O-N 2.92Å; M126-F128 VanDerWaalsContact C-N 3.31Å; M126-F128 PolarHBondContact O-N 3.4Å; M126-F129 PolarHBondContact O-N 3.41Å; M126-F129 HydrophobicContact SD-CD2 4.38Å; M126-F130 HydrophobicContact CE-CD2 4.31Å; M126-F130 HydrophobicContact CE-CE2 3.55Å; M126-F130 HydrophobicContact CE-CZ 4.12Å; M126-F130 WeakPolarHBondContact O-CD2 3.47Å; M126-F130 PolarHBondContact O-N 3.3Å; M126-I374 HydrophobicContact SD-CG2 4.5Å; M126-V378 HydrophobicContact CE-CG1 3.8Å; M126-V378 HydrophobicContact SD-CG1 4.32Å |
| 127 | L | 89.3 | Confident | 84.3 | Confident | 92 Ų | 92 | 47.7 Ų | 47.7 | 48% | 0.482 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -60.7 | -43.4 | 175.2 | -179.3 | 64.4 | 0 | 0 | 0 | 111.2 | G123 W124 A125 V131 | G123-L127 WeakPolarHBondContact O-CB 3.29Å; G123-L127 PolarHBondContact O-N 2.8Å; W124-L127 HydrophobicContact CE3-CD2 4.07Å; W124-L127 HydrophobicContact CZ3-CD2 4.01Å; W124-L127 PolarHBondContact O-N 2.84Å; A125-L127 VanDerWaalsContact C-N 3.33Å; A125-L127 PolarHBondContact O-N 3.16Å; L127-V131 HydrophobicContact CD1-CG2 4.05Å; L127-V131 HydrophobicContact CG-CG2 4.39Å; L127-V131 WeakPolarHBondContact O-CB 2.89Å; L127-V131 WeakPolarHBondContact O-CG2 3.5Å; L127-V131 PolarHBondContact O-N 3.08Å |
| 128 | F | 91.6 | Very high | 86.2 | Confident | 26 Ų | 26 | 46.8 Ų | 46.8 | 11% | 0.114 | 25% | 0.249 | C | C | . | . | H | α-helix | trans | -57.5 | -51.9 | 175.4 | 171.1 | -96.9 | 0 | 0 | 0 | 111 | W124 A125 M126 F130 V131 T132 I317 F470 L474 | W124-F128 WeakPolarHBondContact O-CB 3.32Å; W124-F128 PolarHBondContact O-N 2.91Å; A125-F128 WeakPolarHBondContact O-CB 3.47Å; A125-F128 PolarHBondContact O-N 3.27Å; M126-F128 VanDerWaalsContact C-N 3.31Å; M126-F128 PolarHBondContact O-N 3.4Å; F128-F130 PolarHBondContact O-N 2.88Å; F128-V131 PolarHBondContact O-N 3.36Å; F128-T132 HydrophobicContact CD1-CG2 4.45Å; F128-T132 HydrophobicContact CD2-CG2 4.01Å; F128-T132 HydrophobicContact CE1-CG2 4.05Å; F128-T132 HydrophobicContact CE2-CG2 3.58Å; F128-T132 HydrophobicContact CG-CG2 4.43Å; F128-T132 HydrophobicContact CZ-CG2 3.61Å; F128-T132 WeakPolarHBondContact O-CG2 3.28Å; F128-T132 PolarHBondContact O-N 3.3Å; F128-T132 PolarHBondContact O-OG1 3.16Å; F128-T132 VanDerWaalsContact O-OG1 3.08Å; F128-I317 HydrophobicContact CE2-CG2 4.02Å; F128-F470 HydrophobicContact CZ-CB 4.44Å; F128-L474 HydrophobicContact CD2-CD2 3.43Å; F128-L474 VanDerWaalsContact CD2-CD2 3.43Å; F128-L474 HydrophobicContact CE2-CD2 3.7Å; F128-L474 HydrophobicContact CG-CD2 4.17Å |
| 129 | F | 91 | Very high | 87.8 | Confident | 3 Ų | 3 | 47.1 Ų | 47.1 | 1% | 0.013 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -58.4 | -49.1 | 179.3 | -63.8 | -28.3 | 0 | 0 | 0 | 112.9 | A125 M126 V131 T132 T133 I371 V378 N379 | A125-F129 WeakPolarHBondContact O-CG 3.31Å; A125-F129 PolarHBondContact O-N 3.12Å; M126-F129 PolarHBondContact O-N 3.41Å; M126-F129 HydrophobicContact SD-CD2 4.38Å; F129-V131 VanDerWaalsContact C-N 3.3Å; F129-V131 PolarHBondContact O-N 3.2Å; F129-T132 WeakPolarHBondContact CA-OG1 3.5Å; F129-T132 PolarHBondContact O-N 3.39Å; F129-T132 PolarHBondContact O-OG1 3.45Å; F129-T133 WeakPolarHBondContact O-CB 3.49Å; F129-T133 PolarHBondContact O-N 2.77Å; F129-T133 PolarHBondContact O-OG1 2.9Å; F129-I371 HydrophobicContact CE2-CG2 4.45Å; F129-I371 HydrophobicContact CZ-CG2 3.69Å; F129-V378 HydrophobicContact CD2-CG1 4.37Å; F129-N379 HydrophobicContact CB-CB 3.98Å; F129-N379 HydrophobicContact CD1-CB 3.47Å; F129-N379 VanDerWaalsContact CD1-CB 3.47Å; F129-N379 WeakPolarHBondContact CD1-OD1 3.37Å; F129-N379 HydrophobicContact CD2-CB 4.02Å; F129-N379 HydrophobicContact CE1-CB 3.81Å; F129-N379 HydrophobicContact CE2-CB 4.31Å; F129-N379 HydrophobicContact CG-CB 3.59Å; F129-N379 HydrophobicContact CZ-CB 4.2Å |
| 130 | F | 90.1 | Very high | 89.1 | Confident | 97 Ų | 97 | 45 Ų | 45 | 43% | 0.425 | 23% | 0.229 | S | C | . | . | H | α-helix | trans | -61.3 | -39.7 | 178 | -79.8 | -62.4 | 0 | 0 | 0 | 112.5 | M126 F128 L134 V419 | M126-F130 HydrophobicContact CE-CD2 4.31Å; M126-F130 HydrophobicContact CE-CE2 3.55Å; M126-F130 HydrophobicContact CE-CZ 4.12Å; M126-F130 WeakPolarHBondContact O-CD2 3.47Å; M126-F130 PolarHBondContact O-N 3.3Å; F128-F130 PolarHBondContact O-N 2.88Å; F130-L134 VanDerWaalsContact O-CB 3.25Å; F130-L134 WeakPolarHBondContact O-CB 3.21Å; F130-L134 PolarHBondContact O-N 3.5Å; F130-V419 HydrophobicContact CE1-CG2 4.18Å |
| 131 | V | 93.8 | Very high | 90 | Very high | 69 Ų | 69 | 36.4 Ų | 36.4 | 42% | 0.418 | 19% | 0.193 | S | C | . | . | H | α-helix | trans | -70.1 | -43.8 | 179.6 | 171 | 0 | 0 | 0 | 0 | 111.2 | L127 F128 F129 L134 I135 | L127-V131 HydrophobicContact CD1-CG2 4.05Å; L127-V131 HydrophobicContact CG-CG2 4.39Å; L127-V131 WeakPolarHBondContact O-CB 2.89Å; L127-V131 WeakPolarHBondContact O-CG2 3.5Å; L127-V131 PolarHBondContact O-N 3.08Å; F128-V131 PolarHBondContact O-N 3.36Å; F129-V131 VanDerWaalsContact C-N 3.3Å; F129-V131 PolarHBondContact O-N 3.2Å; V131-L134 PolarHBondContact O-N 3.4Å; V131-I135 HydrophobicContact CG1-CD1 3.76Å; V131-I135 HydrophobicContact CG1-CG1 4.49Å; V131-I135 WeakPolarHBondContact O-CB 3.41Å; V131-I135 WeakPolarHBondContact O-CD1 3.34Å; V131-I135 WeakPolarHBondContact O-CG1 3.21Å; V131-I135 PolarHBondContact O-N 2.9Å |
| 132 | T | 95.1 | Very high | 91.1 | Very high | 1 Ų | 1 | 38.1 Ų | 38.1 | 1% | 0.006 | 21% | 0.205 | C | C | . | . | H | α-helix | trans | -63.9 | -43.6 | 178.4 | 49.8 | 0 | 0 | 0 | 0 | 111.3 | F128 F129 L134 I135 A136 L314 I317 N379 D381 | F128-T132 HydrophobicContact CD1-CG2 4.45Å; F128-T132 HydrophobicContact CD2-CG2 4.01Å; F128-T132 HydrophobicContact CE1-CG2 4.05Å; F128-T132 HydrophobicContact CE2-CG2 3.58Å; F128-T132 HydrophobicContact CG-CG2 4.43Å; F128-T132 HydrophobicContact CZ-CG2 3.61Å; F128-T132 WeakPolarHBondContact O-CG2 3.28Å; F128-T132 PolarHBondContact O-N 3.3Å; F128-T132 PolarHBondContact O-OG1 3.16Å; F128-T132 VanDerWaalsContact O-OG1 3.08Å; F129-T132 WeakPolarHBondContact CA-OG1 3.5Å; F129-T132 PolarHBondContact O-N 3.39Å; F129-T132 PolarHBondContact O-OG1 3.45Å; T132-L134 PolarHBondContact O-N 3.46Å; T132-I135 PolarHBondContact O-N 2.91Å; T132-A136 WeakPolarHBondContact O-CB 3.27Å; T132-A136 PolarHBondContact O-N 2.9Å; T132-L314 HydrophobicContact CG2-CD2 3.76Å; T132-I317 HydrophobicContact CG2-CD1 4.24Å; T132-N379 PolarHBondContact OG1-OD1 3.27Å; T132-D381 VanDerWaalsContact C-OD1 3.3Å; T132-D381 PolarHBondContact OG1-OD1 2.92Å |
| 133 | T | 93.8 | Very high | 92 | Very high | 3 Ų | 3 | 39.2 Ų | 39.2 | 2% | 0.018 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -67.1 | -37.5 | 179.7 | -58.3 | 0 | 0 | 0 | 0 | 112 | F129 A136 S137 D381 A384 T415 S418 | F129-T133 WeakPolarHBondContact O-CB 3.49Å; F129-T133 PolarHBondContact O-N 2.77Å; F129-T133 PolarHBondContact O-OG1 2.9Å; T133-A136 WeakPolarHBondContact O-CB 3.43Å; T133-A136 PolarHBondContact O-N 3.36Å; T133-S137 WeakPolarHBondContact O-CB 3.23Å; T133-S137 PolarHBondContact O-N 2.91Å; T133-S137 PolarHBondContact O-OG 3.41Å; T133-D381 WeakPolarHBondContact CA-OD1 3.37Å; T133-D381 WeakPolarHBondContact CB-OD1 3.41Å; T133-D381 PolarHBondContact N-OD1 3.24Å; T133-D381 PolarHBondContact OG1-OD1 3.15Å; T133-A384 HydrophobicContact CG2-CB 3.58Å; T133-T415 HydrophobicContact CG2-CG2 3.92Å; T133-S418 WeakPolarHBondContact CG2-OG 3.46Å |
| 134 | L | 94.6 | Very high | 92.5 | Very high | 76 Ų | 76 | 37.4 Ų | 37.4 | 40% | 0.398 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -65.1 | -40.4 | 174.1 | -168 | 73 | 0 | 0 | 0 | 111.6 | F130 V131 T132 S138 L411 | F130-L134 VanDerWaalsContact O-CB 3.25Å; F130-L134 WeakPolarHBondContact O-CB 3.21Å; F130-L134 PolarHBondContact O-N 3.5Å; V131-L134 PolarHBondContact O-N 3.4Å; T132-L134 PolarHBondContact O-N 3.46Å; L134-S138 WeakPolarHBondContact O-CB 3.12Å; L134-S138 PolarHBondContact O-N 3.34Å; L134-S138 PolarHBondContact O-OG 3.17Å; L134-L411 HydrophobicContact CD1-CD2 3.27Å; L134-L411 HydrophobicContact CD1-CG 4.41Å; L134-L411 HydrophobicContact CG-CD2 4.13Å |
| 135 | I | 96.3 | Very high | 92.9 | Very high | 57 Ų | 57 | 34.5 Ų | 34.5 | 29% | 0.292 | 18% | 0.182 | S | C | . | . | H | α-helix | trans | -65.4 | -43.7 | 174.8 | -68.7 | 166.4 | 0 | 0 | 0 | 110.2 | V131 T132 S137 S138 I139 V313 I317 | V131-I135 HydrophobicContact CG1-CD1 3.76Å; V131-I135 HydrophobicContact CG1-CG1 4.49Å; V131-I135 WeakPolarHBondContact O-CB 3.41Å; V131-I135 WeakPolarHBondContact O-CD1 3.34Å; V131-I135 WeakPolarHBondContact O-CG1 3.21Å; V131-I135 PolarHBondContact O-N 2.9Å; T132-I135 PolarHBondContact O-N 2.91Å; I135-S137 PolarHBondContact O-N 3.29Å; I135-S138 WeakPolarHBondContact O-CB 3.49Å; I135-S138 PolarHBondContact O-N 3.1Å; I135-I139 HydrophobicContact CG2-CD1 3.84Å; I135-I139 HydrophobicContact CG2-CG1 4.46Å; I135-I139 VanDerWaalsContact O-CG1 3.28Å; I135-I139 WeakPolarHBondContact O-CG1 3.37Å; I135-I139 PolarHBondContact O-N 3.3Å; I135-V313 HydrophobicContact CG2-CG1 3.78Å; I135-I317 HydrophobicContact CD1-CD1 4.25Å |
| 136 | A | 96.4 | Very high | 93.3 | Very high | 0 Ų | 0 | 39.9 Ų | 39.9 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -58.7 | -47.8 | 177 | 0 | 0 | 0 | 0 | 0 | 111.8 | T132 T133 S138 I139 G140 H309 D381 L385 | T132-A136 WeakPolarHBondContact O-CB 3.27Å; T132-A136 PolarHBondContact O-N 2.9Å; T133-A136 WeakPolarHBondContact O-CB 3.43Å; T133-A136 PolarHBondContact O-N 3.36Å; A136-S138 VanDerWaalsContact C-N 3.34Å; A136-S138 PolarHBondContact O-N 3.21Å; A136-I139 PolarHBondContact O-N 2.84Å; A136-G140 PolarHBondContact O-N 3.4Å; A136-H309 WeakPolarHBondContact CB-NE2 3.39Å; A136-D381 HydrophobicContact CB-CB 3.97Å; A136-D381 WeakPolarHBondContact CB-O 3.5Å; A136-L385 HydrophobicContact CB-CB 4.34Å; A136-L385 WeakPolarHBondContact O-CG 3.47Å |
| 137 | S | 94.9 | Very high | 93.7 | Very high | 0 Ų | 0 | 41.1 Ų | 41.1 | 0% | 0 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -59.4 | -44.8 | 175.9 | -58.4 | 0 | 0 | 0 | 0 | 111.4 | T133 I135 I139 G140 V141 A384 T415 | T133-S137 WeakPolarHBondContact O-CB 3.23Å; T133-S137 PolarHBondContact O-N 2.91Å; T133-S137 PolarHBondContact O-OG 3.41Å; I135-S137 PolarHBondContact O-N 3.29Å; S137-I139 PolarHBondContact O-N 3.46Å; S137-G140 PolarHBondContact O-N 3.21Å; S137-V141 PolarHBondContact O-N 3.49Å; S137-A384 VanDerWaalsContact OG-CB 3.3Å; S137-A384 WeakPolarHBondContact OG-CB 3.49Å; S137-T415 PolarHBondContact OG-OG1 2.96Å |
| 138 | S | 95.8 | Very high | 93.8 | Very high | 46 Ų | 46 | 41.7 Ų | 41.7 | 32% | 0.322 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -59.6 | -44.8 | 176.5 | -56.6 | 0 | 0 | 0 | 0 | 111.8 | L134 I135 A136 G140 V141 V142 | L134-S138 WeakPolarHBondContact O-CB 3.12Å; L134-S138 PolarHBondContact O-N 3.34Å; L134-S138 PolarHBondContact O-OG 3.17Å; I135-S138 WeakPolarHBondContact O-CB 3.49Å; I135-S138 PolarHBondContact O-N 3.1Å; A136-S138 VanDerWaalsContact C-N 3.34Å; A136-S138 PolarHBondContact O-N 3.21Å; S138-G140 VanDerWaalsContact C-N 3.33Å; S138-G140 PolarHBondContact O-N 3.29Å; S138-V141 PolarHBondContact O-N 3.32Å; S138-V142 WeakPolarHBondContact O-CB 3.49Å; S138-V142 VanDerWaalsContact O-CG2 3.25Å; S138-V142 WeakPolarHBondContact O-CG2 3.44Å; S138-V142 PolarHBondContact O-N 2.94Å |
| 139 | I | 96.3 | Very high | 93.5 | Very high | 28 Ų | 28 | 40.5 Ų | 40.5 | 14% | 0.144 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -61.1 | -44.5 | 176 | -67.5 | 161.9 | 0 | 0 | 0 | 110 | I135 A136 S137 V141 V142 M143 I308 H309 V313 L385 | I135-I139 HydrophobicContact CG2-CD1 3.84Å; I135-I139 HydrophobicContact CG2-CG1 4.46Å; I135-I139 VanDerWaalsContact O-CG1 3.28Å; I135-I139 WeakPolarHBondContact O-CG1 3.37Å; I135-I139 PolarHBondContact O-N 3.3Å; A136-I139 PolarHBondContact O-N 2.84Å; S137-I139 PolarHBondContact O-N 3.46Å; I139-V141 PolarHBondContact O-N 2.86Å; I139-V142 PolarHBondContact O-N 3.2Å; I139-M143 HydrophobicContact CG2-CG 3.98Å; I139-M143 VanDerWaalsContact O-CB 3.29Å; I139-M143 WeakPolarHBondContact O-CB 3.49Å; I139-M143 WeakPolarHBondContact O-CG 3.2Å; I139-M143 PolarHBondContact O-N 2.94Å; I139-I308 HydrophobicContact CG2-CG2 4.43Å; I139-H309 HydrophobicContact CD1-CB 4.01Å; I139-V313 HydrophobicContact CD1-CB 4.49Å; I139-V313 HydrophobicContact CD1-CG2 3.82Å; I139-L385 HydrophobicContact CB-CD1 4.37Å; I139-L385 HydrophobicContact CG2-CD1 4.1Å |
| 140 | G | 95.4 | Very high | 93.1 | Very high | 0 Ų | 0 | 40.4 Ų | 40.4 | 0% | 0 | 21% | 0.209 | C | C | . | . | H | α-helix | trans | -56.7 | -51 | 178.1 | 0 | 0 | 0 | 0 | 0 | 112.6 | A136 S137 S138 M143 A144 V389 | A136-G140 PolarHBondContact O-N 3.4Å; S137-G140 PolarHBondContact O-N 3.21Å; S138-G140 VanDerWaalsContact C-N 3.33Å; S138-G140 PolarHBondContact O-N 3.29Å; G140-M143 PolarHBondContact O-N 3.37Å; G140-A144 WeakPolarHBondContact O-CB 3.33Å; G140-A144 PolarHBondContact O-N 3.4Å; G140-V389 WeakPolarHBondContact O-CG2 3.14Å |
| 141 | V | 94.5 | Very high | 92.4 | Very high | 9 Ų | 9 | 40.2 Ų | 40.2 | 6% | 0.055 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -58.9 | -50.6 | 176.5 | 172.8 | 0 | 0 | 0 | 0 | 111.3 | S137 S138 I139 M143 A144 F145 C388 V407 I410 | S137-V141 PolarHBondContact O-N 3.49Å; S138-V141 PolarHBondContact O-N 3.32Å; I139-V141 PolarHBondContact O-N 2.86Å; V141-M143 PolarHBondContact O-N 3.12Å; V141-A144 PolarHBondContact O-N 3.15Å; V141-F145 HydrophobicContact CG1-CD2 3.67Å; V141-F145 HydrophobicContact CG1-CE2 3.62Å; V141-F145 VanDerWaalsContact O-CD2 3.26Å; V141-F145 WeakPolarHBondContact O-CD2 3.43Å; V141-F145 PolarHBondContact O-N 2.92Å; V141-C388 HydrophobicContact CG2-CB 3.74Å; V141-V407 HydrophobicContact CG1-CG1 3.66Å; V141-I410 HydrophobicContact CG2-CG2 4.32Å |
| 142 | V | 95.2 | Very high | 91.1 | Very high | 81 Ų | 81 | 38.1 Ų | 38.1 | 49% | 0.491 | 20% | 0.2 | S | C | . | . | H | α-helix | trans | -60.7 | -46.1 | -178.1 | 169.4 | 0 | 0 | 0 | 0 | 111 | S138 I139 A144 F145 I146 | S138-V142 WeakPolarHBondContact O-CB 3.49Å; S138-V142 VanDerWaalsContact O-CG2 3.25Å; S138-V142 WeakPolarHBondContact O-CG2 3.44Å; S138-V142 PolarHBondContact O-N 2.94Å; I139-V142 PolarHBondContact O-N 3.2Å; V142-A144 VanDerWaalsContact C-N 3.33Å; V142-A144 PolarHBondContact O-N 3.33Å; V142-F145 PolarHBondContact O-N 3.34Å; V142-I146 HydrophobicContact CG1-CD1 3.65Å; V142-I146 HydrophobicContact CG1-CG1 4.41Å; V142-I146 VanDerWaalsContact O-CG1 3.3Å; V142-I146 WeakPolarHBondContact O-CG1 3.35Å; V142-I146 PolarHBondContact O-N 3.45Å |
| 143 | M | 93.8 | Very high | 89.1 | Confident | 24 Ų | 24 | 45.8 Ų | 45.8 | 12% | 0.118 | 24% | 0.235 | C | C | . | . | H | α-helix | trans | -61.4 | -41.5 | 178.2 | -72.7 | -57.6 | -55.8 | 0 | 0 | 111.9 | I139 G140 V141 F145 I146 I147 I304 I308 | I139-M143 HydrophobicContact CG2-CG 3.98Å; I139-M143 VanDerWaalsContact O-CB 3.29Å; I139-M143 WeakPolarHBondContact O-CB 3.49Å; I139-M143 WeakPolarHBondContact O-CG 3.2Å; I139-M143 PolarHBondContact O-N 2.94Å; G140-M143 PolarHBondContact O-N 3.37Å; V141-M143 PolarHBondContact O-N 3.12Å; M143-F145 VanDerWaalsContact C-N 3.34Å; M143-F145 PolarHBondContact O-N 2.97Å; M143-I146 PolarHBondContact O-N 3.43Å; M143-I147 HydrophobicContact CE-CD1 3.52Å; M143-I147 HydrophobicContact CE-CG1 4.2Å; M143-I147 WeakPolarHBondContact O-CB 3.45Å; M143-I147 PolarHBondContact O-N 3.21Å; M143-I304 HydrophobicContact CE-CB 4.27Å; M143-I304 HydrophobicContact CE-CG2 3.55Å; M143-I308 HydrophobicContact CE-CD1 4.27Å; M143-I308 HydrophobicContact SD-CD1 3.81Å |
| 144 | A | 92.9 | Very high | 87.1 | Confident | 0 Ų | 0 | 47 Ų | 47 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -67.1 | -32.6 | 178.6 | 0 | 0 | 0 | 0 | 0 | 113 | G140 V141 V142 K148 P149 V389 V392 Q396 | G140-A144 WeakPolarHBondContact O-CB 3.33Å; G140-A144 PolarHBondContact O-N 3.4Å; V141-A144 PolarHBondContact O-N 3.15Å; V142-A144 VanDerWaalsContact C-N 3.33Å; V142-A144 PolarHBondContact O-N 3.33Å; A144-K148 VanDerWaalsContact O-CA 3.28Å; A144-K148 WeakPolarHBondContact O-CA 3.22Å; A144-K148 PolarHBondContact O-N 3.41Å; A144-P149 VanDerWaalsContact O-CD 3.32Å; A144-P149 WeakPolarHBondContact O-CD 3.32Å; A144-V389 HydrophobicContact CB-CG1 4.28Å; A144-V392 HydrophobicContact CB-CB 3.7Å; A144-V392 HydrophobicContact CB-CG1 3.56Å; A144-V392 HydrophobicContact CB-CG2 4.33Å; A144-Q396 PolarHBondContact O-NE2 2.98Å; A144-Q396 VanDerWaalsContact O-NE2 3.1Å |
| 145 | F | 92.1 | Very high | 84.6 | Confident | 81 Ų | 81 | 49.1 Ų | 49.1 | 36% | 0.355 | 25% | 0.253 | S | S | . | . | H | α-helix | trans | -76.8 | -28.5 | 173.4 | -81.1 | -65 | 0 | 0 | 0 | 113.9 | V141 V142 M143 K148 V392 L402 V407 | V141-F145 HydrophobicContact CG1-CD2 3.67Å; V141-F145 HydrophobicContact CG1-CE2 3.62Å; V141-F145 VanDerWaalsContact O-CD2 3.26Å; V141-F145 WeakPolarHBondContact O-CD2 3.43Å; V141-F145 PolarHBondContact O-N 2.92Å; V142-F145 PolarHBondContact O-N 3.34Å; M143-F145 VanDerWaalsContact C-N 3.34Å; M143-F145 PolarHBondContact O-N 2.97Å; F145-K148 WeakPolarHBondContact O-CE 3.45Å; F145-K148 WeakPolarHBondContact O-CG 3.31Å; F145-V392 HydrophobicContact CE1-CG1 4.4Å; F145-V392 HydrophobicContact CE2-CG1 4.42Å; F145-V392 HydrophobicContact CE2-CG2 4.33Å; F145-V392 HydrophobicContact CZ-CG1 4.33Å; F145-L402 HydrophobicContact CZ-CB 4.33Å; F145-L402 HydrophobicContact CZ-CD1 4.17Å; F145-V407 HydrophobicContact CE2-CG2 3.9Å; F145-V407 HydrophobicContact CZ-CG2 3.91Å |
| 146 | I | 92.9 | Very high | 82.1 | Confident | 119 Ų | 119 | 50 Ų | 50 | 61% | 0.61 | 26% | 0.261 | S | S | * | . | H | α-helix | trans | -75.6 | -51.5 | 175.5 | -68.9 | 169.4 | 0 | 0 | 0 | 110.6 | V142 M143 | V142-I146 HydrophobicContact CG1-CD1 3.65Å; V142-I146 HydrophobicContact CG1-CG1 4.41Å; V142-I146 VanDerWaalsContact O-CG1 3.3Å; V142-I146 WeakPolarHBondContact O-CG1 3.35Å; V142-I146 PolarHBondContact O-N 3.45Å; M143-I146 PolarHBondContact O-N 3.43Å |
| 147 | I | 91.9 | Very high | 79.3 | Confident | 51 Ų | 51 | 54.6 Ų | 54.6 | 26% | 0.262 | 29% | 0.289 | S | S | . | . | H | α-helix | trans | -75.8 | -31 | -175.8 | -67.1 | 176.3 | 0 | 0 | 0 | 111.2 | M143 P149 C301 I304 | M143-I147 HydrophobicContact CE-CD1 3.52Å; M143-I147 HydrophobicContact CE-CG1 4.2Å; M143-I147 WeakPolarHBondContact O-CB 3.45Å; M143-I147 PolarHBondContact O-N 3.21Å; I147-P149 HydrophobicContact CG2-CB 4.46Å; I147-C301 HydrophobicContact CB-CB 4.45Å; I147-C301 HydrophobicContact CD1-CB 3.79Å; I147-C301 HydrophobicContact CG2-CB 4.24Å; I147-I304 HydrophobicContact CD1-CD1 4.31Å |
| 148 | K | 90.5 | Very high | 76.6 | Confident | 105 Ų | 105 | 58.2 Ų | 58.2 | 46% | 0.457 | 32% | 0.319 | S | S | . | . | trans | 48 | 58.7 | -174.8 | -58.6 | -174.6 | 177.7 | 178.2 | 0 | 112.3 | A144 F145 G150 N151 | A144-K148 VanDerWaalsContact O-CA 3.28Å; A144-K148 WeakPolarHBondContact O-CA 3.22Å; A144-K148 PolarHBondContact O-N 3.41Å; F145-K148 WeakPolarHBondContact O-CE 3.45Å; F145-K148 WeakPolarHBondContact O-CG 3.31Å; K148-G150 PolarHBondContact O-N 2.85Å; K148-N151 HydrophobicContact CB-CB 3.83Å; K148-N151 PolarHBondContact O-N 3.44Å | ||
| 149 | P | 87.4 | Confident | 73.8 | Confident | 0 Ų | 0 | 62.7 Ų | 62.7 | 0% | 0 | 34% | 0.339 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -59.8 | -32 | -172.6 | 23.5 | -32.3 | 0 | 0 | 0 | 113.1 | A144 I147 S294 K297 C301 F393 Q396 | A144-P149 VanDerWaalsContact O-CD 3.32Å; A144-P149 WeakPolarHBondContact O-CD 3.32Å; I147-P149 HydrophobicContact CG2-CB 4.46Å; P149-S294 PolarHBondContact O-OG 3.24Å; P149-K297 HydrophobicContact CB-CB 3.89Å; P149-C301 HydrophobicContact CG-CB 4.49Å; P149-F393 HydrophobicContact CB-CD2 3.77Å; P149-F393 HydrophobicContact CB-CE2 4.23Å; P149-F393 HydrophobicContact CG-CB 4.28Å; P149-F393 HydrophobicContact CG-CD2 3.85Å; P149-Q396 VanDerWaalsContact CD-OE1 3.29Å |
| 150 | G | 80.7 | Confident | 70.9 | Confident | 2 Ų | 2 | 66.3 Ų | 66.3 | 2% | 0.021 | 37% | 0.373 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -87.7 | -9.7 | -178.6 | 0 | 0 | 0 | 0 | 0 | 115 | K148 V152 | K148-G150 PolarHBondContact O-N 2.85Å; G150-V152 PolarHBondContact O-N 2.9Å |
| 151 | N | 76.3 | Confident | 68 | Low | 93 Ų | 93 | 74.4 Ų | 74.4 | 50% | 0.497 | 41% | 0.409 | S | S | . | . | trans | -81.8 | 38.1 | -176.1 | -165 | 43.4 | 0 | 0 | 0 | 113.3 | K148 | K148-N151 HydrophobicContact CB-CB 3.83Å; K148-N151 PolarHBondContact O-N 3.44Å | ||
| 152 | V | 65.8 | Low | 65.1 | Low | 24 Ų | 24 | 81.7 Ų | 81.7 | 15% | 0.145 | 45% | 0.447 | C | S | . | . | S | Bend | trans | -78.1 | 125 | 166.5 | -177.1 | 0 | 0 | 0 | 0 | 105.3 | G150 M154 K290 | G150-V152 PolarHBondContact O-N 2.9Å; V152-M154 HydrophobicContact CB-CG 4.49Å; V152-M154 HydrophobicContact CG1-CG 4.49Å; V152-M154 PolarHBondContact O-N 3.47Å; V152-K290 HydrophobicContact CG1-CB 3.75Å; V152-K290 HydrophobicContact CG1-CD 3.96Å; V152-K290 HydrophobicContact CG1-CG 3.76Å |
| 153 | E | 54.8 | Low | 62.1 | Low | 162 Ų | 162 | 87 Ų | 87 | 76% | 0.757 | 47% | 0.469 | S | S | * | . | trans | -58 | 80.5 | 170.5 | -73.8 | 179.6 | 171.6 | 0 | 0 | 108.8 | N155 K290 | E153-N155 PolarHBondContact O-N 2.97Å; E153-K290 WeakPolarHBondContact O-CD 3.41Å; E153-K290 PolarHBondContact O-NZ 2.86Å | ||
| 154 | M | 51.4 | Low | 59.4 | Low | 30 Ų | 30 | 91 Ų | 91 | 15% | 0.148 | 50% | 0.5 | C | S | . | . | trans | -79.4 | 116.5 | 165.6 | -67.1 | -157.7 | -165.7 | 0 | 0 | 104 | V152 T156 M285 K290 L291 L397 | V152-M154 HydrophobicContact CB-CG 4.49Å; V152-M154 HydrophobicContact CG1-CG 4.49Å; V152-M154 PolarHBondContact O-N 3.47Å; M154-T156 PolarHBondContact O-N 2.96Å; M154-T156 PolarHBondContact O-OG1 3.43Å; M154-M285 HydrophobicContact CE-CE 3.79Å; M154-M285 HydrophobicContact SD-CE 3.17Å; M154-M285 WeakPolarHBondContact SD-CE 3.49Å; M154-K290 HydrophobicContact CG-CB 4.46Å; M154-L291 HydrophobicContact CE-CB 4.26Å; M154-L397 HydrophobicContact CE-CD2 3.96Å | ||
| 155 | N | 41.3 | Very low | 56.6 | Low | 119 Ų | 119 | 98.3 Ų | 98.3 | 64% | 0.636 | 54% | 0.539 | S | S | * | . | trans | -70.2 | 67.6 | 163.4 | -65.7 | -17.5 | 0 | 0 | 0 | 106.3 | E153 T157 | E153-N155 PolarHBondContact O-N 2.97Å; N155-T157 PolarHBondContact O-N 3.25Å | ||
| 156 | T | 44.8 | Very low | 54 | Low | 77 Ų | 77 | 101.8 Ų | 101.8 | 47% | 0.472 | 56% | 0.561 | S | S | . | * | trans | -74.2 | 83.6 | 165.5 | 0.9 | 0 | 0 | 0 | 0 | 104.9 | M154 A158 | M154-T156 PolarHBondContact O-N 2.96Å; M154-T156 PolarHBondContact O-OG1 3.43Å; T156-A158 PolarHBondContact O-N 3.33Å | ||
| 157 | T | 37.7 | Very low | 51.3 | Low | 95 Ų | 95 | 103.7 Ų | 103.7 | 58% | 0.583 | 57% | 0.571 | S | S | * | * | trans | -66.2 | 53.5 | 153.7 | 6.5 | 0 | 0 | 0 | 0 | 108.6 | N155 N159 | N155-T157 PolarHBondContact O-N 3.25Å; T157-N159 PolarHBondContact O-N 2.87Å; T157-N159 VanDerWaalsContact O-N 3.08Å | ||
| 158 | A | 37.7 | Very low | 49 | Very low | 76 Ų | 76 | 106.8 Ų | 106.8 | 63% | 0.628 | 59% | 0.594 | S | S | * | * | trans | -64.5 | 110.2 | 153.6 | 0 | 0 | 0 | 0 | 0 | 104 | T156 A160 | T156-A158 PolarHBondContact O-N 3.33Å; A158-A160 PolarHBondContact O-N 2.89Å | ||
| 159 | N | 36.6 | Very low | 46.9 | Very low | 140 Ų | 140 | 104.1 Ų | 104.1 | 75% | 0.749 | 59% | 0.592 | S | S | * | * | trans | -52.7 | 89.5 | 175.9 | -73 | -50.7 | 0 | 0 | 0 | 109.7 | T157 K161 | T157-N159 PolarHBondContact O-N 2.87Å; T157-N159 VanDerWaalsContact O-N 3.08Å; N159-K161 PolarHBondContact O-N 3.42Å | ||
| 160 | A | 34.8 | Very low | 45.1 | Very low | 104 Ų | 104 | 111.5 Ų | 111.5 | 86% | 0.86 | 63% | 0.631 | S | S | * | * | trans | -77.9 | 40.1 | 160 | 0 | 0 | 0 | 0 | 0 | 109.7 | A158 | A158-A160 PolarHBondContact O-N 2.89Š| ||
| 161 | K | 35.5 | Very low | 43.9 | Very low | 171 Ų | 171 | 115.1 Ų | 115.1 | 74% | 0.743 | 65% | 0.646 | S | S | * | * | S | Bend | trans | -140.3 | 119.8 | 172.1 | -88.8 | -176 | 174.4 | 177.3 | 0 | 106 | N159 | N159-K161 PolarHBondContact O-N 3.42Š|
| 162 | D | 34.1 | Very low | 43.3 | Very low | 161 Ų | 161 | 115.8 Ų | 115.8 | 86% | 0.861 | 65% | 0.647 | S | S | * | * | S | Bend | trans | 88 | 63 | 178.3 | -58.3 | -16.9 | 0 | 0 | 0 | 117.1 | ||
| 163 | M | 31.1 | Very low | 43.1 | Very low | 192 Ų | 192 | 117.9 Ų | 117.9 | 95% | 0.946 | 66% | 0.659 | S | S | * | * | -148.7 | 112.8 | 121.2 | -107.5 | 165.9 | 99.3 | 0 | 0 | 108.9 | |||||
| 164 | S | 38.2 | Very low | 43.6 | Very low | 110 Ų | 110 | 115.2 Ų | 115.2 | 77% | 0.769 | 65% | 0.649 | S | S | * | * | trans | -63.6 | 147.5 | 176.2 | 44 | 0 | 0 | 0 | 0 | 112.6 | ||||
| 165 | D | 33.8 | Very low | 44.4 | Very low | 153 Ų | 153 | 114.4 Ų | 114.4 | 82% | 0.818 | 65% | 0.645 | S | S | * | * | S | Bend | trans | 100.4 | 9.9 | 158.3 | -72.9 | -4.5 | 0 | 0 | 0 | 122.5 | ||
| 166 | D | 36.4 | Very low | 45.4 | Very low | 153 Ų | 153 | 110.4 Ų | 110.4 | 82% | 0.818 | 63% | 0.626 | S | S | * | * | trans | -146.5 | 80 | 161 | -92.7 | -40.1 | 0 | 0 | 0 | 110.7 | P168 | D166-P168 VanDerWaalsContact O-CD 3.24Å; D166-P168 WeakPolarHBondContact O-CD 3.36Å | ||
| 167 | I | 37.6 | Very low | 46.3 | Very low | 160 Ų | 160 | 111.3 Ų | 111.3 | 82% | 0.821 | 62% | 0.624 | S | S | * | * | trans | -74.8 | 113.9 | 159.2 | -59.7 | 173.3 | 0 | 0 | 0 | 104.9 | A169 | I167-A169 VanDerWaalsContact C-N 3.31Å; I167-A169 PolarHBondContact O-N 3.22Å | ||
| 168 | P | 43.2 | Very low | 48 | Very low | 116 Ų | 116 | 109.9 Ų | 109.9 | 75% | 0.753 | 61% | 0.613 | S | S | * | * | trans | -63.4 | 102 | 170.4 | -11.4 | 27.2 | 0 | 0 | 0 | 105.9 | D166 N170 | D166-P168 VanDerWaalsContact O-CD 3.24Å; D166-P168 WeakPolarHBondContact O-CD 3.36Å; P168-N170 PolarHBondContact O-N 3.29Å; P168-N170 VanDerWaalsContact O-N 3.14Å | ||
| 169 | A | 45.8 | Very low | 49.5 | Very low | 48 Ų | 48 | 106.6 Ų | 106.6 | 40% | 0.397 | 59% | 0.585 | S | S | . | * | trans | -54.6 | 126 | 173.6 | 0 | 0 | 0 | 0 | 0 | 106.8 | I167 K171 Y201 | I167-A169 VanDerWaalsContact C-N 3.31Å; I167-A169 PolarHBondContact O-N 3.22Å; A169-K171 PolarHBondContact O-N 2.91Å; A169-Y201 HydrophobicContact CB-CD2 4.28Å | ||
| 170 | N | 49.3 | Very low | 51 | Low | 155 Ų | 155 | 101.4 Ų | 101.4 | 83% | 0.829 | 56% | 0.557 | S | S | * | * | trans | -42.2 | 110.4 | 178.8 | -72.8 | -45.5 | 0 | 0 | 0 | 109 | P168 E172 | P168-N170 PolarHBondContact O-N 3.29Å; P168-N170 VanDerWaalsContact O-N 3.14Å; N170-E172 PolarHBondContact O-N 3.15Å | ||
| 171 | K | 55.3 | Low | 53 | Low | 78 Ų | 78 | 99.9 Ų | 99.9 | 34% | 0.339 | 53% | 0.533 | S | S | . | . | trans | -59.1 | 136.2 | 180 | -74.7 | -171.3 | -179.2 | -167.9 | 0 | 108.1 | A169 D179 T199 Y201 | A169-K171 PolarHBondContact O-N 2.91Å; K171-D179 IonicContact NZ-OD2 3.27Å; K171-D179 PolarHBondContact NZ-OD2 2.84Å; K171-T199 WeakPolarHBondContact CE-O 3.43Å; K171-Y201 HydrophobicContact CG-CE2 4.45Å | ||
| 172 | E | 64.6 | Low | 55.2 | Low | 108 Ų | 108 | 96.2 Ų | 96.2 | 51% | 0.505 | 52% | 0.515 | S | S | . | . | trans | -61.4 | 145.6 | 168.5 | -67.7 | -167.4 | -176.9 | 0 | 0 | 109.1 | N170 I174 D175 S176 Y201 | N170-E172 PolarHBondContact O-N 3.15Å; E172-I174 HydrophobicContact CB-CG2 4.31Å; E172-I174 PolarHBondContact O-N 3.25Å; E172-D175 PolarHBondContact O-N 2.8Å; E172-D175 VanDerWaalsContact O-N 3.17Å; E172-S176 PolarHBondContact O-N 3.24Å; E172-S176 VanDerWaalsContact O-N 3.09Å; E172-S176 PolarHBondContact O-OG 2.71Å; E172-Y201 PolarHBondContact N-OH 3.21Å | ||
| 173 | V | 60.3 | Low | 57 | Low | 68 Ų | 68 | 89.6 Ų | 89.6 | 41% | 0.412 | 48% | 0.479 | S | S | . | . | H | α-helix | trans | -57.1 | -37.1 | -178.7 | -176.9 | 0 | 0 | 0 | 0 | 110.3 | F177 N403 I405 | V173-F177 PolarHBondContact O-N 3.17Å; V173-N403 WeakPolarHBondContact CG2-ND2 3.31Å; V173-I405 HydrophobicContact CB-CD1 4.5Å; V173-I405 HydrophobicContact CG1-CB 4.42Å; V173-I405 HydrophobicContact CG1-CD1 3.21Å; V173-I405 HydrophobicContact CG1-CG1 3.59Å |
| 174 | I | 65.9 | Low | 59.4 | Low | 106 Ų | 106 | 82.5 Ų | 82.5 | 54% | 0.544 | 45% | 0.445 | S | S | . | . | H | α-helix | trans | -69.1 | -42.5 | 179.8 | -151.7 | 152.4 | 0 | 0 | 0 | 112.1 | E172 S176 F177 L178 | E172-I174 HydrophobicContact CB-CG2 4.31Å; E172-I174 PolarHBondContact O-N 3.25Å; I174-S176 VanDerWaalsContact C-N 3.3Å; I174-S176 PolarHBondContact O-N 3.43Å; I174-F177 WeakPolarHBondContact O-CB 3.48Å; I174-F177 PolarHBondContact O-N 2.94Å; I174-F177 VanDerWaalsContact O-N 3.16Å; I174-L178 VanDerWaalsContact O-CG 3.32Å; I174-L178 WeakPolarHBondContact O-CG 3.47Å; I174-L178 PolarHBondContact O-N 3.38Å |
| 175 | D | 68.1 | Low | 61.7 | Low | 12 Ų | 12 | 84.4 Ų | 84.4 | 6% | 0.064 | 44% | 0.44 | C | S | . | . | H | α-helix | trans | -66.5 | -35 | 178.5 | -71.3 | -43.4 | 0 | 0 | 0 | 111.7 | E172 F177 L178 D179 T199 Y201 | E172-D175 PolarHBondContact O-N 2.8Å; E172-D175 VanDerWaalsContact O-N 3.17Å; D175-F177 VanDerWaalsContact C-N 3.33Å; D175-F177 PolarHBondContact O-N 3.46Å; D175-L178 PolarHBondContact O-N 3.45Å; D175-D179 VanDerWaalsContact O-CB 3.31Å; D175-D179 WeakPolarHBondContact O-CB 3.46Å; D175-D179 PolarHBondContact O-N 3.45Å; D175-T199 HydrophobicContact CB-CG2 4.3Å; D175-Y201 VanDerWaalsContact OD2-CE1 3.3Å; D175-Y201 WeakPolarHBondContact OD2-CE1 3.33Å; D175-Y201 VanDerWaalsContact OD2-CZ 3.27Å; D175-Y201 PolarHBondContact OD2-OH 3.37Å |
| 176 | S | 61.8 | Low | 64.2 | Low | 35 Ų | 35 | 78.8 Ų | 78.8 | 25% | 0.245 | 41% | 0.411 | C | S | . | . | H | α-helix | trans | -64.9 | -37.6 | 174 | -54.9 | 0 | 0 | 0 | 0 | 112.1 | E172 I174 L180 | E172-S176 PolarHBondContact O-N 3.24Å; E172-S176 VanDerWaalsContact O-N 3.09Å; E172-S176 PolarHBondContact O-OG 2.71Å; I174-S176 VanDerWaalsContact C-N 3.3Å; I174-S176 PolarHBondContact O-N 3.43Å; S176-L180 PolarHBondContact O-N 3.26Å; S176-L180 VanDerWaalsContact O-N 3.07Å |
| 177 | F | 63.9 | Low | 66.8 | Low | 97 Ų | 97 | 77.3 Ų | 77.3 | 43% | 0.425 | 41% | 0.413 | S | S | . | . | H | α-helix | trans | -70.6 | -39.9 | 174.8 | -176.6 | -104.5 | 0 | 0 | 0 | 112.3 | V173 I174 D175 L180 I181 I405 | V173-F177 PolarHBondContact O-N 3.17Å; I174-F177 WeakPolarHBondContact O-CB 3.48Å; I174-F177 PolarHBondContact O-N 2.94Å; I174-F177 VanDerWaalsContact O-N 3.16Å; D175-F177 VanDerWaalsContact C-N 3.33Å; D175-F177 PolarHBondContact O-N 3.46Å; F177-L180 WeakPolarHBondContact O-CB 3.35Å; F177-L180 PolarHBondContact O-N 2.68Å; F177-I181 HydrophobicContact CD1-CD1 3.98Å; F177-I181 HydrophobicContact CE1-CD1 3.45Å; F177-I181 VanDerWaalsContact CE1-CD1 3.45Å; F177-I181 HydrophobicContact CE1-CG1 4.42Å; F177-I181 HydrophobicContact CZ-CD1 3.87Å; F177-I181 PolarHBondContact O-N 3.48Å; F177-I405 HydrophobicContact CB-CD1 3.92Å; F177-I405 HydrophobicContact CB-CG2 4.42Å; F177-I405 HydrophobicContact CD2-CD1 4.42Å; F177-I405 HydrophobicContact CD2-CG2 4.41Å; F177-I405 HydrophobicContact CG-CD1 4.47Å |
| 178 | L | 74.1 | Confident | 69.5 | Low | 65 Ų | 65 | 73.5 Ų | 73.5 | 34% | 0.34 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -66.2 | -40.1 | 175.2 | -66.6 | 176 | 0 | 0 | 0 | 111.4 | I174 D175 L180 I181 R182 | I174-L178 VanDerWaalsContact O-CG 3.32Å; I174-L178 WeakPolarHBondContact O-CG 3.47Å; I174-L178 PolarHBondContact O-N 3.38Å; D175-L178 PolarHBondContact O-N 3.45Å; L178-L180 VanDerWaalsContact C-N 3.31Å; L178-L180 PolarHBondContact O-N 2.91Å; L178-I181 PolarHBondContact O-N 2.75Å; L178-R182 VanDerWaalsContact O-CG 3.26Å; L178-R182 WeakPolarHBondContact O-CG 3.18Å; L178-R182 PolarHBondContact O-N 3.49Å |
| 179 | D | 69.8 | Low | 71.8 | Confident | 7 Ų | 7 | 71.3 Ų | 71.3 | 4% | 0.037 | 38% | 0.376 | C | S | . | . | H | α-helix | trans | -59.7 | -40.7 | 172.7 | -76.7 | -7 | 0 | 0 | 0 | 111.3 | K171 D175 I181 R182 N183 T199 | K171-D179 IonicContact NZ-OD2 3.27Å; K171-D179 PolarHBondContact NZ-OD2 2.84Å; D175-D179 VanDerWaalsContact O-CB 3.31Å; D175-D179 WeakPolarHBondContact O-CB 3.46Å; D175-D179 PolarHBondContact O-N 3.45Å; D179-I181 PolarHBondContact O-N 3.27Å; D179-R182 PolarHBondContact O-N 3.44Å; D179-R182 IonicContact OD1-NH1 3.04Å; D179-R182 PolarHBondContact OD1-NH1 3.41Å; D179-N183 WeakPolarHBondContact O-CB 3.14Å; D179-N183 PolarHBondContact O-N 3.01Å; D179-N183 PolarHBondContact O-ND2 3.27Å; D179-T199 WeakPolarHBondContact OD1-CB 3.38Å; D179-T199 PolarHBondContact OD1-N 3.05Å; D179-T199 PolarHBondContact OD1-OG1 3.47Å; D179-T199 WeakPolarHBondContact OD2-CB 3.36Å; D179-T199 PolarHBondContact OD2-N 2.9Å |
| 180 | L | 68.1 | Low | 74.1 | Confident | 31 Ų | 31 | 74.1 Ų | 74.1 | 16% | 0.162 | 39% | 0.388 | C | S | . | . | H | α-helix | trans | -57.6 | -50.2 | 174.4 | -179.9 | 70.9 | 0 | 0 | 0 | 111.3 | S176 F177 L178 R182 N183 I184 L225 T409 | S176-L180 PolarHBondContact O-N 3.26Å; S176-L180 VanDerWaalsContact O-N 3.07Å; F177-L180 WeakPolarHBondContact O-CB 3.35Å; F177-L180 PolarHBondContact O-N 2.68Å; L178-L180 VanDerWaalsContact C-N 3.31Å; L178-L180 PolarHBondContact O-N 2.91Å; L180-R182 PolarHBondContact O-N 3.04Å; L180-N183 PolarHBondContact O-N 3.49Å; L180-I184 HydrophobicContact CG-CD1 4.47Å; L180-I184 WeakPolarHBondContact O-CG1 3.49Å; L180-I184 PolarHBondContact O-N 3.48Å; L180-L225 HydrophobicContact CD1-CD2 3.52Å; L180-T409 HydrophobicContact CD1-CG2 3.75Å |
| 181 | I | 76.3 | Confident | 76 | Confident | 72 Ų | 72 | 68 Ų | 68 | 37% | 0.369 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -63.9 | -41.5 | 179.7 | -65 | 171.2 | 0 | 0 | 0 | 111.3 | F177 L178 D179 N183 I184 F185 | F177-I181 HydrophobicContact CD1-CD1 3.98Å; F177-I181 HydrophobicContact CE1-CD1 3.45Å; F177-I181 VanDerWaalsContact CE1-CD1 3.45Å; F177-I181 HydrophobicContact CE1-CG1 4.42Å; F177-I181 HydrophobicContact CZ-CD1 3.87Å; F177-I181 PolarHBondContact O-N 3.48Å; L178-I181 PolarHBondContact O-N 2.75Å; D179-I181 PolarHBondContact O-N 3.27Å; I181-N183 VanDerWaalsContact C-N 3.29Å; I181-N183 PolarHBondContact O-N 3.15Å; I181-I184 WeakPolarHBondContact O-CB 3.38Å; I181-I184 PolarHBondContact O-N 3.33Å; I181-F185 PolarHBondContact O-N 3.35Å |
| 182 | R | 80.7 | Confident | 77.4 | Confident | 93 Ų | 93 | 64.3 Ų | 64.3 | 35% | 0.351 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -62.7 | -37.5 | 176.5 | -69.9 | 171.1 | -169.7 | 142.4 | -5.7 | 111.5 | L178 D179 L180 F185 Y197 T199 | L178-R182 VanDerWaalsContact O-CG 3.26Å; L178-R182 WeakPolarHBondContact O-CG 3.18Å; L178-R182 PolarHBondContact O-N 3.49Å; D179-R182 PolarHBondContact O-N 3.44Å; D179-R182 IonicContact OD1-NH1 3.04Å; D179-R182 PolarHBondContact OD1-NH1 3.41Å; L180-R182 PolarHBondContact O-N 3.04Å; R182-F185 CarbonylContact O-C 3.56Å; R182-F185 VanDerWaalsContact O-C 3.29Å; R182-F185 PolarHBondContact O-N 3Å; R182-F185 VanDerWaalsContact O-O 3.07Å; R182-Y197 HydrophobicContact CB-CD1 4.02Å; R182-Y197 HydrophobicContact CB-CE1 4.48Å; R182-Y197 HydrophobicContact CB-CG 4.28Å; R182-Y197 HydrophobicContact CG-CD1 4.47Å; R182-Y197 HydrophobicContact CG-CE1 4.45Å; R182-T199 PolarHBondContact NH1-OG1 2.85Å |
| 183 | N | 73.3 | Confident | 78.3 | Confident | 22 Ų | 22 | 60.4 Ų | 60.4 | 12% | 0.118 | 33% | 0.328 | C | S | . | . | H | α-helix | trans | -73.1 | -28.7 | 176.5 | -78.4 | -58.7 | 0 | 0 | 0 | 113.3 | D179 L180 I181 F185 Y197 N223 G226 | D179-N183 WeakPolarHBondContact O-CB 3.14Å; D179-N183 PolarHBondContact O-N 3.01Å; D179-N183 PolarHBondContact O-ND2 3.27Å; L180-N183 PolarHBondContact O-N 3.49Å; I181-N183 VanDerWaalsContact C-N 3.29Å; I181-N183 PolarHBondContact O-N 3.15Å; N183-F185 PolarHBondContact O-N 2.7Å; N183-Y197 PolarHBondContact ND2-O 3.25Å; N183-Y197 WeakPolarHBondContact OD1-CB 3.49Å; N183-Y197 PolarHBondContact OD1-N 3.5Å; N183-N223 PolarHBondContact O-ND2 3.27Å; N183-N223 PolarHBondContact O-OD1 2.94Å; N183-N223 PolarHBondContact OD1-ND2 2.65Å; N183-G226 WeakPolarHBondContact O-CA 3.32Å; N183-G226 PolarHBondContact O-N 2.93Å |
| 184 | I | 80.6 | Confident | 79.3 | Confident | 44 Ų | 44 | 62.5 Ų | 62.5 | 23% | 0.226 | 33% | 0.331 | C | S | . | . | H | α-helix | trans | -59.9 | -36.7 | 172 | -72.7 | 170.5 | 0 | 0 | 0 | 111.4 | L180 I181 P186 L225 V229 | L180-I184 HydrophobicContact CG-CD1 4.47Å; L180-I184 WeakPolarHBondContact O-CG1 3.49Å; L180-I184 PolarHBondContact O-N 3.48Å; I181-I184 WeakPolarHBondContact O-CB 3.38Å; I181-I184 PolarHBondContact O-N 3.33Å; I184-P186 WeakPolarHBondContact O-CD 3.43Å; I184-L225 HydrophobicContact CG1-CD1 4.45Å; I184-L225 HydrophobicContact CG1-CD2 3.72Å; I184-L225 HydrophobicContact CG1-CG 4Å; I184-V229 HydrophobicContact CG2-CB 4.42Å; I184-V229 HydrophobicContact CG2-CG1 4.04Å; I184-V229 HydrophobicContact CG2-CG2 4.14Å |
| 185 | F | 87.7 | Confident | 79.9 | Confident | 150 Ų | 150 | 59.9 Ų | 59.9 | 66% | 0.658 | 32% | 0.317 | S | S | * | . | S | Bend | trans | -118.2 | 78.8 | -179.4 | -58.3 | -72 | 0 | 0 | 0 | 110.9 | I181 R182 N183 | I181-F185 PolarHBondContact O-N 3.35Å; R182-F185 CarbonylContact O-C 3.56Å; R182-F185 VanDerWaalsContact O-C 3.29Å; R182-F185 PolarHBondContact O-N 3Å; R182-F185 VanDerWaalsContact O-O 3.07Å; N183-F185 PolarHBondContact O-N 2.7Å |
| 186 | P | 86 | Confident | 80.1 | Confident | 34 Ų | 34 | 60.6 Ų | 60.6 | 22% | 0.221 | 32% | 0.323 | C | S | . | . | trans | -62 | 141.8 | -178.8 | 25 | -32.8 | 0 | 0 | 0 | 111.3 | I184 N188 L189 A192 | I184-P186 WeakPolarHBondContact O-CD 3.43Å; P186-N188 PolarHBondContact O-N 3.45Å; P186-L189 HydrophobicContact CG-CD2 4.26Å; P186-A192 HydrophobicContact CB-CB 3.74Å; P186-A192 HydrophobicContact CG-CB 4.06Å | ||
| 187 | S | 91.3 | Very high | 80.8 | Confident | 122 Ų | 122 | 62.4 Ų | 62.4 | 85% | 0.853 | 33% | 0.325 | S | S | * | . | S | Bend | trans | -65.4 | -25.4 | 176.3 | 57.5 | 0 | 0 | 0 | 0 | 112.8 | ||
| 188 | N | 94.1 | Very high | 81.3 | Confident | 81 Ų | 81 | 57.8 Ų | 57.8 | 43% | 0.433 | 31% | 0.305 | S | S | . | . | trans | -151.2 | 129.5 | 178.8 | -175.7 | -57 | 0 | 0 | 0 | 111 | P186 V190 S191 A192 | P186-N188 PolarHBondContact O-N 3.45Å; N188-V190 WeakPolarHBondContact OD1-CA 3.1Å; N188-V190 WeakPolarHBondContact OD1-CB 3.27Å; N188-V190 PolarHBondContact OD1-N 3.41Å; N188-S191 PolarHBondContact OD1-N 2.66Å; N188-A192 VanDerWaalsContact O-CB 3.3Å; N188-A192 WeakPolarHBondContact O-CB 3.26Å; N188-A192 PolarHBondContact O-N 3.43Å | ||
| 189 | L | 91.6 | Very high | 81.4 | Confident | 70 Ų | 70 | 54.9 Ų | 54.9 | 37% | 0.366 | 29% | 0.29 | S | S | . | . | H | α-helix | trans | -69.9 | -32.7 | -178.1 | -65.6 | 173.2 | 0 | 0 | 0 | 113.8 | P186 A193 F230 | P186-L189 HydrophobicContact CG-CD2 4.26Å; L189-A193 PolarHBondContact O-N 2.86Å; L189-F230 HydrophobicContact CD1-CD1 4.11Å; L189-F230 HydrophobicContact CD1-CD2 3.84Å; L189-F230 HydrophobicContact CD1-CE1 3.77Å; L189-F230 HydrophobicContact CD1-CE2 3.47Å; L189-F230 VanDerWaalsContact CD1-CE2 3.47Å; L189-F230 HydrophobicContact CD1-CG 4.15Å; L189-F230 HydrophobicContact CD1-CZ 3.43Å; L189-F230 VanDerWaalsContact CD1-CZ 3.43Å; L189-F230 HydrophobicContact CD2-CB 3.91Å; L189-F230 HydrophobicContact CD2-CD1 3.87Å; L189-F230 HydrophobicContact CD2-CD2 3.78Å; L189-F230 HydrophobicContact CD2-CE1 4.38Å; L189-F230 HydrophobicContact CD2-CE2 4.3Å; L189-F230 HydrophobicContact CD2-CG 3.54Å; L189-F230 HydrophobicContact CG-CD2 4.43Å; L189-F230 HydrophobicContact CG-CE2 4.5Å |
| 190 | V | 93.9 | Very high | 81.7 | Confident | 107 Ų | 107 | 57.3 Ų | 57.3 | 65% | 0.648 | 31% | 0.307 | S | S | * | . | H | α-helix | trans | -72 | -45.3 | 178.2 | -176.3 | 0 | 0 | 0 | 0 | 109.5 | N188 A192 A193 F194 | N188-V190 WeakPolarHBondContact OD1-CA 3.1Å; N188-V190 WeakPolarHBondContact OD1-CB 3.27Å; N188-V190 PolarHBondContact OD1-N 3.41Å; V190-A192 VanDerWaalsContact C-N 3.34Å; V190-A193 VanDerWaalsContact O-CB 3.26Å; V190-A193 WeakPolarHBondContact O-CB 3.49Å; V190-A193 PolarHBondContact O-N 3.48Å; V190-A193 VanDerWaalsContact O-N 3.16Å; V190-F194 HydrophobicContact CG1-CE1 4.43Å; V190-F194 WeakPolarHBondContact O-CD1 3.01Å; V190-F194 WeakPolarHBondContact O-CE1 3.37Å |
| 191 | S | 89.6 | Confident | 82.3 | Confident | 25 Ų | 25 | 57.6 Ų | 57.6 | 18% | 0.175 | 31% | 0.306 | C | S | . | . | H | α-helix | trans | -61.4 | -42.1 | 172.8 | 171.8 | 0 | 0 | 0 | 0 | 111.1 | N188 A193 F194 Q195 | N188-S191 PolarHBondContact OD1-N 2.66Å; S191-A193 PolarHBondContact O-N 2.91Å; S191-F194 CarbonylContact O-C 3.6Å; S191-F194 PolarHBondContact O-N 2.94Å; S191-Q195 PolarHBondContact O-N 3.36Å; S191-Q195 PolarHBondContact OG-OE1 2.86Å |
| 192 | A | 84.6 | Confident | 82.6 | Confident | 2 Ų | 2 | 60.6 Ų | 60.6 | 2% | 0.017 | 32% | 0.316 | C | S | . | . | H | α-helix | trans | -56.5 | -22.6 | 175.9 | 0 | 0 | 0 | 0 | 0 | 114 | P186 N188 V190 F194 Q195 N223 L227 | P186-A192 HydrophobicContact CB-CB 3.74Å; P186-A192 HydrophobicContact CG-CB 4.06Å; N188-A192 VanDerWaalsContact O-CB 3.3Å; N188-A192 WeakPolarHBondContact O-CB 3.26Å; N188-A192 PolarHBondContact O-N 3.43Å; V190-A192 VanDerWaalsContact C-N 3.34Å; A192-F194 PolarHBondContact O-N 3.37Å; A192-Q195 WeakPolarHBondContact CA-O 3.47Å; A192-N223 HydrophobicContact CB-CB 4.1Å; A192-N223 PolarHBondContact O-N 2.78Å; A192-L227 HydrophobicContact CB-CD2 4.2Å; A192-L227 HydrophobicContact CB-CG 4.44Å |
| 193 | A | 81.9 | Confident | 82.6 | Confident | 26 Ų | 26 | 60.6 Ų | 60.6 | 22% | 0.215 | 33% | 0.327 | C | S | . | . | T | Hydrogen-bonded Turn | trans | -72.6 | -12.2 | 175.6 | 0 | 0 | 0 | 0 | 0 | 113.9 | I99 L189 V190 S191 M222 | I99-A193 HydrophobicContact CD1-CB 4.08Å; I99-A193 WeakPolarHBondContact CD1-O 3.37Å; L189-A193 PolarHBondContact O-N 2.86Å; V190-A193 VanDerWaalsContact O-CB 3.26Å; V190-A193 WeakPolarHBondContact O-CB 3.49Å; V190-A193 PolarHBondContact O-N 3.48Å; V190-A193 VanDerWaalsContact O-N 3.16Å; S191-A193 PolarHBondContact O-N 2.91Å; A193-M222 VanDerWaalsContact O-CG 3.29Å; A193-M222 WeakPolarHBondContact O-CG 3.34Å |
| 194 | F | 81 | Confident | 83.1 | Confident | 112 Ų | 112 | 63.2 Ų | 63.2 | 49% | 0.491 | 34% | 0.34 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -145.1 | -6.8 | 179.3 | 62.1 | -88.5 | 0 | 0 | 0 | 114.9 | V190 S191 A192 G221 | V190-F194 HydrophobicContact CG1-CE1 4.43Å; V190-F194 WeakPolarHBondContact O-CD1 3.01Å; V190-F194 WeakPolarHBondContact O-CE1 3.37Å; S191-F194 CarbonylContact O-C 3.6Å; S191-F194 PolarHBondContact O-N 2.94Å; A192-F194 PolarHBondContact O-N 3.37Å; F194-G221 CarbonylContact C-O 3.59Å; F194-G221 CarbonylContact O-C 3.58Å; F194-G221 PolarHBondContact O-N 3.31Å |
| 195 | Q | 80.1 | Confident | 83.2 | Confident | 51 Ų | 51 | 67.1 Ų | 67.1 | 24% | 0.238 | 36% | 0.361 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -131.5 | 147.3 | 179.1 | -76.4 | 168.7 | -25.7 | 0 | 0 | 111.8 | S191 A192 Q219 G221 N223 | S191-Q195 PolarHBondContact O-N 3.36Å; S191-Q195 PolarHBondContact OG-OE1 2.86Å; A192-Q195 WeakPolarHBondContact CA-O 3.47Å; Q195-Q219 WeakPolarHBondContact CA-O 3.47Å; Q195-G221 CarbonylContact C-O 3.54Å; Q195-G221 WeakPolarHBondContact CA-O 3.1Å; Q195-G221 PolarHBondContact N-O 2.79Å; Q195-G221 VanDerWaalsContact N-O 3.08Å; Q195-N223 WeakPolarHBondContact O-CB 3.48Å; Q195-N223 PolarHBondContact O-N 3.41Å |
| 196 | S | 71.3 | Confident | 82.5 | Confident | 27 Ų | 27 | 62.2 Ų | 62.2 | 19% | 0.189 | 35% | 0.348 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -127.5 | 154.6 | 176.1 | 63.9 | 0 | 0 | 0 | 0 | 110.5 | D218 Q219 G221 | S196-D218 CarbonylContact O-C 3.58Å; S196-D218 WeakPolarHBondContact O-CA 3.34Å; S196-Q219 PolarHBondContact N-O 3.43Å; S196-Q219 PolarHBondContact O-N 3.5Å; S196-Q219 PolarHBondContact OG-O 3.42Å; S196-G221 PolarHBondContact N-O 3.31Å |
| 197 | Y | 76.6 | Confident | 81.8 | Confident | 72 Ų | 72 | 66.6 Ų | 66.6 | 28% | 0.282 | 38% | 0.38 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.5 | 129.9 | -178.6 | -168.4 | -85.5 | 0 | 0 | 0 | 110.7 | R182 N183 G216 | R182-Y197 HydrophobicContact CB-CD1 4.02Å; R182-Y197 HydrophobicContact CB-CE1 4.48Å; R182-Y197 HydrophobicContact CB-CG 4.28Å; R182-Y197 HydrophobicContact CG-CD1 4.47Å; R182-Y197 HydrophobicContact CG-CE1 4.45Å; N183-Y197 PolarHBondContact ND2-O 3.25Å; N183-Y197 WeakPolarHBondContact OD1-CB 3.49Å; N183-Y197 PolarHBondContact OD1-N 3.5Å; Y197-G216 WeakPolarHBondContact OH-CA 3.46Å |
| 198 | G | 74.4 | Confident | 81 | Confident | 1 Ų | 1 | 64.6 Ų | 64.6 | 1% | 0.01 | 38% | 0.379 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -134 | 144 | 170.9 | 0 | 0 | 0 | 0 | 0 | 112 | T217 | G198-T217 CarbonylContact C-O 3.58Å; G198-T217 PolarHBondContact N-O 2.95Å; G198-T217 CarbonylContact O-C 3.49Å; G198-T217 WeakPolarHBondContact O-CA 3.47Å; G198-T217 PolarHBondContact O-N 3.47Å; G198-T217 PolarHBondContact O-OG1 3.28Å |
| 199 | T | 77 | Confident | 80 | Confident | 4 Ų | 4 | 66.7 Ų | 66.7 | 3% | 0.025 | 39% | 0.389 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -87.9 | 122.6 | 169.6 | -64.1 | 0 | 0 | 0 | 0 | 110.1 | K171 D175 D179 R182 P214 | K171-T199 WeakPolarHBondContact CE-O 3.43Å; D175-T199 HydrophobicContact CB-CG2 4.3Å; D179-T199 WeakPolarHBondContact OD1-CB 3.38Å; D179-T199 PolarHBondContact OD1-N 3.05Å; D179-T199 PolarHBondContact OD1-OG1 3.47Å; D179-T199 WeakPolarHBondContact OD2-CB 3.36Å; D179-T199 PolarHBondContact OD2-N 2.9Å; R182-T199 PolarHBondContact NH1-OG1 2.85Å; T199-P214 HydrophobicContact CG2-CB 3.37Å |
| 200 | S | 76.2 | Confident | 79.3 | Confident | 57 Ų | 57 | 66.6 Ų | 66.6 | 40% | 0.399 | 40% | 0.398 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -102.8 | 171.5 | 164.4 | -171.3 | 0 | 0 | 0 | 0 | 109.6 | P214 V215 | S200-P214 CarbonylContact O-C 2.88Å; S200-P214 WeakPolarHBondContact O-CA 3.48Å; S200-V215 PolarHBondContact N-O 2.7Å; S200-V215 PolarHBondContact O-N 3.46Å |
| 201 | Y | 79.3 | Confident | 78.6 | Confident | 38 Ų | 38 | 67.1 Ų | 67.1 | 15% | 0.149 | 39% | 0.393 | C | S | . | . | E | Extended strand (participates in β ladder) | trans | -117.4 | 133.1 | 178.4 | -62.8 | -81.7 | 0 | 0 | 0 | 111.2 | A169 K171 E172 D175 K212 V213 P214 | A169-Y201 HydrophobicContact CB-CD2 4.28Å; K171-Y201 HydrophobicContact CG-CE2 4.45Å; E172-Y201 PolarHBondContact N-OH 3.21Å; D175-Y201 VanDerWaalsContact OD2-CE1 3.3Å; D175-Y201 WeakPolarHBondContact OD2-CE1 3.33Å; D175-Y201 VanDerWaalsContact OD2-CZ 3.27Å; D175-Y201 PolarHBondContact OD2-OH 3.37Å; Y201-K212 VanDerWaalsContact CB-CE 3.46Å; Y201-K212 HydrophobicContact CD1-CD 4.06Å; Y201-K212 HydrophobicContact CD1-CG 3.75Å; Y201-K212 HydrophobicContact CG-CD 4.1Å; Y201-K212 HydrophobicContact CG-CG 3.95Å; Y201-V213 WeakPolarHBondContact CA-O 3.31Å; Y201-P214 HydrophobicContact CD1-CB 4.23Å; Y201-P214 HydrophobicContact CE1-CB 4.07Å |
| 202 | K | 82.5 | Confident | 78.2 | Confident | 134 Ų | 134 | 70.3 Ų | 70.3 | 58% | 0.583 | 40% | 0.404 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -112 | 128.9 | 169.5 | -166.7 | 172.3 | -177.5 | 176.3 | 0 | 108.6 | I204 V213 V215 | K202-I204 HydrophobicContact CG-CG1 4.43Å; K202-I204 PolarHBondContact O-N 3.29Å; K202-V213 PolarHBondContact N-O 3.23Å; K202-V213 PolarHBondContact O-N 2.99Å; K202-V215 HydrophobicContact CB-CG2 3.78Å |
| 203 | V | 82.3 | Confident | 78.1 | Confident | 93 Ų | 93 | 72.3 Ų | 72.3 | 56% | 0.564 | 42% | 0.416 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -81.1 | 116.5 | 171.2 | -176.7 | 0 | 0 | 0 | 0 | 107.4 | A210 E211 | V203-A210 HydrophobicContact CG1-CB 3.85Å; V203-E211 WeakPolarHBondContact CA-O 3.42Å |
| 204 | I | 83.5 | Confident | 78.2 | Confident | 78 Ų | 78 | 74.2 Ų | 74.2 | 40% | 0.4 | 43% | 0.426 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -107.2 | 124.3 | 176.4 | -56.1 | 178.8 | 0 | 0 | 0 | 107.1 | K202 A206 E211 V213 | K202-I204 HydrophobicContact CG-CG1 4.43Å; K202-I204 PolarHBondContact O-N 3.29Å; I204-A206 PolarHBondContact O-N 2.83Å; I204-E211 PolarHBondContact N-O 2.8Å; I204-E211 PolarHBondContact O-N 3.22Å; I204-V213 HydrophobicContact CD1-CB 4.16Å; I204-V213 HydrophobicContact CD1-CG2 4.05Å; I204-V213 HydrophobicContact CG1-CG2 4.37Å |
| 205 | N | 81.5 | Confident | 78.5 | Confident | 126 Ų | 126 | 71.8 Ų | 71.8 | 67% | 0.674 | 42% | 0.42 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -86.4 | 92.3 | 172.8 | -73 | -13.8 | 0 | 0 | 0 | 108.7 | A210 | N205-A210 WeakPolarHBondContact OD1-CA 3.34Å; N205-A210 WeakPolarHBondContact OD1-CB 3.3Å |
| 206 | A | 74.8 | Confident | 78.6 | Confident | 46 Ų | 46 | 71.1 Ų | 71.1 | 38% | 0.38 | 43% | 0.427 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -100.4 | 126.3 | 169.7 | 0 | 0 | 0 | 0 | 0 | 108.7 | I204 G208 I209 | I204-A206 PolarHBondContact O-N 2.83Å; A206-G208 VanDerWaalsContact C-N 3.25Å; A206-G208 PolarHBondContact O-N 2.85Å; A206-G208 VanDerWaalsContact O-N 3.13Å; A206-I209 PolarHBondContact N-O 3.17Å; A206-I209 PolarHBondContact O-N 3.29Å; A206-I209 VanDerWaalsContact O-N 3.11Å; A206-I209 VanDerWaalsContact O-O 3.1Å |
| 207 | S | 69.7 | Low | 79.1 | Confident | 126 Ų | 126 | 72.2 Ų | 72.2 | 88% | 0.881 | 43% | 0.433 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 62.4 | 24.4 | 170.2 | -35.5 | 0 | 0 | 0 | 0 | 115.6 | I209 | S207-I209 VanDerWaalsContact C-N 3.3Å; S207-I209 PolarHBondContact O-N 3.49Å |
| 208 | G | 74.6 | Confident | 79.3 | Confident | 81 Ų | 81 | 73.5 Ų | 73.5 | 84% | 0.835 | 45% | 0.445 | S | S | * | . | T | Hydrogen-bonded Turn | trans | 81.2 | 3.2 | -178.4 | 0 | 0 | 0 | 0 | 0 | 115 | A206 | A206-G208 VanDerWaalsContact C-N 3.25Å; A206-G208 PolarHBondContact O-N 2.85Å; A206-G208 VanDerWaalsContact O-N 3.13Å |
| 209 | I | 73.4 | Confident | 79.1 | Confident | 125 Ų | 125 | 77.7 Ų | 77.7 | 64% | 0.641 | 46% | 0.464 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -108.4 | 126.9 | 172 | -56.6 | 177 | 0 | 0 | 0 | 107.7 | A206 S207 E211 | A206-I209 PolarHBondContact N-O 3.17Å; A206-I209 PolarHBondContact O-N 3.29Å; A206-I209 VanDerWaalsContact O-N 3.11Å; A206-I209 VanDerWaalsContact O-O 3.1Å; S207-I209 VanDerWaalsContact C-N 3.3Å; S207-I209 PolarHBondContact O-N 3.49Å; I209-E211 PolarHBondContact O-N 3.11Å |
| 210 | A | 77.4 | Confident | 78.6 | Confident | 67 Ų | 67 | 84.4 Ų | 84.4 | 55% | 0.554 | 50% | 0.5 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -76.8 | 110.8 | 173 | 0 | 0 | 0 | 0 | 0 | 108.8 | V203 N205 | V203-A210 HydrophobicContact CG1-CB 3.85Å; N205-A210 WeakPolarHBondContact OD1-CA 3.34Å; N205-A210 WeakPolarHBondContact OD1-CB 3.3Å |
| 211 | E | 79.8 | Confident | 78 | Confident | 119 Ų | 119 | 82.8 Ų | 82.8 | 56% | 0.556 | 49% | 0.492 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -107.4 | 131.7 | 178.1 | -169.1 | 175.2 | 178.6 | 0 | 0 | 110.2 | V203 I204 I209 V213 | V203-E211 WeakPolarHBondContact CA-O 3.42Å; I204-E211 PolarHBondContact N-O 2.8Å; I204-E211 PolarHBondContact O-N 3.22Å; I209-E211 PolarHBondContact O-N 3.11Å; E211-V213 HydrophobicContact CG-CG2 4.24Å |
| 212 | K | 80.1 | Confident | 77.4 | Confident | 91 Ų | 91 | 82.4 Ų | 82.4 | 40% | 0.396 | 49% | 0.492 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -88 | 110.4 | 177.4 | -174.6 | -177.6 | 172.8 | -168 | 0 | 108.3 | Y201 | Y201-K212 VanDerWaalsContact CB-CE 3.46Å; Y201-K212 HydrophobicContact CD1-CD 4.06Å; Y201-K212 HydrophobicContact CD1-CG 3.75Å; Y201-K212 HydrophobicContact CG-CD 4.1Å; Y201-K212 HydrophobicContact CG-CG 3.95Å |
| 213 | V | 83.4 | Confident | 76.9 | Confident | 45 Ų | 45 | 76.5 Ų | 76.5 | 27% | 0.273 | 47% | 0.467 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -109.7 | 131.3 | -177.6 | -176.4 | 0 | 0 | 0 | 0 | 109.9 | Y201 K202 I204 E211 | Y201-V213 WeakPolarHBondContact CA-O 3.31Å; K202-V213 PolarHBondContact N-O 3.23Å; K202-V213 PolarHBondContact O-N 2.99Å; I204-V213 HydrophobicContact CD1-CB 4.16Å; I204-V213 HydrophobicContact CD1-CG2 4.05Å; I204-V213 HydrophobicContact CG1-CG2 4.37Å; E211-V213 HydrophobicContact CG-CG2 4.24Å |
| 214 | P | 84.1 | Confident | 76.1 | Confident | 65 Ų | 65 | 72.2 Ų | 72.2 | 42% | 0.422 | 44% | 0.441 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -69.9 | 132.4 | 174 | 27.6 | -32.7 | 0 | 0 | 0 | 110.8 | T199 S200 Y201 | T199-P214 HydrophobicContact CG2-CB 3.37Å; S200-P214 CarbonylContact O-C 2.88Å; S200-P214 WeakPolarHBondContact O-CA 3.48Å; Y201-P214 HydrophobicContact CD1-CB 4.23Å; Y201-P214 HydrophobicContact CE1-CB 4.07Å |
| 215 | V | 85.8 | Confident | 75.3 | Confident | 61 Ų | 61 | 69.5 Ų | 69.5 | 37% | 0.37 | 43% | 0.427 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -125.1 | 129.5 | 178 | -178 | 0 | 0 | 0 | 0 | 108.7 | S200 K202 | S200-V215 PolarHBondContact N-O 2.7Å; S200-V215 PolarHBondContact O-N 3.46Å; K202-V215 HydrophobicContact CB-CG2 3.78Å |
| 216 | G | 83.1 | Confident | 75 | Confident | 38 Ų | 38 | 63.5 Ų | 63.5 | 39% | 0.392 | 40% | 0.395 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -67.2 | 132.4 | 174.4 | 0 | 0 | 0 | 0 | 0 | 111.8 | Y197 | Y197-G216 WeakPolarHBondContact OH-CA 3.46Å |
| 217 | T | 81.3 | Confident | 75.2 | Confident | 49 Ų | 49 | 61.9 Ų | 61.9 | 30% | 0.301 | 38% | 0.379 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -134.3 | 130.9 | 177.4 | 52.1 | 0 | 0 | 0 | 0 | 109.1 | G198 Q219 | G198-T217 CarbonylContact C-O 3.58Å; G198-T217 PolarHBondContact N-O 2.95Å; G198-T217 CarbonylContact O-C 3.49Å; G198-T217 WeakPolarHBondContact O-CA 3.47Å; G198-T217 PolarHBondContact O-N 3.47Å; G198-T217 PolarHBondContact O-OG1 3.28Å; T217-Q219 PolarHBondContact O-N 2.66Å |
| 218 | D | 80.6 | Confident | 75.4 | Confident | 100 Ų | 100 | 56.1 Ų | 56.1 | 54% | 0.535 | 34% | 0.339 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -79.3 | 119.4 | 170.7 | -62 | -40.7 | 0 | 0 | 0 | 108 | S196 | S196-D218 CarbonylContact O-C 3.58Å; S196-D218 WeakPolarHBondContact O-CA 3.34Å |
| 219 | Q | 71.3 | Confident | 75.6 | Confident | 88 Ų | 88 | 54.1 Ų | 54.1 | 41% | 0.411 | 31% | 0.311 | S | S | . | . | E | Extended strand (participates in β ladder) | trans | -95.9 | 136.3 | 178.3 | -60.5 | -167.9 | -10.5 | 0 | 0 | 109.7 | Q195 S196 T217 G221 | Q195-Q219 WeakPolarHBondContact CA-O 3.47Å; S196-Q219 PolarHBondContact N-O 3.43Å; S196-Q219 PolarHBondContact O-N 3.5Å; S196-Q219 PolarHBondContact OG-O 3.42Å; T217-Q219 PolarHBondContact O-N 2.66Å; Q219-G221 PolarHBondContact O-N 2.96Å |
| 220 | D | 67.2 | Low | 76.4 | Confident | 146 Ų | 146 | 51.7 Ų | 51.7 | 78% | 0.781 | 30% | 0.295 | S | S | * | . | E | Extended strand (participates in β ladder) | trans | -66.1 | 121.3 | 174.5 | -72.5 | -18.8 | 0 | 0 | 0 | 110 | ||
| 221 | G | 63.1 | Low | 76.7 | Confident | 23 Ų | 23 | 48.5 Ų | 48.5 | 24% | 0.237 | 27% | 0.269 | C | S | . | . | S | Bend | trans | 150 | 142.8 | -171.2 | 0 | 0 | 0 | 0 | 0 | 110.5 | F194 Q195 S196 Q219 N223 | F194-G221 CarbonylContact C-O 3.59Å; F194-G221 CarbonylContact O-C 3.58Å; F194-G221 PolarHBondContact O-N 3.31Å; Q195-G221 CarbonylContact C-O 3.54Å; Q195-G221 WeakPolarHBondContact CA-O 3.1Å; Q195-G221 PolarHBondContact N-O 2.79Å; Q195-G221 VanDerWaalsContact N-O 3.08Å; S196-G221 PolarHBondContact N-O 3.31Å; Q219-G221 PolarHBondContact O-N 2.96Å; G221-N223 PolarHBondContact O-N 3.33Å |
| 222 | M | 66.9 | Low | 76.7 | Confident | 29 Ų | 29 | 45.6 Ų | 45.6 | 14% | 0.143 | 26% | 0.257 | C | S | . | . | trans | -72.3 | 129.1 | -174.7 | -57.6 | -172.6 | -77.5 | 0 | 0 | 110.4 | I98 I99 A193 I224 | I98-M222 HydrophobicContact CB-CE 4.4Å; I98-M222 HydrophobicContact CD1-CE 4.29Å; I98-M222 HydrophobicContact CG2-CE 4.38Å; I99-M222 HydrophobicContact CD1-SD 3.49Å; I99-M222 WeakPolarHBondContact CD1-SD 3.43Å; I99-M222 HydrophobicContact CG1-SD 3.52Å; I99-M222 VanDerWaalsContact CG1-SD 3.52Å; A193-M222 VanDerWaalsContact O-CG 3.29Å; A193-M222 WeakPolarHBondContact O-CG 3.34Å; M222-I224 HydrophobicContact CB-CD1 4.2Å; M222-I224 HydrophobicContact CB-CG1 3.68Å; M222-I224 HydrophobicContact CE-CD1 4.07Å; M222-I224 PolarHBondContact O-N 3.27Å | ||
| 223 | N | 70.5 | Confident | 77.1 | Confident | 10 Ų | 10 | 45.8 Ų | 45.8 | 5% | 0.053 | 27% | 0.265 | C | S | . | . | trans | -81.1 | 73.5 | 169.3 | -178.4 | 7.9 | 0 | 0 | 0 | 110.6 | N183 A192 Q195 G221 L225 G226 L227 | N183-N223 PolarHBondContact O-ND2 3.27Å; N183-N223 PolarHBondContact O-OD1 2.94Å; N183-N223 PolarHBondContact OD1-ND2 2.65Å; A192-N223 HydrophobicContact CB-CB 4.1Å; A192-N223 PolarHBondContact O-N 2.78Å; Q195-N223 WeakPolarHBondContact O-CB 3.48Å; Q195-N223 PolarHBondContact O-N 3.41Å; G221-N223 PolarHBondContact O-N 3.33Å; N223-L225 VanDerWaalsContact C-N 3.3Å; N223-L225 PolarHBondContact O-N 3.31Å; N223-G226 PolarHBondContact O-N 3.01Å; N223-G226 PolarHBondContact OD1-N 3.08Å; N223-L227 WeakPolarHBondContact O-CG 3.3Å; N223-L227 PolarHBondContact O-N 2.97Å | ||
| 224 | I | 66.1 | Low | 77.5 | Confident | 4 Ų | 4 | 46.7 Ų | 46.7 | 2% | 0.021 | 27% | 0.266 | C | S | . | . | H | α-helix | trans | -68.3 | -32.8 | -175.9 | -52 | 166.7 | 0 | 0 | 0 | 111.1 | I98 V102 M222 G226 L227 V228 I434 E437 | I98-I224 HydrophobicContact CG2-CD1 3.99Å; V102-I224 HydrophobicContact CG1-CG2 4.18Å; M222-I224 HydrophobicContact CB-CD1 4.2Å; M222-I224 HydrophobicContact CB-CG1 3.68Å; M222-I224 HydrophobicContact CE-CD1 4.07Å; M222-I224 PolarHBondContact O-N 3.27Å; I224-G226 VanDerWaalsContact C-N 3.35Å; I224-G226 PolarHBondContact O-N 3.33Å; I224-L227 PolarHBondContact O-N 3.22Å; I224-V228 HydrophobicContact CG2-CG2 4.08Å; I224-V228 WeakPolarHBondContact O-CB 3.45Å; I224-V228 WeakPolarHBondContact O-CG2 3.49Å; I224-V228 PolarHBondContact O-N 2.87Å; I224-I434 HydrophobicContact CB-CB 4.34Å; I224-I434 HydrophobicContact CB-CD1 4.48Å; I224-I434 HydrophobicContact CB-CG1 3.94Å; I224-I434 HydrophobicContact CB-CG2 3.95Å; I224-I434 HydrophobicContact CD1-CB 4.28Å; I224-I434 HydrophobicContact CD1-CG1 3.57Å; I224-I434 HydrophobicContact CG1-CG1 4.33Å; I224-I434 HydrophobicContact CG2-CB 4.26Å; I224-I434 HydrophobicContact CG2-CD1 3.52Å; I224-I434 HydrophobicContact CG2-CG1 3.5Å; I224-I434 VanDerWaalsContact CG2-CG1 3.5Å; I224-I434 HydrophobicContact CG2-CG2 3.92Å; I224-E437 WeakPolarHBondContact CD1-OE2 3.44Å |
| 225 | L | 65.8 | Low | 77.7 | Confident | 21 Ų | 21 | 43.6 Ų | 43.6 | 11% | 0.11 | 25% | 0.246 | C | C | . | . | H | α-helix | trans | -57.1 | -47.2 | 175.1 | 178 | 60 | 0 | 0 | 0 | 111.9 | L180 I184 N223 V228 V229 T413 | L180-L225 HydrophobicContact CD1-CD2 3.52Å; I184-L225 HydrophobicContact CG1-CD1 4.45Å; I184-L225 HydrophobicContact CG1-CD2 3.72Å; I184-L225 HydrophobicContact CG1-CG 4Å; N223-L225 VanDerWaalsContact C-N 3.3Å; N223-L225 PolarHBondContact O-N 3.31Å; L225-V228 PolarHBondContact O-N 3.47Å; L225-V229 HydrophobicContact CD1-CG2 4.44Å; L225-V229 WeakPolarHBondContact O-CG2 3.43Å; L225-V229 PolarHBondContact O-N 3.37Å; L225-V229 VanDerWaalsContact O-N 3.09Å; L225-T413 HydrophobicContact CD1-CG2 4.25Å |
| 226 | G | 76 | Confident | 77.7 | Confident | 0 Ų | 0 | 44.3 Ų | 44.3 | 0% | 0 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -62.5 | -41.5 | 176 | 0 | 0 | 0 | 0 | 0 | 112.7 | N183 N223 I224 V229 F230 | N183-G226 WeakPolarHBondContact O-CA 3.32Å; N183-G226 PolarHBondContact O-N 2.93Å; N223-G226 PolarHBondContact O-N 3.01Å; N223-G226 PolarHBondContact OD1-N 3.08Å; I224-G226 VanDerWaalsContact C-N 3.35Å; I224-G226 PolarHBondContact O-N 3.33Å; G226-V229 PolarHBondContact O-N 3.46Å; G226-F230 VanDerWaalsContact O-CB 3.28Å; G226-F230 WeakPolarHBondContact O-CB 3.35Å; G226-F230 PolarHBondContact O-N 2.83Å |
| 227 | L | 78.8 | Confident | 78 | Confident | 11 Ų | 11 | 44.5 Ų | 44.5 | 6% | 0.058 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -64 | -39.4 | 176.4 | -66.5 | 176.2 | 0 | 0 | 0 | 112.5 | I99 V103 A192 N223 I224 A231 | I99-L227 HydrophobicContact CG2-CD1 4.49Å; V103-L227 HydrophobicContact CG2-CB 4.29Å; A192-L227 HydrophobicContact CB-CD2 4.2Å; A192-L227 HydrophobicContact CB-CG 4.44Å; N223-L227 WeakPolarHBondContact O-CG 3.3Å; N223-L227 PolarHBondContact O-N 2.97Å; I224-L227 PolarHBondContact O-N 3.22Å; L227-A231 WeakPolarHBondContact O-CB 3.01Å; L227-A231 PolarHBondContact O-N 3.49Å |
| 228 | V | 74.3 | Confident | 78.5 | Confident | 6 Ų | 6 | 42.4 Ų | 42.4 | 4% | 0.036 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -62.5 | -51.6 | 176.8 | 165.5 | 0 | 0 | 0 | 0 | 110.6 | V102 L106 I224 L225 F230 A231 I232 | V102-V228 HydrophobicContact CG1-CG2 3.68Å; L106-V228 HydrophobicContact CD1-CB 3.88Å; L106-V228 HydrophobicContact CD1-CG1 3.73Å; L106-V228 HydrophobicContact CD1-CG2 3.68Å; I224-V228 HydrophobicContact CG2-CG2 4.08Å; I224-V228 WeakPolarHBondContact O-CB 3.45Å; I224-V228 WeakPolarHBondContact O-CG2 3.49Å; I224-V228 PolarHBondContact O-N 2.87Å; L225-V228 PolarHBondContact O-N 3.47Å; V228-F230 VanDerWaalsContact C-N 3.34Å; V228-F230 PolarHBondContact O-N 3.2Å; V228-A231 PolarHBondContact O-N 2.92Å; V228-I232 HydrophobicContact CG1-CD1 3.9Å; V228-I232 WeakPolarHBondContact O-CG1 3.35Å; V228-I232 PolarHBondContact O-N 3.01Å |
| 229 | V | 78.9 | Confident | 78.7 | Confident | 39 Ų | 39 | 41.7 Ų | 41.7 | 24% | 0.236 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -63.8 | -43.7 | -178.7 | 172.9 | 0 | 0 | 0 | 0 | 110.5 | I184 L225 G226 I232 V233 | I184-V229 HydrophobicContact CG2-CB 4.42Å; I184-V229 HydrophobicContact CG2-CG1 4.04Å; I184-V229 HydrophobicContact CG2-CG2 4.14Å; L225-V229 HydrophobicContact CD1-CG2 4.44Å; L225-V229 WeakPolarHBondContact O-CG2 3.43Å; L225-V229 PolarHBondContact O-N 3.37Å; L225-V229 VanDerWaalsContact O-N 3.09Å; G226-V229 PolarHBondContact O-N 3.46Å; V229-I232 PolarHBondContact O-N 2.8Å; V229-V233 WeakPolarHBondContact O-CG2 3.42Å; V229-V233 PolarHBondContact O-N 3.33Å |
| 230 | F | 89.1 | Confident | 79.5 | Confident | 73 Ų | 73 | 46.5 Ų | 46.5 | 32% | 0.32 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -57.7 | -50.2 | 172.9 | 170.3 | -100.4 | 0 | 0 | 0 | 111.8 | L189 G226 V228 I232 V233 F234 | L189-F230 HydrophobicContact CD1-CD1 4.11Å; L189-F230 HydrophobicContact CD1-CD2 3.84Å; L189-F230 HydrophobicContact CD1-CE1 3.77Å; L189-F230 HydrophobicContact CD1-CE2 3.47Å; L189-F230 VanDerWaalsContact CD1-CE2 3.47Å; L189-F230 HydrophobicContact CD1-CG 4.15Å; L189-F230 HydrophobicContact CD1-CZ 3.43Å; L189-F230 VanDerWaalsContact CD1-CZ 3.43Å; L189-F230 HydrophobicContact CD2-CB 3.91Å; L189-F230 HydrophobicContact CD2-CD1 3.87Å; L189-F230 HydrophobicContact CD2-CD2 3.78Å; L189-F230 HydrophobicContact CD2-CE1 4.38Å; L189-F230 HydrophobicContact CD2-CE2 4.3Å; L189-F230 HydrophobicContact CD2-CG 3.54Å; L189-F230 HydrophobicContact CG-CD2 4.43Å; L189-F230 HydrophobicContact CG-CE2 4.5Å; G226-F230 VanDerWaalsContact O-CB 3.28Å; G226-F230 WeakPolarHBondContact O-CB 3.35Å; G226-F230 PolarHBondContact O-N 2.83Å; V228-F230 VanDerWaalsContact C-N 3.34Å; V228-F230 PolarHBondContact O-N 3.2Å; F230-I232 VanDerWaalsContact C-N 3.34Å; F230-I232 PolarHBondContact O-N 2.79Å; F230-V233 PolarHBondContact O-N 2.89Å; F230-F234 HydrophobicContact CE1-CB 4.33Å; F230-F234 HydrophobicContact CE1-CG 4.43Å; F230-F234 HydrophobicContact CE2-CB 4.32Å; F230-F234 HydrophobicContact CE2-CD2 4.47Å; F230-F234 HydrophobicContact CZ-CB 4.12Å; F230-F234 HydrophobicContact CZ-CD2 4.16Å; F230-F234 HydrophobicContact CZ-CG 4.03Å; F230-F234 WeakPolarHBondContact O-CB 3.48Å; F230-F234 PolarHBondContact O-N 3.43Å |
| 231 | A | 84.6 | Confident | 80.6 | Confident | 0 Ų | 0 | 44 Ų | 44 | 0% | 0 | 23% | 0.23 | C | C | . | . | H | α-helix | trans | -59.9 | -41.7 | -178.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | L106 V107 L227 V228 G235 | L106-A231 HydrophobicContact CB-CB 3.72Å; L106-A231 HydrophobicContact CD1-CB 4.37Å; V107-A231 HydrophobicContact CG2-CB 3.82Å; V107-A231 WeakPolarHBondContact CG2-O 3.22Å; L227-A231 WeakPolarHBondContact O-CB 3.01Å; L227-A231 PolarHBondContact O-N 3.49Å; V228-A231 PolarHBondContact O-N 2.92Å; A231-G235 PolarHBondContact O-N 3.3Å |
| 232 | I | 80.4 | Confident | 81.8 | Confident | 59 Ų | 59 | 44.3 Ų | 44.3 | 30% | 0.303 | 23% | 0.234 | S | C | . | . | H | α-helix | trans | -64.3 | -52.1 | 177 | -68 | 167.3 | 0 | 0 | 0 | 110.5 | L106 A110 V228 V229 F230 F234 G235 V236 | L106-I232 HydrophobicContact CD2-CG1 4.32Å; A110-I232 HydrophobicContact CB-CG2 4.38Å; V228-I232 HydrophobicContact CG1-CD1 3.9Å; V228-I232 WeakPolarHBondContact O-CG1 3.35Å; V228-I232 PolarHBondContact O-N 3.01Å; V229-I232 PolarHBondContact O-N 2.8Å; F230-I232 VanDerWaalsContact C-N 3.34Å; F230-I232 PolarHBondContact O-N 2.79Å; I232-F234 VanDerWaalsContact C-N 3.28Å; I232-F234 PolarHBondContact O-N 3.46Å; I232-G235 PolarHBondContact O-N 3.16Å; I232-V236 WeakPolarHBondContact O-CG2 3.33Å; I232-V236 PolarHBondContact O-N 3.5Å |
| 233 | V | 87.8 | Confident | 82.9 | Confident | 94 Ų | 94 | 51.1 Ų | 51.1 | 57% | 0.57 | 27% | 0.265 | S | S | * | . | H | α-helix | trans | -62.1 | -40 | -179.6 | 174 | 0 | 0 | 0 | 0 | 110.7 | V229 F230 V236 A237 | V229-V233 WeakPolarHBondContact O-CG2 3.42Å; V229-V233 PolarHBondContact O-N 3.33Å; F230-V233 PolarHBondContact O-N 2.89Å; V233-V236 PolarHBondContact O-N 3.45Å; V233-A237 WeakPolarHBondContact O-CB 3.48Å; V233-A237 PolarHBondContact O-N 2.94Å |
| 234 | F | 92.4 | Very high | 83.9 | Confident | 65 Ų | 65 | 58 Ų | 58 | 29% | 0.285 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -67 | -42.9 | 177.7 | -171.1 | -113.4 | 0 | 0 | 0 | 112 | V107 F230 I232 V236 A237 L238 F252 | V107-F234 HydrophobicContact CG1-CD1 4.09Å; V107-F234 HydrophobicContact CG2-CD1 3.94Å; F230-F234 HydrophobicContact CE1-CB 4.33Å; F230-F234 HydrophobicContact CE1-CG 4.43Å; F230-F234 HydrophobicContact CE2-CB 4.32Å; F230-F234 HydrophobicContact CE2-CD2 4.47Å; F230-F234 HydrophobicContact CZ-CB 4.12Å; F230-F234 HydrophobicContact CZ-CD2 4.16Å; F230-F234 HydrophobicContact CZ-CG 4.03Å; F230-F234 WeakPolarHBondContact O-CB 3.48Å; F230-F234 PolarHBondContact O-N 3.43Å; I232-F234 VanDerWaalsContact C-N 3.28Å; I232-F234 PolarHBondContact O-N 3.46Å; F234-V236 PolarHBondContact O-N 2.94Å; F234-A237 WeakPolarHBondContact O-CB 3.38Å; F234-A237 PolarHBondContact O-N 3.41Å; F234-L238 HydrophobicContact CD1-CD1 4.06Å; F234-L238 HydrophobicContact CD1-CG 4.28Å; F234-L238 HydrophobicContact CE1-CD1 3.74Å; F234-L238 HydrophobicContact CE1-CD2 4.23Å; F234-L238 HydrophobicContact CE1-CG 4.02Å; F234-L238 HydrophobicContact CE2-CD2 4.43Å; F234-L238 HydrophobicContact CZ-CD1 4.32Å; F234-L238 HydrophobicContact CZ-CD2 3.96Å; F234-L238 HydrophobicContact CZ-CG 4.19Å; F234-L238 WeakPolarHBondContact O-CG 3.31Å; F234-L238 PolarHBondContact O-N 3.49Å; F234-F252 HydrophobicContact CD1-CE2 4.47Å; F234-F252 AromaticContact CE1-CE2 3.78Å; F234-F252 HydrophobicContact CE1-CE2 3.78Å; F234-F252 HydrophobicContact CE1-CZ 4.03Å |
| 235 | G | 86.8 | Confident | 85.1 | Confident | 0 Ų | 0 | 57.9 Ų | 57.9 | 0% | 0 | 30% | 0.296 | C | S | . | . | H | α-helix | trans | -60.3 | -44 | 173.9 | 0 | 0 | 0 | 0 | 0 | 112.6 | V107 A111 A231 I232 A237 L238 R239 | V107-G235 WeakPolarHBondContact O-CA 3.26Å; A111-G235 WeakPolarHBondContact CA-O 3.47Å; A111-G235 WeakPolarHBondContact CB-O 3.45Å; A231-G235 PolarHBondContact O-N 3.3Å; I232-G235 PolarHBondContact O-N 3.16Å; G235-A237 VanDerWaalsContact C-N 3.32Å; G235-A237 PolarHBondContact O-N 3.46Å; G235-L238 PolarHBondContact O-N 3.24Å; G235-R239 PolarHBondContact O-N 3.02Å |
| 236 | V | 85.8 | Confident | 86.2 | Confident | 76 Ų | 76 | 61.3 Ų | 61.3 | 46% | 0.461 | 31% | 0.312 | S | S | . | . | H | α-helix | trans | -62.4 | -40.1 | 173.7 | 174 | 0 | 0 | 0 | 0 | 111.3 | A110 I232 V233 F234 R239 K240 | A110-V236 HydrophobicContact CB-CG2 4.39Å; I232-V236 WeakPolarHBondContact O-CG2 3.33Å; I232-V236 PolarHBondContact O-N 3.5Å; V233-V236 PolarHBondContact O-N 3.45Å; F234-V236 PolarHBondContact O-N 2.94Å; V236-R239 PolarHBondContact O-N 3.2Å; V236-K240 PolarHBondContact O-N 3.37Å |
| 237 | A | 91.1 | Very high | 87.2 | Confident | 41 Ų | 41 | 67.8 Ų | 67.8 | 34% | 0.339 | 35% | 0.345 | S | S | . | . | H | α-helix | trans | -62.4 | -49.7 | 175.3 | 0 | 0 | 0 | 0 | 0 | 111.3 | V233 F234 G235 R239 K240 L241 | V233-A237 WeakPolarHBondContact O-CB 3.48Å; V233-A237 PolarHBondContact O-N 2.94Å; F234-A237 WeakPolarHBondContact O-CB 3.38Å; F234-A237 PolarHBondContact O-N 3.41Å; G235-A237 VanDerWaalsContact C-N 3.32Å; G235-A237 PolarHBondContact O-N 3.46Å; A237-R239 PolarHBondContact O-N 3.12Å; A237-K240 WeakPolarHBondContact O-CA 3.44Å; A237-K240 WeakPolarHBondContact O-CB 3.46Å; A237-K240 PolarHBondContact O-N 3.03Å; A237-L241 WeakPolarHBondContact O-CD1 3.14Å; A237-L241 PolarHBondContact O-N 3.14Å |
| 238 | L | 91.3 | Very high | 87.9 | Confident | 5 Ų | 5 | 71 Ų | 71 | 3% | 0.026 | 36% | 0.362 | C | S | . | . | H | α-helix | trans | -55.1 | -41.3 | 176 | -70.7 | -177.4 | 0 | 0 | 0 | 111.8 | V107 F234 G235 K240 L241 L248 I249 F252 | V107-L238 HydrophobicContact CG1-CD1 3.66Å; F234-L238 HydrophobicContact CD1-CD1 4.06Å; F234-L238 HydrophobicContact CD1-CG 4.28Å; F234-L238 HydrophobicContact CE1-CD1 3.74Å; F234-L238 HydrophobicContact CE1-CD2 4.23Å; F234-L238 HydrophobicContact CE1-CG 4.02Å; F234-L238 HydrophobicContact CE2-CD2 4.43Å; F234-L238 HydrophobicContact CZ-CD1 4.32Å; F234-L238 HydrophobicContact CZ-CD2 3.96Å; F234-L238 HydrophobicContact CZ-CG 4.19Å; F234-L238 WeakPolarHBondContact O-CG 3.31Å; F234-L238 PolarHBondContact O-N 3.49Å; G235-L238 PolarHBondContact O-N 3.24Å; L238-K240 VanDerWaalsContact C-N 3.31Å; L238-K240 PolarHBondContact O-N 3.15Å; L238-L241 PolarHBondContact O-N 3Å; L238-L248 HydrophobicContact CD1-CB 4.01Å; L238-L248 HydrophobicContact CD2-CB 3.92Å; L238-L248 HydrophobicContact CD2-CD1 3.56Å; L238-L248 HydrophobicContact CD2-CG 4.4Å; L238-I249 HydrophobicContact CB-CD1 4.28Å; L238-I249 HydrophobicContact CB-CG1 4.05Å; L238-I249 HydrophobicContact CD1-CG1 4.23Å; L238-F252 HydrophobicContact CD1-CD2 4.15Å; L238-F252 HydrophobicContact CD1-CE2 4.17Å |
| 239 | R | 85 | Confident | 88.6 | Confident | 85 Ų | 85 | 71.9 Ų | 71.9 | 32% | 0.321 | 37% | 0.366 | S | S | . | . | H | α-helix | trans | -63.7 | -38.7 | 176 | -177.1 | 55.6 | -176.3 | 150.3 | -5.2 | 112.2 | A111 D114 G235 V236 A237 L241 G242 | A111-R239 WeakPolarHBondContact O-CD 3.27Å; D114-R239 IonicContact OD1-CZ 4Å; D114-R239 IonicContact OD1-NE 2.74Å; D114-R239 IonicContact OD1-NH2 3.74Å; D114-R239 IonicContact OD2-CZ 3.72Å; D114-R239 IonicContact OD2-NE 3.99Å; D114-R239 IonicContact OD2-NH2 3.67Å; D114-R239 PolarHBondContact OD2-NH2 3.35Å; G235-R239 PolarHBondContact O-N 3.02Å; V236-R239 PolarHBondContact O-N 3.2Å; A237-R239 PolarHBondContact O-N 3.12Å; R239-L241 VanDerWaalsContact C-N 3.3Å; R239-L241 PolarHBondContact O-N 3.22Å; R239-G242 PolarHBondContact O-N 2.74Å |
| 240 | K | 87.8 | Confident | 89.2 | Confident | 190 Ų | 190 | 75.5 Ų | 75.5 | 83% | 0.826 | 38% | 0.379 | S | S | * | . | H | α-helix | trans | -68.7 | -26.2 | 178.6 | -168.1 | 177.1 | 177.1 | -177 | 0 | 113.1 | V236 A237 L238 G242 | V236-K240 PolarHBondContact O-N 3.37Å; A237-K240 WeakPolarHBondContact O-CA 3.44Å; A237-K240 WeakPolarHBondContact O-CB 3.46Å; A237-K240 PolarHBondContact O-N 3.03Å; L238-K240 VanDerWaalsContact C-N 3.31Å; L238-K240 PolarHBondContact O-N 3.15Å; K240-G242 PolarHBondContact O-N 3.4Å |
| 241 | L | 90.6 | Very high | 89.5 | Confident | 92 Ų | 92 | 77.4 Ų | 77.4 | 48% | 0.482 | 39% | 0.387 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -68.1 | -15.6 | 173.1 | -86.2 | 89.7 | 0 | 0 | 0 | 113.5 | A237 L238 R239 E243 E244 | A237-L241 WeakPolarHBondContact O-CD1 3.14Å; A237-L241 PolarHBondContact O-N 3.14Å; L238-L241 PolarHBondContact O-N 3Å; R239-L241 VanDerWaalsContact C-N 3.3Å; R239-L241 PolarHBondContact O-N 3.22Å; L241-E243 PolarHBondContact O-N 3.32Å; L241-E244 HydrophobicContact CB-CB 4.44Å; L241-E244 HydrophobicContact CD2-CB 4.26Å |
| 242 | G | 87.3 | Confident | 89.7 | Confident | 31 Ų | 31 | 78.7 Ų | 78.7 | 32% | 0.32 | 39% | 0.393 | S | S | . | . | T | Hydrogen-bonded Turn | trans | 68.5 | -125.5 | 179.5 | 0 | 0 | 0 | 0 | 0 | 112.1 | R239 K240 E244 G245 E246 | R239-G242 PolarHBondContact O-N 2.74Å; K240-G242 PolarHBondContact O-N 3.4Å; G242-E244 VanDerWaalsContact C-N 3.34Å; G242-E244 PolarHBondContact O-N 2.96Å; G242-G245 PolarHBondContact O-N 3.46Å; G242-E246 PolarHBondContact O-N 3.43Å |
| 243 | E | 89.9 | Confident | 89.9 | Confident | 172 Ų | 172 | 79.5 Ų | 79.5 | 80% | 0.804 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -63.2 | -37.2 | -175.7 | -64 | -175.4 | 172.9 | 0 | 0 | 112.7 | L241 G245 E246 | L241-E243 PolarHBondContact O-N 3.32Å; E243-G245 PolarHBondContact O-N 3.2Å; E243-E246 WeakPolarHBondContact O-CB 3.41Å; E243-E246 PolarHBondContact O-N 2.87Å; E243-E246 VanDerWaalsContact O-N 3.16Å |
| 244 | E | 91.9 | Very high | 89.9 | Confident | 155 Ų | 155 | 78.9 Ų | 78.9 | 72% | 0.724 | 40% | 0.397 | S | S | * | . | H | α-helix | trans | -63.8 | -31.1 | 178.2 | -64.9 | -172.5 | 170.4 | 0 | 0 | 112.3 | L241 G242 | L241-E244 HydrophobicContact CB-CB 4.44Å; L241-E244 HydrophobicContact CD2-CB 4.26Å; G242-E244 VanDerWaalsContact C-N 3.34Å; G242-E244 PolarHBondContact O-N 2.96Å |
| 245 | G | 90.8 | Very high | 89.7 | Confident | 0 Ų | 0 | 79.8 Ų | 79.8 | 0% | 0 | 40% | 0.401 | C | S | . | . | H | α-helix | trans | -78.5 | -17.9 | 178.2 | 0 | 0 | 0 | 0 | 0 | 114 | G242 E243 I247 L248 I249 | G242-G245 PolarHBondContact O-N 3.46Å; E243-G245 PolarHBondContact O-N 3.2Å; G245-I247 VanDerWaalsContact C-N 3.34Å; G245-I247 PolarHBondContact O-N 3.37Å; G245-L248 PolarHBondContact O-N 3.41Å; G245-I249 WeakPolarHBondContact O-CG1 3.42Å; G245-I249 PolarHBondContact O-N 3.41Å |
| 246 | E | 90.4 | Very high | 89.2 | Confident | 94 Ų | 94 | 81 Ų | 81 | 44% | 0.439 | 41% | 0.408 | S | S | . | . | H | α-helix | trans | -64.6 | -37.2 | -170.6 | -164.8 | -175.3 | 155.9 | 0 | 0 | 112.6 | G242 E243 L248 I249 K250 | G242-E246 PolarHBondContact O-N 3.43Å; E243-E246 WeakPolarHBondContact O-CB 3.41Å; E243-E246 PolarHBondContact O-N 2.87Å; E243-E246 VanDerWaalsContact O-N 3.16Å; E246-L248 VanDerWaalsContact C-N 3.33Å; E246-L248 PolarHBondContact O-N 3.32Å; E246-I249 PolarHBondContact O-N 3.21Å; E246-K250 WeakPolarHBondContact O-CG 3.18Å; E246-K250 PolarHBondContact O-N 2.77Å; E246-K250 WeakPolarHBondContact OE1-CE 3.39Å; E246-K250 IonicContact OE1-NZ 3.61Å; E246-K250 PolarHBondContact OE1-NZ 3.13Å |
| 247 | I | 95.4 | Very high | 88.8 | Confident | 136 Ų | 136 | 83.6 Ų | 83.6 | 70% | 0.697 | 42% | 0.415 | S | S | * | . | H | α-helix | trans | -61.4 | -44.8 | 177.8 | -62.1 | 174.3 | 0 | 0 | 0 | 110.3 | G245 K250 F251 | G245-I247 VanDerWaalsContact C-N 3.34Å; G245-I247 PolarHBondContact O-N 3.37Å; I247-K250 PolarHBondContact O-N 3.41Å; I247-F251 PolarHBondContact O-N 3.16Å |
| 248 | L | 94.9 | Very high | 88.6 | Confident | 77 Ų | 77 | 84.4 Ų | 84.4 | 40% | 0.403 | 42% | 0.422 | S | S | . | . | H | α-helix | trans | -69 | -40.2 | 179.1 | -72.3 | 175.9 | 0 | 0 | 0 | 111.6 | L238 G245 E246 K250 F251 F252 | L238-L248 HydrophobicContact CD1-CB 4.01Å; L238-L248 HydrophobicContact CD2-CB 3.92Å; L238-L248 HydrophobicContact CD2-CD1 3.56Å; L238-L248 HydrophobicContact CD2-CG 4.4Å; G245-L248 PolarHBondContact O-N 3.41Å; E246-L248 VanDerWaalsContact C-N 3.33Å; E246-L248 PolarHBondContact O-N 3.32Å; L248-K250 VanDerWaalsContact C-N 3.32Å; L248-K250 PolarHBondContact O-N 3.41Å; L248-F251 WeakPolarHBondContact O-CB 3.45Å; L248-F251 PolarHBondContact O-N 2.66Å; L248-F251 VanDerWaalsContact O-N 3.17Å; L248-F252 WeakPolarHBondContact O-CD2 3.34Å; L248-F252 PolarHBondContact O-N 3Å |
| 249 | I | 89.1 | Confident | 87.9 | Confident | 26 Ų | 26 | 84.5 Ų | 84.5 | 13% | 0.133 | 42% | 0.422 | C | S | . | . | H | α-helix | trans | -60 | -44 | 175.4 | -64.9 | 166.2 | 0 | 0 | 0 | 110.5 | A111 L238 G245 E246 F251 F252 N253 | A111-I249 HydrophobicContact CB-CD1 3.81Å; A111-I249 HydrophobicContact CB-CG1 3.74Å; A111-I249 HydrophobicContact CB-CG2 4.34Å; L238-I249 HydrophobicContact CB-CD1 4.28Å; L238-I249 HydrophobicContact CB-CG1 4.05Å; L238-I249 HydrophobicContact CD1-CG1 4.23Å; G245-I249 WeakPolarHBondContact O-CG1 3.42Å; G245-I249 PolarHBondContact O-N 3.41Å; E246-I249 PolarHBondContact O-N 3.21Å; I249-F251 VanDerWaalsContact C-N 3.34Å; I249-F251 PolarHBondContact O-N 3.44Å; I249-F252 PolarHBondContact O-N 3.14Å; I249-N253 WeakPolarHBondContact O-CB 3.27Å; I249-N253 VanDerWaalsContact O-CG 3.29Å; I249-N253 PolarHBondContact O-N 3.19Å; I249-N253 PolarHBondContact O-ND2 3.21Å |
| 250 | K | 91.5 | Very high | 87.1 | Confident | 115 Ų | 115 | 82 Ų | 82 | 50% | 0.5 | 42% | 0.415 | S | S | . | . | H | α-helix | trans | -62.9 | -38.6 | 175.3 | -75.6 | 176.4 | -176.1 | 164.7 | 0 | 112.6 | E246 I247 L248 S254 | E246-K250 WeakPolarHBondContact O-CG 3.18Å; E246-K250 PolarHBondContact O-N 2.77Å; E246-K250 WeakPolarHBondContact OE1-CE 3.39Å; E246-K250 IonicContact OE1-NZ 3.61Å; E246-K250 PolarHBondContact OE1-NZ 3.13Å; I247-K250 PolarHBondContact O-N 3.41Å; L248-K250 VanDerWaalsContact C-N 3.32Å; L248-K250 PolarHBondContact O-N 3.41Å; K250-S254 WeakPolarHBondContact O-CB 2.84Å; K250-S254 PolarHBondContact O-N 3.39Å; K250-S254 PolarHBondContact O-OG 2.89Å |
| 251 | F | 95 | Very high | 86.6 | Confident | 112 Ų | 112 | 76 Ų | 76 | 49% | 0.491 | 39% | 0.394 | S | S | . | . | H | α-helix | trans | -59.5 | -52.8 | 173.3 | 167.8 | -94.6 | 0 | 0 | 0 | 111.2 | I247 L248 I249 N253 S254 F255 | I247-F251 PolarHBondContact O-N 3.16Å; L248-F251 WeakPolarHBondContact O-CB 3.45Å; L248-F251 PolarHBondContact O-N 2.66Å; L248-F251 VanDerWaalsContact O-N 3.17Å; I249-F251 VanDerWaalsContact C-N 3.34Å; I249-F251 PolarHBondContact O-N 3.44Å; F251-N253 VanDerWaalsContact C-N 3.35Å; F251-N253 PolarHBondContact O-N 3.35Å; F251-S254 PolarHBondContact O-N 3Å; F251-F255 HydrophobicContact CE2-CD2 4.41Å; F251-F255 HydrophobicContact CZ-CD2 4.05Å; F251-F255 WeakPolarHBondContact O-CB 3.36Å; F251-F255 PolarHBondContact O-N 3.05Å |
| 252 | F | 89.2 | Confident | 86.1 | Confident | 28 Ų | 28 | 75.1 Ų | 75.1 | 12% | 0.123 | 39% | 0.389 | C | S | . | . | H | α-helix | trans | -62.6 | -39.5 | 180 | -77.8 | -70 | 0 | 0 | 0 | 112.6 | V103 C104 V107 S108 F234 L238 L248 I249 F255 N256 | V103-F252 HydrophobicContact CG1-CE1 4.45Å; C104-F252 HydrophobicContact CB-CD1 4.01Å; V107-F252 HydrophobicContact CB-CD1 4.27Å; V107-F252 HydrophobicContact CB-CD2 4.34Å; V107-F252 HydrophobicContact CB-CG 4.14Å; V107-F252 HydrophobicContact CG1-CB 4.25Å; V107-F252 HydrophobicContact CG1-CD1 4.27Å; V107-F252 HydrophobicContact CG1-CD2 3.49Å; V107-F252 VanDerWaalsContact CG1-CD2 3.49Å; V107-F252 HydrophobicContact CG1-CE2 3.86Å; V107-F252 HydrophobicContact CG1-CG 3.74Å; V107-F252 HydrophobicContact CG1-CZ 4.37Å; V107-F252 HydrophobicContact CG2-CE1 4.48Å; S108-F252 WeakPolarHBondContact OG-CB 3.46Å; F234-F252 HydrophobicContact CD1-CE2 4.47Å; F234-F252 AromaticContact CE1-CE2 3.78Å; F234-F252 HydrophobicContact CE1-CE2 3.78Å; F234-F252 HydrophobicContact CE1-CZ 4.03Å; L238-F252 HydrophobicContact CD1-CD2 4.15Å; L238-F252 HydrophobicContact CD1-CE2 4.17Å; L248-F252 WeakPolarHBondContact O-CD2 3.34Å; L248-F252 PolarHBondContact O-N 3Å; I249-F252 PolarHBondContact O-N 3.14Å; F252-F255 PolarHBondContact O-N 3.41Å; F252-N256 VanDerWaalsContact O-CB 3.3Å; F252-N256 WeakPolarHBondContact O-CB 3.2Å; F252-N256 PolarHBondContact O-N 3.22Å |
| 253 | N | 82.8 | Confident | 85.2 | Confident | 75 Ų | 75 | 74.2 Ų | 74.2 | 40% | 0.401 | 38% | 0.378 | S | S | . | . | H | α-helix | trans | -60.2 | -48.4 | 173.8 | -75.4 | -18.1 | 0 | 0 | 0 | 111.9 | S108 I249 F251 F255 N256 E257 | S108-N253 WeakPolarHBondContact CB-OD1 3.5Å; S108-N253 PolarHBondContact OG-N 2.94Å; S108-N253 PolarHBondContact OG-OD1 3.02Å; I249-N253 WeakPolarHBondContact O-CB 3.27Å; I249-N253 VanDerWaalsContact O-CG 3.29Å; I249-N253 PolarHBondContact O-N 3.19Å; I249-N253 PolarHBondContact O-ND2 3.21Å; F251-N253 VanDerWaalsContact C-N 3.35Å; F251-N253 PolarHBondContact O-N 3.35Å; N253-F255 VanDerWaalsContact C-N 3.32Å; N253-F255 PolarHBondContact O-N 3.37Å; N253-N256 PolarHBondContact O-N 3.48Å; N253-E257 PolarHBondContact O-N 3.49Å |
| 254 | S | 88 | Confident | 84.3 | Confident | 81 Ų | 81 | 69.1 Ų | 69.1 | 57% | 0.566 | 36% | 0.361 | S | S | * | . | H | α-helix | trans | -66.2 | -37.8 | -179.1 | -54.5 | 0 | 0 | 0 | 0 | 111.6 | K250 F251 E257 A258 | K250-S254 WeakPolarHBondContact O-CB 2.84Å; K250-S254 PolarHBondContact O-N 3.39Å; K250-S254 PolarHBondContact O-OG 2.89Å; F251-S254 PolarHBondContact O-N 3Å; S254-E257 PolarHBondContact O-N 3.01Å; S254-A258 WeakPolarHBondContact O-CB 3.29Å; S254-A258 PolarHBondContact O-N 3.05Å |
| 255 | F | 88.3 | Confident | 83.9 | Confident | 84 Ų | 84 | 70 Ų | 70 | 37% | 0.368 | 36% | 0.358 | S | S | . | . | H | α-helix | trans | -68.4 | -39.9 | 176.9 | -163.8 | -79.8 | 0 | 0 | 0 | 111.8 | P100 C104 F251 F252 N253 A258 T259 | P100-F255 HydrophobicContact CB-CE1 3.6Å; P100-F255 HydrophobicContact CB-CZ 4.39Å; C104-F255 HydrophobicContact CB-CD1 4.25Å; C104-F255 WeakPolarHBondContact SG-CD1 3.45Å; F251-F255 HydrophobicContact CE2-CD2 4.41Å; F251-F255 HydrophobicContact CZ-CD2 4.05Å; F251-F255 WeakPolarHBondContact O-CB 3.36Å; F251-F255 PolarHBondContact O-N 3.05Å; F252-F255 PolarHBondContact O-N 3.41Å; N253-F255 VanDerWaalsContact C-N 3.32Å; N253-F255 PolarHBondContact O-N 3.37Å; F255-A258 PolarHBondContact O-N 2.61Å; F255-T259 WeakPolarHBondContact O-CB 3.23Å; F255-T259 PolarHBondContact O-N 3.12Å; F255-T259 PolarHBondContact O-OG1 3.3Å |
| 256 | N | 78 | Confident | 83.2 | Confident | 27 Ų | 27 | 70.7 Ų | 70.7 | 14% | 0.144 | 36% | 0.361 | C | S | . | . | H | α-helix | trans | -59.8 | -50.3 | 173.4 | -170.5 | 41.3 | 0 | 0 | 0 | 110.5 | L101 C104 F252 N253 A258 T259 M260 | L101-N256 WeakPolarHBondContact CD1-OD1 3.47Å; C104-N256 HydrophobicContact CB-CB 4.09Å; F252-N256 VanDerWaalsContact O-CB 3.3Å; F252-N256 WeakPolarHBondContact O-CB 3.2Å; F252-N256 PolarHBondContact O-N 3.22Å; N253-N256 PolarHBondContact O-N 3.48Å; N256-A258 VanDerWaalsContact C-N 3.34Å; N256-A258 PolarHBondContact O-N 3.18Å; N256-T259 WeakPolarHBondContact O-CA 3.42Å; N256-T259 WeakPolarHBondContact O-CB 3.48Å; N256-T259 PolarHBondContact O-N 2.94Å; N256-M260 VanDerWaalsContact O-CG 3.27Å; N256-M260 WeakPolarHBondContact O-CG 3.5Å; N256-M260 PolarHBondContact O-N 3.21Å |
| 257 | E | 77.6 | Confident | 82.2 | Confident | 129 Ų | 129 | 67.8 Ų | 67.8 | 60% | 0.603 | 35% | 0.348 | S | S | * | . | H | α-helix | trans | -59.8 | -42.7 | 178.6 | -165.7 | 63 | -153.6 | 0 | 0 | 112.2 | N253 S254 T259 M260 V261 | N253-E257 PolarHBondContact O-N 3.49Å; S254-E257 PolarHBondContact O-N 3.01Å; E257-T259 VanDerWaalsContact C-N 3.31Å; E257-T259 PolarHBondContact O-N 3.37Å; E257-M260 WeakPolarHBondContact O-CB 3.3Å; E257-M260 PolarHBondContact O-N 3.41Å; E257-V261 PolarHBondContact O-N 3.46Å |
| 258 | A | 85.1 | Confident | 81.5 | Confident | 58 Ų | 58 | 68.3 Ų | 68.3 | 48% | 0.479 | 34% | 0.341 | S | S | . | . | H | α-helix | trans | -61.2 | -39.7 | 174.3 | 0 | 0 | 0 | 0 | 0 | 112.2 | S254 F255 N256 M260 V261 L262 | S254-A258 WeakPolarHBondContact O-CB 3.29Å; S254-A258 PolarHBondContact O-N 3.05Å; F255-A258 PolarHBondContact O-N 2.61Å; N256-A258 VanDerWaalsContact C-N 3.34Å; N256-A258 PolarHBondContact O-N 3.18Å; A258-M260 VanDerWaalsContact C-N 3.31Å; A258-M260 PolarHBondContact O-N 2.91Å; A258-V261 WeakPolarHBondContact O-CB 3.48Å; A258-V261 PolarHBondContact O-N 3.22Å; A258-L262 PolarHBondContact O-N 3.43Å |
| 259 | T | 76.7 | Confident | 80.8 | Confident | 7 Ų | 7 | 67.5 Ų | 67.5 | 4% | 0.043 | 33% | 0.334 | C | S | . | . | H | α-helix | trans | -64.8 | -37.3 | 176.2 | -54.9 | 0 | 0 | 0 | 0 | 111 | P100 L101 F255 N256 E257 V261 L262 V263 | P100-T259 HydrophobicContact CB-CG2 4.36Å; P100-T259 HydrophobicContact CG-CG2 4.33Å; L101-T259 HydrophobicContact CB-CG2 4.16Å; L101-T259 HydrophobicContact CD1-CG2 4.3Å; F255-T259 WeakPolarHBondContact O-CB 3.23Å; F255-T259 PolarHBondContact O-N 3.12Å; F255-T259 PolarHBondContact O-OG1 3.3Å; N256-T259 WeakPolarHBondContact O-CA 3.42Å; N256-T259 WeakPolarHBondContact O-CB 3.48Å; N256-T259 PolarHBondContact O-N 2.94Å; E257-T259 VanDerWaalsContact C-N 3.31Å; E257-T259 PolarHBondContact O-N 3.37Å; T259-V261 VanDerWaalsContact C-N 3.29Å; T259-V261 PolarHBondContact O-N 2.95Å; T259-L262 WeakPolarHBondContact O-CA 3.38Å; T259-L262 VanDerWaalsContact O-CB 3.31Å; T259-L262 WeakPolarHBondContact O-CB 3.34Å; T259-L262 PolarHBondContact O-N 3Å; T259-V263 WeakPolarHBondContact O-CG2 3.36Å; T259-V263 PolarHBondContact O-N 3.34Å |
| 260 | M | 68.1 | Low | 80.1 | Confident | 32 Ų | 32 | 66.6 Ų | 66.6 | 16% | 0.158 | 33% | 0.33 | C | S | . | . | H | α-helix | trans | -64.9 | -31 | 177.2 | -64.9 | -67.1 | -91.4 | 0 | 0 | 113.2 | L101 N256 E257 A258 V263 S264 A422 I424 | L101-M260 HydrophobicContact CD1-CG 4.46Å; L101-M260 HydrophobicContact CD1-SD 3.65Å; N256-M260 VanDerWaalsContact O-CG 3.27Å; N256-M260 WeakPolarHBondContact O-CG 3.5Å; N256-M260 PolarHBondContact O-N 3.21Å; E257-M260 WeakPolarHBondContact O-CB 3.3Å; E257-M260 PolarHBondContact O-N 3.41Å; A258-M260 VanDerWaalsContact C-N 3.31Å; A258-M260 PolarHBondContact O-N 2.91Å; M260-V263 WeakPolarHBondContact O-CB 3.49Å; M260-V263 PolarHBondContact O-N 2.86Å; M260-S264 PolarHBondContact O-N 3.41Å; M260-S264 PolarHBondContact O-OG 2.98Å; M260-A422 HydrophobicContact CE-CB 3.71Å; M260-A422 HydrophobicContact SD-CB 4.14Å; M260-I424 HydrophobicContact CE-CB 4.16Å; M260-I424 HydrophobicContact CE-CD1 3.89Å; M260-I424 HydrophobicContact CE-CG1 3.96Å; M260-I424 HydrophobicContact CE-CG2 3.2Å; M260-I424 HydrophobicContact SD-CD1 3.9Å; M260-I424 HydrophobicContact SD-CG2 4.49Å |
| 261 | V | 78.8 | Confident | 79.5 | Confident | 66 Ų | 66 | 61.7 Ų | 61.7 | 40% | 0.4 | 31% | 0.31 | S | S | . | . | H | α-helix | trans | -63.9 | -42.2 | 170.6 | 177.9 | 0 | 0 | 0 | 0 | 110.8 | E257 A258 T259 S264 W265 | E257-V261 PolarHBondContact O-N 3.46Å; A258-V261 WeakPolarHBondContact O-CB 3.48Å; A258-V261 PolarHBondContact O-N 3.22Å; T259-V261 VanDerWaalsContact C-N 3.29Å; T259-V261 PolarHBondContact O-N 2.95Å; V261-S264 WeakPolarHBondContact O-CB 3.48Å; V261-S264 PolarHBondContact O-N 2.87Å; V261-W265 HydrophobicContact CG1-CH2 4.42Å; V261-W265 HydrophobicContact CG1-CZ2 3.69Å; V261-W265 PolarHBondContact O-N 3.41Å |
| 262 | L | 79.1 | Confident | 79.1 | Confident | 72 Ų | 72 | 60.4 Ų | 60.4 | 38% | 0.377 | 31% | 0.307 | S | S | . | . | H | α-helix | trans | -62.3 | -43.5 | 175.2 | -60 | 177.8 | 0 | 0 | 0 | 111.5 | A258 T259 S264 W265 I266 | A258-L262 PolarHBondContact O-N 3.43Å; T259-L262 WeakPolarHBondContact O-CA 3.38Å; T259-L262 VanDerWaalsContact O-CB 3.31Å; T259-L262 WeakPolarHBondContact O-CB 3.34Å; T259-L262 PolarHBondContact O-N 3Å; L262-S264 VanDerWaalsContact C-N 3.26Å; L262-S264 PolarHBondContact O-N 3.22Å; L262-W265 HydrophobicContact CD2-CE3 3.73Å; L262-W265 HydrophobicContact CD2-CH2 4.44Å; L262-W265 HydrophobicContact CD2-CZ3 3.57Å; L262-W265 PolarHBondContact O-N 2.93Å; L262-W265 VanDerWaalsContact O-N 3.14Å; L262-I266 WeakPolarHBondContact O-CG1 3.31Å; L262-I266 PolarHBondContact O-N 3.34Å |
| 263 | V | 67.9 | Low | 78.6 | Confident | 12 Ų | 12 | 59 Ų | 59 | 7% | 0.073 | 30% | 0.301 | C | S | . | . | H | α-helix | trans | -55.1 | -46 | 174.7 | 179.1 | 0 | 0 | 0 | 0 | 110.3 | I97 T259 M260 W265 I266 M267 I424 | I97-V263 HydrophobicContact CD1-CG2 3.7Å; T259-V263 WeakPolarHBondContact O-CG2 3.36Å; T259-V263 PolarHBondContact O-N 3.34Å; M260-V263 WeakPolarHBondContact O-CB 3.49Å; M260-V263 PolarHBondContact O-N 2.86Å; V263-W265 VanDerWaalsContact C-N 3.3Å; V263-W265 PolarHBondContact O-N 2.79Å; V263-I266 PolarHBondContact O-N 3.47Å; V263-I266 VanDerWaalsContact O-N 3.13Å; V263-M267 HydrophobicContact CG1-CG 4.22Å; V263-M267 VanDerWaalsContact O-CG 3.3Å; V263-M267 WeakPolarHBondContact O-CG 3.44Å; V263-M267 PolarHBondContact O-N 2.94Å; V263-I424 HydrophobicContact CG1-CD1 3.79Å |
| 264 | S | 71.8 | Confident | 78.2 | Confident | 66 Ų | 66 | 56.1 Ų | 56.1 | 46% | 0.462 | 29% | 0.286 | S | S | . | . | H | α-helix | trans | -59 | -39.9 | 179.4 | -60.3 | 0 | 0 | 0 | 0 | 112.4 | M260 V261 L262 M267 W268 | M260-S264 PolarHBondContact O-N 3.41Å; M260-S264 PolarHBondContact O-OG 2.98Å; V261-S264 WeakPolarHBondContact O-CB 3.48Å; V261-S264 PolarHBondContact O-N 2.87Å; L262-S264 VanDerWaalsContact C-N 3.26Å; L262-S264 PolarHBondContact O-N 3.22Å; S264-M267 PolarHBondContact O-N 2.77Å; S264-W268 VanDerWaalsContact O-CD1 3.27Å; S264-W268 PolarHBondContact O-N 3.42Å |
| 265 | W | 83.3 | Confident | 77.9 | Confident | 173 Ų | 173 | 53.9 Ų | 53.9 | 66% | 0.655 | 27% | 0.266 | S | S | * | . | H | α-helix | trans | -67.5 | -41.5 | 175.1 | -60.1 | -14.7 | 0 | 0 | 0 | 112.5 | V261 L262 V263 M267 W268 Y269 | V261-W265 HydrophobicContact CG1-CH2 4.42Å; V261-W265 HydrophobicContact CG1-CZ2 3.69Å; V261-W265 PolarHBondContact O-N 3.41Å; L262-W265 HydrophobicContact CD2-CE3 3.73Å; L262-W265 HydrophobicContact CD2-CH2 4.44Å; L262-W265 HydrophobicContact CD2-CZ3 3.57Å; L262-W265 PolarHBondContact O-N 2.93Å; L262-W265 VanDerWaalsContact O-N 3.14Å; V263-W265 VanDerWaalsContact C-N 3.3Å; V263-W265 PolarHBondContact O-N 2.79Å; W265-M267 VanDerWaalsContact C-N 3.27Å; W265-M267 PolarHBondContact O-N 3.42Å; W265-W268 PolarHBondContact O-N 2.95Å; W265-Y269 PolarHBondContact O-N 3.35Å |
| 266 | I | 75.7 | Confident | 77.7 | Confident | 14 Ų | 14 | 52.4 Ų | 52.4 | 7% | 0.072 | 26% | 0.26 | C | S | . | . | H | α-helix | trans | -61.8 | -38.9 | 175.9 | -65.1 | 164.8 | 0 | 0 | 0 | 110.4 | L90 L93 L94 I97 L262 V263 W268 Y269 A270 | L90-I266 HydrophobicContact CD1-CG2 3.99Å; L93-I266 HydrophobicContact CB-CD1 4.15Å; L93-I266 HydrophobicContact CB-CG1 4.21Å; L93-I266 HydrophobicContact CB-CG2 4.13Å; L94-I266 HydrophobicContact CD2-CG2 3.81Å; L94-I266 HydrophobicContact CG-CG2 4.45Å; I97-I266 HydrophobicContact CD1-CD1 4.21Å; I97-I266 HydrophobicContact CG2-CD1 3.62Å; L262-I266 WeakPolarHBondContact O-CG1 3.31Å; L262-I266 PolarHBondContact O-N 3.34Å; V263-I266 PolarHBondContact O-N 3.47Å; V263-I266 VanDerWaalsContact O-N 3.13Å; I266-W268 VanDerWaalsContact C-N 3.27Å; I266-W268 PolarHBondContact O-N 3.47Å; I266-Y269 CarbonylContact O-C 3.29Å; I266-Y269 WeakPolarHBondContact O-CA 3.48Å; I266-Y269 WeakPolarHBondContact O-CB 3.42Å; I266-Y269 PolarHBondContact O-N 3.01Å; I266-A270 PolarHBondContact O-N 3.16Å |
| 267 | M | 71.1 | Confident | 77.4 | Confident | 33 Ų | 33 | 52 Ų | 52 | 16% | 0.163 | 26% | 0.258 | C | S | . | . | H | α-helix | trans | -63 | -32.6 | 177.9 | -69.5 | -60.2 | -107.1 | 0 | 0 | 112.5 | L52 V263 S264 W265 Y269 A270 P271 P425 A426 | L52-M267 WeakPolarHBondContact CD1-O 3.44Å; L52-M267 HydrophobicContact CD2-CB 4.28Å; V263-M267 HydrophobicContact CG1-CG 4.22Å; V263-M267 VanDerWaalsContact O-CG 3.3Å; V263-M267 WeakPolarHBondContact O-CG 3.44Å; V263-M267 PolarHBondContact O-N 2.94Å; S264-M267 PolarHBondContact O-N 2.77Å; W265-M267 VanDerWaalsContact C-N 3.27Å; W265-M267 PolarHBondContact O-N 3.42Å; M267-Y269 VanDerWaalsContact C-N 3.27Å; M267-Y269 PolarHBondContact O-N 3.17Å; M267-A270 VanDerWaalsContact O-CB 3.23Å; M267-A270 WeakPolarHBondContact O-CB 3.27Å; M267-A270 PolarHBondContact O-N 3.46Å; M267-A270 VanDerWaalsContact O-N 3.14Å; M267-A270 HydrophobicContact SD-CB 4.45Å; M267-P271 VanDerWaalsContact O-CD 3.29Å; M267-P271 WeakPolarHBondContact O-CD 2.99Å; M267-P425 HydrophobicContact CE-CB 3.96Å; M267-P425 VanDerWaalsContact CE-O 3.27Å; M267-P425 WeakPolarHBondContact CE-O 3.31Å; M267-A426 HydrophobicContact CE-CB 3.77Å |
| 268 | W | 79.3 | Confident | 77.3 | Confident | 147 Ų | 147 | 46.5 Ų | 46.5 | 56% | 0.557 | 23% | 0.233 | S | C | * | . | H | α-helix | trans | -67.3 | -25.9 | 171.8 | -81.4 | 102.2 | 0 | 0 | 0 | 113.8 | L51 L52 L55 S264 W265 I266 P271 | L51-W268 HydrophobicContact CD2-CH2 3.95Å; L51-W268 HydrophobicContact CD2-CZ3 4.21Å; L51-W268 HydrophobicContact CG-CH2 4.41Å; L51-W268 HydrophobicContact CG-CZ3 4.5Å; L52-W268 HydrophobicContact CD1-CE3 4.5Å; L55-W268 HydrophobicContact CD1-CZ3 4.14Å; S264-W268 VanDerWaalsContact O-CD1 3.27Å; S264-W268 PolarHBondContact O-N 3.42Å; W265-W268 PolarHBondContact O-N 2.95Å; I266-W268 VanDerWaalsContact C-N 3.27Å; I266-W268 PolarHBondContact O-N 3.47Å; W268-P271 WeakPolarHBondContact O-CD 3.47Å |
| 269 | Y | 81.6 | Confident | 77.1 | Confident | 61 Ų | 61 | 43.8 Ų | 43.8 | 24% | 0.239 | 21% | 0.21 | C | C | . | . | H | α-helix | trans | -79.7 | -25.5 | 170.9 | 179.8 | -107.2 | 0 | 0 | 0 | 112.7 | P86 I89 L90 L93 W265 I266 M267 P271 I272 G273 | P86-Y269 WeakPolarHBondContact CA-OH 3.34Å; P86-Y269 PolarHBondContact O-OH 3.21Å; I89-Y269 HydrophobicContact CB-CE1 4.35Å; I89-Y269 HydrophobicContact CG2-CE1 3.95Å; L90-Y269 HydrophobicContact CB-CD1 4.21Å; L90-Y269 HydrophobicContact CB-CE1 3.91Å; L90-Y269 HydrophobicContact CD1-CD1 4.05Å; L93-Y269 HydrophobicContact CD1-CD1 4.05Å; L93-Y269 HydrophobicContact CD1-CE1 4.38Å; W265-Y269 PolarHBondContact O-N 3.35Å; I266-Y269 CarbonylContact O-C 3.29Å; I266-Y269 WeakPolarHBondContact O-CA 3.48Å; I266-Y269 WeakPolarHBondContact O-CB 3.42Å; I266-Y269 PolarHBondContact O-N 3.01Å; M267-Y269 VanDerWaalsContact C-N 3.27Å; M267-Y269 PolarHBondContact O-N 3.17Å; Y269-P271 VanDerWaalsContact C-CD 3.44Å; Y269-I272 HydrophobicContact CE2-CB 4.46Å; Y269-I272 HydrophobicContact CE2-CG2 4.41Å; Y269-I272 PolarHBondContact O-N 3.21Å; Y269-G273 PolarHBondContact O-N 3.47Å; Y269-G273 VanDerWaalsContact O-N 3.15Å |
| 270 | A | 72.8 | Confident | 77 | Confident | 7 Ų | 7 | 44 Ų | 44 | 6% | 0.058 | 22% | 0.215 | C | C | . | . | H | α-helix | trans | -52 | -40.7 | -174.9 | 0 | 0 | 0 | 0 | 0 | 115.1 | L90 I266 M267 I272 G273 I274 | L90-A270 HydrophobicContact CD1-CB 4.22Å; L90-A270 HydrophobicContact CD2-CB 4.43Å; I266-A270 PolarHBondContact O-N 3.16Å; M267-A270 VanDerWaalsContact O-CB 3.23Å; M267-A270 WeakPolarHBondContact O-CB 3.27Å; M267-A270 PolarHBondContact O-N 3.46Å; M267-A270 VanDerWaalsContact O-N 3.14Å; M267-A270 HydrophobicContact SD-CB 4.45Å; A270-I272 VanDerWaalsContact C-N 3.26Å; A270-I272 PolarHBondContact O-N 3.2Å; A270-G273 PolarHBondContact O-N 3.34Å; A270-I274 HydrophobicContact CB-CD1 4.2Å; A270-I274 VanDerWaalsContact O-CB 3.3Å; A270-I274 WeakPolarHBondContact O-CB 3.42Å; A270-I274 WeakPolarHBondContact O-CG1 3.38Å; A270-I274 PolarHBondContact O-N 3.36Å |
| 271 | P | 80.4 | Confident | 77.1 | Confident | 12 Ų | 12 | 43.8 Ų | 43.8 | 8% | 0.078 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -54.1 | -40.8 | 175.9 | -27.5 | 33.9 | 0 | 0 | 0 | 114 | L52 L55 T56 M267 W268 Y269 M275 | L52-P271 HydrophobicContact CD1-CG 4.24Å; L55-P271 HydrophobicContact CB-CB 3.96Å; L55-P271 HydrophobicContact CB-CG 3.76Å; T56-P271 HydrophobicContact CG2-CB 4.45Å; T56-P271 HydrophobicContact CG2-CG 3.89Å; M267-P271 VanDerWaalsContact O-CD 3.29Å; M267-P271 WeakPolarHBondContact O-CD 2.99Å; W268-P271 WeakPolarHBondContact O-CD 3.47Å; Y269-P271 VanDerWaalsContact C-CD 3.44Å; P271-M275 WeakPolarHBondContact O-CB 3.3Å; P271-M275 PolarHBondContact O-N 3.4Å |
| 272 | I | 85.3 | Confident | 77 | Confident | 84 Ų | 84 | 40.9 Ų | 40.9 | 43% | 0.431 | 20% | 0.195 | S | C | . | . | H | α-helix | trans | -74.5 | -46.6 | 179.6 | -60.7 | 174.3 | 0 | 0 | 0 | 109.6 | Y269 A270 I274 M275 F276 | Y269-I272 HydrophobicContact CE2-CB 4.46Å; Y269-I272 HydrophobicContact CE2-CG2 4.41Å; Y269-I272 PolarHBondContact O-N 3.21Å; A270-I272 VanDerWaalsContact C-N 3.26Å; A270-I272 PolarHBondContact O-N 3.2Å; I272-I274 PolarHBondContact O-N 2.99Å; I272-M275 WeakPolarHBondContact O-CB 3.44Å; I272-M275 PolarHBondContact O-N 3.46Å; I272-F276 HydrophobicContact CG2-CD2 4.08Å; I272-F276 HydrophobicContact CG2-CE2 4.07Å; I272-F276 WeakPolarHBondContact O-CD2 3.2Å; I272-F276 PolarHBondContact O-N 2.84Å |
| 273 | G | 79.1 | Confident | 76.8 | Confident | 0 Ų | 0 | 38.1 Ų | 38.1 | 0% | 0 | 18% | 0.181 | C | C | . | . | H | α-helix | trans | -61.8 | -43.7 | 179.2 | 0 | 0 | 0 | 0 | 0 | 113 | G87 Y269 A270 M275 F276 L277 | G87-G273 WeakPolarHBondContact CA-O 3.33Å; Y269-G273 PolarHBondContact O-N 3.47Å; Y269-G273 VanDerWaalsContact O-N 3.15Å; A270-G273 PolarHBondContact O-N 3.34Å; G273-M275 PolarHBondContact O-N 2.97Å; G273-F276 PolarHBondContact O-N 3.41Å; G273-L277 WeakPolarHBondContact O-CB 3.41Å; G273-L277 WeakPolarHBondContact O-CG 3.1Å; G273-L277 PolarHBondContact O-N 3.44Å |
| 274 | I | 74.3 | Confident | 77 | Confident | 14 Ų | 14 | 43.1 Ų | 43.1 | 7% | 0.072 | 20% | 0.203 | C | C | . | . | H | α-helix | trans | -63.6 | -42.3 | 177.3 | -67.4 | 168 | 0 | 0 | 0 | 110.7 | T56 V60 L90 A270 I272 F276 L277 V278 L450 | T56-I274 HydrophobicContact CG2-CD1 4.23Å; V60-I274 HydrophobicContact CG2-CG2 3.57Å; L90-I274 HydrophobicContact CD2-CG1 3.92Å; A270-I274 HydrophobicContact CB-CD1 4.2Å; A270-I274 VanDerWaalsContact O-CB 3.3Å; A270-I274 WeakPolarHBondContact O-CB 3.42Å; A270-I274 WeakPolarHBondContact O-CG1 3.38Å; A270-I274 PolarHBondContact O-N 3.36Å; I272-I274 PolarHBondContact O-N 2.99Å; I274-F276 VanDerWaalsContact C-N 3.32Å; I274-F276 PolarHBondContact O-N 3.12Å; I274-L277 PolarHBondContact O-N 3.29Å; I274-V278 HydrophobicContact CG2-CG2 4.06Å; I274-V278 WeakPolarHBondContact O-CB 3.16Å; I274-V278 VanDerWaalsContact O-CG2 3.26Å; I274-V278 WeakPolarHBondContact O-CG2 3.37Å; I274-V278 PolarHBondContact O-N 3.47Å; I274-L450 HydrophobicContact CD1-CG 4.39Å; I274-L450 HydrophobicContact CG1-CD2 4.17Å; I274-L450 HydrophobicContact CG1-CG 4.24Å |
| 275 | M | 82.1 | Confident | 76.8 | Confident | 33 Ų | 33 | 41.5 Ų | 41.5 | 16% | 0.163 | 19% | 0.189 | C | C | . | . | H | α-helix | trans | -54.3 | -48 | 176.7 | 179.6 | -177.6 | 71.3 | 0 | 0 | 111.9 | G59 V62 G63 I66 P271 I272 G273 A279 | G59-M275 WeakPolarHBondContact O-CA 3.34Å; G59-M275 VanDerWaalsContact O-CB 3.31Å; G59-M275 WeakPolarHBondContact O-CB 3.34Å; G59-M275 WeakPolarHBondContact O-CG 3.27Å; V62-M275 HydrophobicContact CB-CG 4.4Å; V62-M275 HydrophobicContact CB-SD 4.13Å; V62-M275 HydrophobicContact CG1-CG 4.19Å; V62-M275 HydrophobicContact CG1-SD 3.56Å; V62-M275 VanDerWaalsContact CG1-SD 3.56Å; G63-M275 VanDerWaalsContact CA-O 3.24Å; G63-M275 WeakPolarHBondContact CA-O 3.29Å; I66-M275 HydrophobicContact CD1-CG 4.3Å; I66-M275 HydrophobicContact CD1-SD 4.08Å; P271-M275 WeakPolarHBondContact O-CB 3.3Å; P271-M275 PolarHBondContact O-N 3.4Å; I272-M275 WeakPolarHBondContact O-CB 3.44Å; I272-M275 PolarHBondContact O-N 3.46Å; G273-M275 PolarHBondContact O-N 2.97Å; M275-A279 WeakPolarHBondContact O-CB 3.33Å; M275-A279 PolarHBondContact O-N 3.21Å |
| 276 | F | 84 | Confident | 76 | Confident | 54 Ų | 54 | 39.3 Ų | 39.3 | 24% | 0.237 | 19% | 0.186 | C | C | . | . | H | α-helix | trans | -77.8 | -30.2 | 179.7 | -75 | -75.6 | 0 | 0 | 0 | 113.7 | I83 P86 I272 G273 I274 G280 | I83-F276 HydrophobicContact CG2-CD1 4.46Å; I83-F276 WeakPolarHBondContact O-CD1 3.38Å; P86-F276 HydrophobicContact CB-CB 4.02Å; P86-F276 HydrophobicContact CB-CD2 3.59Å; P86-F276 HydrophobicContact CB-CE2 4.25Å; P86-F276 HydrophobicContact CB-CG 3.93Å; P86-F276 HydrophobicContact CG-CB 4.22Å; P86-F276 HydrophobicContact CG-CD1 4.28Å; P86-F276 HydrophobicContact CG-CD2 3.67Å; P86-F276 HydrophobicContact CG-CE2 4.02Å; P86-F276 HydrophobicContact CG-CG 3.81Å; P86-F276 HydrophobicContact CG-CZ 4.47Å; I272-F276 HydrophobicContact CG2-CD2 4.08Å; I272-F276 HydrophobicContact CG2-CE2 4.07Å; I272-F276 WeakPolarHBondContact O-CD2 3.2Å; I272-F276 PolarHBondContact O-N 2.84Å; G273-F276 PolarHBondContact O-N 3.41Å; I274-F276 VanDerWaalsContact C-N 3.32Å; I274-F276 PolarHBondContact O-N 3.12Å; F276-G280 PolarHBondContact O-N 2.89Å |
| 277 | L | 72.6 | Confident | 75.9 | Confident | 19 Ų | 19 | 41.9 Ų | 41.9 | 10% | 0.099 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -61.1 | -49.4 | 170.1 | -85.3 | 175.2 | 0 | 0 | 0 | 111.3 | G87 L90 I91 G273 I274 G280 K281 L450 | G87-L277 VanDerWaalsContact CA-CG 3.49Å; L90-L277 HydrophobicContact CD2-CD1 4.25Å; I91-L277 HydrophobicContact CD1-CD1 3.82Å; I91-L277 HydrophobicContact CG1-CD1 4.06Å; I91-L277 HydrophobicContact CG1-CD2 4.21Å; G273-L277 WeakPolarHBondContact O-CB 3.41Å; G273-L277 WeakPolarHBondContact O-CG 3.1Å; G273-L277 PolarHBondContact O-N 3.44Å; I274-L277 PolarHBondContact O-N 3.29Å; L277-G280 PolarHBondContact O-N 2.91Å; L277-K281 WeakPolarHBondContact O-CB 3.45Å; L277-K281 WeakPolarHBondContact O-CG 3.33Å; L277-K281 PolarHBondContact O-N 3.4Å; L277-L450 HydrophobicContact CD1-CD2 4.01Å |
| 278 | V | 74.6 | Confident | 75.9 | Confident | 13 Ų | 13 | 41.3 Ų | 41.3 | 8% | 0.079 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -62 | -46.8 | 178.8 | 171.9 | 0 | 0 | 0 | 0 | 110.3 | V64 I274 G280 K281 I282 A451 | V64-V278 HydrophobicContact CG2-CG1 3.77Å; I274-V278 HydrophobicContact CG2-CG2 4.06Å; I274-V278 WeakPolarHBondContact O-CB 3.16Å; I274-V278 VanDerWaalsContact O-CG2 3.26Å; I274-V278 WeakPolarHBondContact O-CG2 3.37Å; I274-V278 PolarHBondContact O-N 3.47Å; V278-G280 PolarHBondContact O-N 3.3Å; V278-K281 PolarHBondContact O-N 3.39Å; V278-I282 HydrophobicContact CG1-CD1 3.77Å; V278-I282 WeakPolarHBondContact O-CG1 3.2Å; V278-I282 PolarHBondContact O-N 2.94Å; V278-A451 HydrophobicContact CG2-CB 3.41Å; V278-A451 VanDerWaalsContact CG2-CB 3.41Å |
| 279 | A | 81.3 | Confident | 75.8 | Confident | 0 Ų | 0 | 36.8 Ų | 36.8 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -59 | -48.9 | 177.1 | 0 | 0 | 0 | 0 | 0 | 111.7 | G63 I66 M275 K281 I282 V283 | G63-A279 WeakPolarHBondContact O-CA 3.11Å; G63-A279 WeakPolarHBondContact O-CB 3.02Å; I66-A279 HydrophobicContact CB-CB 4.22Å; I66-A279 HydrophobicContact CG2-CB 3.96Å; M275-A279 WeakPolarHBondContact O-CB 3.33Å; M275-A279 PolarHBondContact O-N 3.21Å; A279-K281 PolarHBondContact O-N 3.45Å; A279-I282 PolarHBondContact O-N 2.83Å; A279-V283 VanDerWaalsContact O-CG2 3.27Å; A279-V283 WeakPolarHBondContact O-CG2 3.39Å; A279-V283 PolarHBondContact O-N 3.23Å |
| 280 | G | 74.3 | Confident | 75.7 | Confident | 13 Ų | 13 | 36.9 Ų | 36.9 | 13% | 0.134 | 20% | 0.199 | C | C | . | . | H | α-helix | trans | -59.2 | -45.4 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.6 | F276 L277 V278 I282 V283 E284 | F276-G280 PolarHBondContact O-N 2.89Å; L277-G280 PolarHBondContact O-N 2.91Å; V278-G280 PolarHBondContact O-N 3.3Å; G280-I282 PolarHBondContact O-N 3.24Å; G280-V283 PolarHBondContact O-N 3.46Å; G280-E284 PolarHBondContact O-N 2.94Å |
| 281 | K | 69.7 | Low | 75.9 | Confident | 27 Ų | 27 | 37 Ų | 37 | 12% | 0.117 | 20% | 0.198 | C | C | . | . | H | α-helix | trans | -66.8 | -36.1 | 179.5 | -75.9 | -70.2 | 170.7 | -165.1 | 0 | 113.7 | L277 V278 A279 V283 E284 M285 S447 L448 | L277-K281 WeakPolarHBondContact O-CB 3.45Å; L277-K281 WeakPolarHBondContact O-CG 3.33Å; L277-K281 PolarHBondContact O-N 3.4Å; V278-K281 PolarHBondContact O-N 3.39Å; A279-K281 PolarHBondContact O-N 3.45Å; K281-V283 VanDerWaalsContact C-N 3.26Å; K281-V283 PolarHBondContact O-N 2.96Å; K281-E284 WeakPolarHBondContact CD-OE2 3.38Å; K281-E284 WeakPolarHBondContact CE-OE2 3.14Å; K281-E284 IonicContact NZ-OE1 2.98Å; K281-E284 IonicContact NZ-OE2 2.7Å; K281-E284 PolarHBondContact NZ-OE2 2.91Å; K281-E284 PolarHBondContact O-N 3.49Å; K281-M285 WeakPolarHBondContact O-CG 3.39Å; K281-M285 PolarHBondContact O-N 3.34Å; K281-S447 WeakPolarHBondContact CE-OG 3.32Å; K281-L448 HydrophobicContact CB-CD2 3.84Å; K281-L448 HydrophobicContact CD-CD2 4.1Å; K281-L448 HydrophobicContact CD-CG 4.37Å; K281-L448 HydrophobicContact CG-CD2 3.88Å; K281-L448 HydrophobicContact CG-CG 4.47Å |
| 282 | I | 76.1 | Confident | 75.9 | Confident | 5 Ų | 5 | 41 Ų | 41 | 3% | 0.026 | 21% | 0.214 | C | C | . | . | H | α-helix | trans | -65.8 | -33.1 | 175.2 | -72.4 | 167.8 | 0 | 0 | 0 | 111.8 | V64 L68 V278 A279 G280 V288 F292 | V64-I282 HydrophobicContact CB-CD1 4.1Å; V64-I282 HydrophobicContact CG1-CD1 4.14Å; V64-I282 HydrophobicContact CG2-CD1 3.91Å; L68-I282 HydrophobicContact CD2-CG2 4.15Å; L68-I282 HydrophobicContact CG-CG2 4.38Å; V278-I282 HydrophobicContact CG1-CD1 3.77Å; V278-I282 WeakPolarHBondContact O-CG1 3.2Å; V278-I282 PolarHBondContact O-N 2.94Å; A279-I282 PolarHBondContact O-N 2.83Å; G280-I282 PolarHBondContact O-N 3.24Å; I282-V288 HydrophobicContact CG2-CG1 4.36Å; I282-V288 HydrophobicContact CG2-CG2 4.02Å; I282-F292 HydrophobicContact CD1-CE2 4.48Å; I282-F292 HydrophobicContact CD1-CZ 4.28Å |
| 283 | V | 76.5 | Confident | 75.9 | Confident | 13 Ų | 13 | 39.3 Ų | 39.3 | 8% | 0.079 | 21% | 0.213 | C | C | . | . | H | α-helix | trans | -75.3 | -37.1 | 178.1 | 176 | 0 | 0 | 0 | 0 | 111.4 | G67 V70 R71 P75 Q80 A279 G280 K281 M285 | G67-V283 WeakPolarHBondContact O-CG2 3.45Å; V70-V283 HydrophobicContact CB-CG2 3.94Å; V70-V283 HydrophobicContact CG1-CG1 4.27Å; V70-V283 HydrophobicContact CG1-CG2 3.61Å; R71-V283 HydrophobicContact CB-CG2 4.35Å; P75-V283 HydrophobicContact CG-CG1 3.87Å; Q80-V283 HydrophobicContact CB-CG1 4.26Å; Q80-V283 HydrophobicContact CG-CG1 3.56Å; A279-V283 VanDerWaalsContact O-CG2 3.27Å; A279-V283 WeakPolarHBondContact O-CG2 3.39Å; A279-V283 PolarHBondContact O-N 3.23Å; G280-V283 PolarHBondContact O-N 3.46Å; K281-V283 VanDerWaalsContact C-N 3.26Å; K281-V283 PolarHBondContact O-N 2.96Å; V283-M285 VanDerWaalsContact C-N 3.34Å; V283-M285 PolarHBondContact O-N 2.81Å |
| 284 | E | 71.7 | Confident | 76.2 | Confident | 117 Ų | 117 | 39.4 Ų | 39.4 | 55% | 0.547 | 21% | 0.214 | S | C | . | . | H | α-helix | trans | -65.7 | -34.2 | 178 | -171.6 | 179.7 | 179.6 | 0 | 0 | 112.6 | G280 K281 | G280-E284 PolarHBondContact O-N 2.94Å; K281-E284 WeakPolarHBondContact CD-OE2 3.38Å; K281-E284 WeakPolarHBondContact CE-OE2 3.14Å; K281-E284 IonicContact NZ-OE1 2.98Å; K281-E284 IonicContact NZ-OE2 2.7Å; K281-E284 PolarHBondContact NZ-OE2 2.91Å; K281-E284 PolarHBondContact O-N 3.49Å |
| 285 | M | 67.8 | Low | 76.7 | Confident | 33 Ų | 33 | 39.4 Ų | 39.4 | 16% | 0.163 | 21% | 0.214 | C | C | . | . | trans | -93.8 | 132 | -170.5 | -66.9 | -172 | 65.2 | 0 | 0 | 113.3 | R71 M154 K281 V283 D287 L291 | R71-M285 PolarHBondContact NH1-O 3.06Å; M154-M285 HydrophobicContact CE-CE 3.79Å; M154-M285 HydrophobicContact SD-CE 3.17Å; M154-M285 WeakPolarHBondContact SD-CE 3.49Å; K281-M285 WeakPolarHBondContact O-CG 3.39Å; K281-M285 PolarHBondContact O-N 3.34Å; V283-M285 VanDerWaalsContact C-N 3.34Å; V283-M285 PolarHBondContact O-N 2.81Å; M285-D287 PolarHBondContact O-N 2.92Å; M285-L291 HydrophobicContact CE-CB 4.2Å; M285-L291 HydrophobicContact CE-CD1 3.66Å; M285-L291 HydrophobicContact CG-CD1 4.4Å; M285-L291 HydrophobicContact SD-CD1 3.07Å; M285-L291 WeakPolarHBondContact SD-CD1 3.44Å; M285-L291 HydrophobicContact SD-CG 4.37Å | ||
| 286 | E | 65.9 | Low | 77 | Confident | 127 Ų | 127 | 39.6 Ų | 39.6 | 59% | 0.593 | 22% | 0.224 | S | C | * | . | S | Bend | trans | -68.8 | -26.8 | -175.9 | -66.1 | -174.5 | -176.1 | 0 | 0 | 114.1 | R71 | R71-E286 PolarHBondContact NH1-O 2.9Å; R71-E286 VanDerWaalsContact NH1-O 3.16Å; R71-E286 PolarHBondContact NH2-O 3.39Å |
| 287 | D | 72.6 | Confident | 77.3 | Confident | 67 Ų | 67 | 41.5 Ų | 41.5 | 36% | 0.358 | 23% | 0.232 | S | C | . | . | trans | -130.2 | 97.7 | -179.5 | -169.1 | -24.8 | 0 | 0 | 0 | 112 | M285 G289 K290 L291 | M285-D287 PolarHBondContact O-N 2.92Å; D287-G289 VanDerWaalsContact C-N 3.3Å; D287-G289 PolarHBondContact O-N 3.43Å; D287-G289 PolarHBondContact OD1-N 3.2Å; D287-K290 HydrophobicContact CB-CB 4.11Å; D287-K290 HydrophobicContact CB-CD 4.12Å; D287-K290 HydrophobicContact CB-CG 4.29Å; D287-K290 PolarHBondContact O-N 2.94Å; D287-K290 PolarHBondContact OD1-N 3.37Å; D287-K290 WeakPolarHBondContact OD2-CD 3.32Å; D287-K290 WeakPolarHBondContact OD2-CE 3.4Å; D287-K290 VanDerWaalsContact OD2-CG 3.24Å; D287-K290 WeakPolarHBondContact OD2-CG 3.28Å; D287-K290 IonicContact OD2-NZ 2.67Å; D287-L291 PolarHBondContact O-N 3.25Å | ||
| 288 | V | 71.4 | Confident | 78.3 | Confident | 22 Ų | 22 | 40.6 Ų | 40.6 | 13% | 0.133 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -63.4 | -37 | 179.7 | -172.1 | 0 | 0 | 0 | 0 | 111.7 | L68 I282 L291 F292 | L68-V288 HydrophobicContact CD2-CG1 4.09Å; L68-V288 HydrophobicContact CD2-CG2 4.06Å; I282-V288 HydrophobicContact CG2-CG1 4.36Å; I282-V288 HydrophobicContact CG2-CG2 4.02Å; V288-L291 PolarHBondContact O-N 3Å; V288-F292 HydrophobicContact CG1-CD2 3.46Å; V288-F292 VanDerWaalsContact CG1-CD2 3.46Å; V288-F292 HydrophobicContact CG1-CE2 3.31Å; V288-F292 VanDerWaalsContact O-CD2 3.25Å; V288-F292 WeakPolarHBondContact O-CD2 3.41Å; V288-F292 PolarHBondContact O-N 3.46Å |
| 289 | G | 78.1 | Confident | 79.1 | Confident | 51 Ų | 51 | 41.5 Ų | 41.5 | 53% | 0.526 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -65.3 | -43.3 | -177.5 | 0 | 0 | 0 | 0 | 0 | 111.6 | D287 F292 A293 | D287-G289 VanDerWaalsContact C-N 3.3Å; D287-G289 PolarHBondContact O-N 3.43Å; D287-G289 PolarHBondContact OD1-N 3.2Å; G289-F292 PolarHBondContact O-N 3.17Å; G289-A293 WeakPolarHBondContact O-CB 3.47Å; G289-A293 PolarHBondContact O-N 3Å |
| 290 | K | 78.8 | Confident | 79.7 | Confident | 64 Ų | 64 | 43.4 Ų | 43.4 | 28% | 0.278 | 25% | 0.248 | S | C | . | . | H | α-helix | trans | -64.7 | -39.2 | 174.5 | -75.3 | -178.5 | -173.6 | -176.8 | 0 | 112.7 | V152 E153 M154 D287 A293 S294 | V152-K290 HydrophobicContact CG1-CB 3.75Å; V152-K290 HydrophobicContact CG1-CD 3.96Å; V152-K290 HydrophobicContact CG1-CG 3.76Å; E153-K290 WeakPolarHBondContact O-CD 3.41Å; E153-K290 PolarHBondContact O-NZ 2.86Å; M154-K290 HydrophobicContact CG-CB 4.46Å; D287-K290 HydrophobicContact CB-CB 4.11Å; D287-K290 HydrophobicContact CB-CD 4.12Å; D287-K290 HydrophobicContact CB-CG 4.29Å; D287-K290 PolarHBondContact O-N 2.94Å; D287-K290 PolarHBondContact OD1-N 3.37Å; D287-K290 WeakPolarHBondContact OD2-CD 3.32Å; D287-K290 WeakPolarHBondContact OD2-CE 3.4Å; D287-K290 VanDerWaalsContact OD2-CG 3.24Å; D287-K290 WeakPolarHBondContact OD2-CG 3.28Å; D287-K290 IonicContact OD2-NZ 2.67Å; K290-A293 PolarHBondContact O-N 3.39Å; K290-S294 VanDerWaalsContact O-CB 3.31Å; K290-S294 WeakPolarHBondContact O-CB 3.48Å; K290-S294 PolarHBondContact O-N 3.47Å |
| 291 | L | 77.4 | Confident | 80.7 | Confident | 10 Ų | 10 | 42.8 Ų | 42.8 | 5% | 0.052 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -61.4 | -49.6 | 174.6 | 171.3 | 135.1 | 0 | 0 | 0 | 111.8 | M154 M285 D287 V288 A293 S294 L295 L448 | M154-L291 HydrophobicContact CE-CB 4.26Å; M285-L291 HydrophobicContact CE-CB 4.2Å; M285-L291 HydrophobicContact CE-CD1 3.66Å; M285-L291 HydrophobicContact CG-CD1 4.4Å; M285-L291 HydrophobicContact SD-CD1 3.07Å; M285-L291 WeakPolarHBondContact SD-CD1 3.44Å; M285-L291 HydrophobicContact SD-CG 4.37Å; D287-L291 PolarHBondContact O-N 3.25Å; V288-L291 PolarHBondContact O-N 3Å; L291-A293 VanDerWaalsContact C-N 3.3Å; L291-A293 PolarHBondContact O-N 3.03Å; L291-S294 WeakPolarHBondContact O-CB 3.49Å; L291-S294 PolarHBondContact O-N 2.97Å; L291-S294 VanDerWaalsContact O-N 3.17Å; L291-L295 HydrophobicContact CD2-CD1 3.65Å; L291-L295 HydrophobicContact CG-CD1 3.99Å; L291-L295 HydrophobicContact CG-CG 4.44Å; L291-L295 WeakPolarHBondContact O-CG 3.44Å; L291-L295 PolarHBondContact O-N 3.39Å; L291-L448 HydrophobicContact CD1-CD2 3.88Å |
| 292 | F | 80 | Confident | 81.8 | Confident | 94 Ų | 94 | 41.5 Ų | 41.5 | 41% | 0.412 | 24% | 0.236 | S | C | . | . | H | α-helix | trans | -64.5 | -35.7 | 178.7 | -82.4 | -73 | 0 | 0 | 0 | 112.3 | V64 I282 V288 G289 G296 | V64-F292 HydrophobicContact CG1-CE2 4.41Å; V64-F292 HydrophobicContact CG1-CZ 3.92Å; V64-F292 HydrophobicContact CG2-CE1 4.38Å; V64-F292 HydrophobicContact CG2-CZ 3.8Å; I282-F292 HydrophobicContact CD1-CE2 4.48Å; I282-F292 HydrophobicContact CD1-CZ 4.28Å; V288-F292 HydrophobicContact CG1-CD2 3.46Å; V288-F292 VanDerWaalsContact CG1-CD2 3.46Å; V288-F292 HydrophobicContact CG1-CE2 3.31Å; V288-F292 VanDerWaalsContact O-CD2 3.25Å; V288-F292 WeakPolarHBondContact O-CD2 3.41Å; V288-F292 PolarHBondContact O-N 3.46Å; G289-F292 PolarHBondContact O-N 3.17Å; F292-G296 PolarHBondContact O-N 3.03Å |
| 293 | A | 84.6 | Confident | 82.7 | Confident | 50 Ų | 50 | 45.2 Ų | 45.2 | 41% | 0.413 | 25% | 0.254 | S | S | . | . | H | α-helix | trans | -63.9 | -42.4 | 173.3 | 0 | 0 | 0 | 0 | 0 | 111.9 | G289 K290 L291 G296 K297 | G289-A293 WeakPolarHBondContact O-CB 3.47Å; G289-A293 PolarHBondContact O-N 3Å; K290-A293 PolarHBondContact O-N 3.39Å; L291-A293 VanDerWaalsContact C-N 3.3Å; L291-A293 PolarHBondContact O-N 3.03Å; A293-G296 PolarHBondContact O-N 3.01Å; A293-K297 WeakPolarHBondContact O-CG 3.44Å; A293-K297 PolarHBondContact O-N 3.33Å |
| 294 | S | 85.6 | Confident | 83.6 | Confident | 1 Ų | 1 | 48.2 Ų | 48.2 | 1% | 0.007 | 27% | 0.269 | C | S | . | . | H | α-helix | trans | -63.3 | -48.6 | 176.6 | -168.5 | 0 | 0 | 0 | 0 | 111.6 | P149 K290 L291 G296 K297 Y298 F393 | P149-S294 PolarHBondContact O-OG 3.24Å; K290-S294 VanDerWaalsContact O-CB 3.31Å; K290-S294 WeakPolarHBondContact O-CB 3.48Å; K290-S294 PolarHBondContact O-N 3.47Å; L291-S294 WeakPolarHBondContact O-CB 3.49Å; L291-S294 PolarHBondContact O-N 2.97Å; L291-S294 VanDerWaalsContact O-N 3.17Å; S294-G296 PolarHBondContact O-N 2.95Å; S294-K297 PolarHBondContact O-N 3.01Å; S294-Y298 PolarHBondContact O-N 2.88Å; S294-F393 VanDerWaalsContact OG-CE2 3.3Å; S294-F393 WeakPolarHBondContact OG-CE2 3.21Å |
| 295 | L | 85.4 | Confident | 84.8 | Confident | 14 Ų | 14 | 42.7 Ų | 42.7 | 7% | 0.073 | 24% | 0.243 | C | C | . | . | H | α-helix | trans | -62.9 | -39.5 | 175.2 | -73.4 | 174.4 | 0 | 0 | 0 | 112.4 | L291 Y298 I299 F393 L448 V452 | L291-L295 HydrophobicContact CD2-CD1 3.65Å; L291-L295 HydrophobicContact CG-CD1 3.99Å; L291-L295 HydrophobicContact CG-CG 4.44Å; L291-L295 WeakPolarHBondContact O-CG 3.44Å; L291-L295 PolarHBondContact O-N 3.39Å; L295-Y298 WeakPolarHBondContact O-CB 3.49Å; L295-Y298 PolarHBondContact O-N 3.04Å; L295-I299 WeakPolarHBondContact O-CG1 2.93Å; L295-I299 PolarHBondContact O-N 2.83Å; L295-F393 HydrophobicContact CD2-CE1 4.24Å; L295-F393 HydrophobicContact CD2-CZ 4.02Å; L295-L448 HydrophobicContact CD2-CB 4.43Å; L295-V452 HydrophobicContact CB-CG1 4.48Å; L295-V452 HydrophobicContact CD1-CG1 4.32Å; L295-V452 HydrophobicContact CD2-CG1 4.26Å; L295-V452 HydrophobicContact CD2-CG2 4.45Å |
| 296 | G | 88.6 | Confident | 86.1 | Confident | 37 Ų | 37 | 41.6 Ų | 41.6 | 38% | 0.381 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -61.9 | -43.5 | 174.9 | 0 | 0 | 0 | 0 | 0 | 112.3 | F292 A293 S294 Y298 I299 A300 | F292-G296 PolarHBondContact O-N 3.03Å; A293-G296 PolarHBondContact O-N 3.01Å; S294-G296 PolarHBondContact O-N 2.95Å; G296-Y298 VanDerWaalsContact C-N 3.33Å; G296-I299 PolarHBondContact O-N 2.97Å; G296-A300 WeakPolarHBondContact O-CB 3.35Å; G296-A300 PolarHBondContact O-N 3.37Å |
| 297 | K | 90.9 | Very high | 87.6 | Confident | 94 Ų | 94 | 37.8 Ų | 37.8 | 41% | 0.409 | 23% | 0.227 | S | C | . | . | H | α-helix | trans | -63.2 | -39.5 | 173.1 | -72.6 | 175.4 | -176.5 | -180 | 0 | 111.9 | P149 A293 S294 A300 C301 | P149-K297 HydrophobicContact CB-CB 3.89Å; A293-K297 WeakPolarHBondContact O-CG 3.44Å; A293-K297 PolarHBondContact O-N 3.33Å; S294-K297 PolarHBondContact O-N 3.01Å; K297-A300 PolarHBondContact O-N 3.4Å; K297-C301 VanDerWaalsContact O-CB 3.25Å; K297-C301 WeakPolarHBondContact O-CB 3.31Å; K297-C301 PolarHBondContact O-N 3.15Å |
| 298 | Y | 92.5 | Very high | 88.7 | Confident | 0 Ų | 0 | 37.1 Ų | 37.1 | 0% | 0 | 22% | 0.223 | C | C | . | . | H | α-helix | trans | -61.1 | -51.1 | 175.7 | 164.7 | -100.2 | 0 | 0 | 0 | 111.7 | S294 L295 G296 A300 C301 C302 F386 V389 A390 F393 I449 V452 | S294-Y298 PolarHBondContact O-N 2.88Å; L295-Y298 WeakPolarHBondContact O-CB 3.49Å; L295-Y298 PolarHBondContact O-N 3.04Å; G296-Y298 VanDerWaalsContact C-N 3.33Å; Y298-A300 VanDerWaalsContact C-N 3.32Å; Y298-A300 PolarHBondContact O-N 2.89Å; Y298-C301 WeakPolarHBondContact O-CB 3.2Å; Y298-C301 PolarHBondContact O-N 3.16Å; Y298-C301 VanDerWaalsContact O-N 3.12Å; Y298-C302 VanDerWaalsContact CE2-SG 3.51Å; Y298-C302 VanDerWaalsContact CZ-SG 3.58Å; Y298-C302 PolarHBondContact O-N 2.97Å; Y298-F386 VanDerWaalsContact OH-CD2 3.25Å; Y298-F386 WeakPolarHBondContact OH-CD2 3.36Å; Y298-F386 WeakPolarHBondContact OH-CE2 3.24Å; Y298-V389 HydrophobicContact CD2-CG1 3.94Å; Y298-V389 HydrophobicContact CE2-CG1 3.85Å; Y298-A390 HydrophobicContact CE2-CB 4.06Å; Y298-F393 HydrophobicContact CD2-CB 3.85Å; Y298-F393 AromaticContact CD2-CD1 3.97Å; Y298-F393 HydrophobicContact CD2-CD1 3.97Å; Y298-F393 HydrophobicContact CD2-CD2 4.15Å; Y298-F393 AromaticContact CD2-CG 3.73Å; Y298-F393 HydrophobicContact CD2-CG 3.73Å; Y298-F393 HydrophobicContact CE2-CB 4.36Å; Y298-F393 HydrophobicContact CE2-CD1 4.49Å; Y298-F393 HydrophobicContact CE2-CG 4.49Å; Y298-F393 HydrophobicContact CG-CD1 4.27Å; Y298-F393 HydrophobicContact CG-CD2 4.32Å; Y298-F393 HydrophobicContact CG-CE1 4.36Å; Y298-F393 HydrophobicContact CG-CE2 4.42Å; Y298-F393 HydrophobicContact CG-CG 4.21Å; Y298-F393 HydrophobicContact CG-CZ 4.43Å; Y298-I449 HydrophobicContact CE1-CD1 4Å; Y298-I449 HydrophobicContact CE2-CD1 4.06Å; Y298-V452 HydrophobicContact CD1-CG2 3.94Å; Y298-V452 HydrophobicContact CE1-CG2 3.68Å |
| 299 | I | 91.8 | Very high | 90 | Very high | 32 Ų | 32 | 36 Ų | 36 | 16% | 0.164 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -57.7 | -47.6 | 176.9 | -66.6 | 166.1 | 0 | 0 | 0 | 110.1 | L295 G296 C301 C302 M303 V452 L455 V456 | L295-I299 WeakPolarHBondContact O-CG1 2.93Å; L295-I299 PolarHBondContact O-N 2.83Å; G296-I299 PolarHBondContact O-N 2.97Å; I299-C301 VanDerWaalsContact C-N 3.31Å; I299-C301 PolarHBondContact O-N 3.21Å; I299-C302 PolarHBondContact O-N 2.86Å; I299-M303 HydrophobicContact CG2-CG 4.29Å; I299-M303 HydrophobicContact CG2-SD 3.88Å; I299-M303 WeakPolarHBondContact O-CB 3.25Å; I299-M303 WeakPolarHBondContact O-CG 3.3Å; I299-M303 PolarHBondContact O-N 3.47Å; I299-V452 HydrophobicContact CD1-CB 3.92Å; I299-V452 HydrophobicContact CD1-CG1 3.95Å; I299-V452 HydrophobicContact CG1-CB 4.09Å; I299-V452 HydrophobicContact CG1-CG1 4.49Å; I299-V452 HydrophobicContact CG1-CG2 4.35Å; I299-L455 HydrophobicContact CG2-CD2 3.87Å; I299-V456 HydrophobicContact CG1-CG2 4.28Å; I299-V456 HydrophobicContact CG2-CG2 4.45Å |
| 300 | A | 93.2 | Very high | 90.8 | Very high | 41 Ų | 41 | 33.7 Ų | 33.7 | 34% | 0.339 | 19% | 0.192 | S | C | . | . | H | α-helix | trans | -60.1 | -41.9 | 177.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | G296 K297 Y298 M303 I304 | G296-A300 WeakPolarHBondContact O-CB 3.35Å; G296-A300 PolarHBondContact O-N 3.37Å; K297-A300 PolarHBondContact O-N 3.4Å; Y298-A300 VanDerWaalsContact C-N 3.32Å; Y298-A300 PolarHBondContact O-N 2.89Å; A300-M303 PolarHBondContact O-N 2.83Å; A300-I304 VanDerWaalsContact O-CB 3.32Å; A300-I304 WeakPolarHBondContact O-CB 3.25Å; A300-I304 WeakPolarHBondContact O-CD1 3.22Å; A300-I304 WeakPolarHBondContact O-CG1 3.25Å; A300-I304 PolarHBondContact O-N 3.48Å |
| 301 | C | 94.9 | Very high | 91.6 | Very high | 0 Ų | 0 | 35 Ų | 35 | 0% | 0 | 20% | 0.202 | C | C | . | . | H | α-helix | trans | -59.7 | -48.2 | 176.6 | -174.4 | 0 | 0 | 0 | 0 | 111.8 | I147 P149 K297 Y298 I299 G305 V389 | I147-C301 HydrophobicContact CB-CB 4.45Å; I147-C301 HydrophobicContact CD1-CB 3.79Å; I147-C301 HydrophobicContact CG2-CB 4.24Å; P149-C301 HydrophobicContact CG-CB 4.49Å; K297-C301 VanDerWaalsContact O-CB 3.25Å; K297-C301 WeakPolarHBondContact O-CB 3.31Å; K297-C301 PolarHBondContact O-N 3.15Å; Y298-C301 WeakPolarHBondContact O-CB 3.2Å; Y298-C301 PolarHBondContact O-N 3.16Å; Y298-C301 VanDerWaalsContact O-N 3.12Å; I299-C301 VanDerWaalsContact C-N 3.31Å; I299-C301 PolarHBondContact O-N 3.21Å; C301-G305 PolarHBondContact O-N 3.41Å; C301-V389 HydrophobicContact CB-CG1 4.16Å |
| 302 | C | 94.4 | Very high | 92.5 | Very high | 0 Ų | 0 | 39.5 Ų | 39.5 | 0% | 0 | 23% | 0.226 | C | C | . | . | H | α-helix | trans | -61.5 | -49.1 | 176.1 | -68 | 0 | 0 | 0 | 0 | 111.6 | Y298 I299 I304 G305 H306 V389 V456 | Y298-C302 VanDerWaalsContact CE2-SG 3.51Å; Y298-C302 VanDerWaalsContact CZ-SG 3.58Å; Y298-C302 PolarHBondContact O-N 2.97Å; I299-C302 PolarHBondContact O-N 2.86Å; C302-I304 PolarHBondContact O-N 2.97Å; C302-G305 PolarHBondContact O-N 2.87Å; C302-H306 VanDerWaalsContact O-CG 3.23Å; C302-H306 PolarHBondContact O-N 3.5Å; C302-H306 PolarHBondContact O-ND1 3.35Å; C302-V389 VanDerWaalsContact SG-CG1 3.51Å; C302-V456 HydrophobicContact CB-CG1 3.64Å; C302-V456 HydrophobicContact CB-CG2 4.45Å |
| 303 | M | 94 | Very high | 93.3 | Very high | 83 Ų | 83 | 36.5 Ų | 36.5 | 41% | 0.409 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -63 | -40.5 | -178.9 | -71.1 | -175.6 | 72.4 | 0 | 0 | 112.7 | I299 A300 H306 A307 | I299-M303 HydrophobicContact CG2-CG 4.29Å; I299-M303 HydrophobicContact CG2-SD 3.88Å; I299-M303 WeakPolarHBondContact O-CB 3.25Å; I299-M303 WeakPolarHBondContact O-CG 3.3Å; I299-M303 PolarHBondContact O-N 3.47Å; A300-M303 PolarHBondContact O-N 2.83Å; M303-H306 PolarHBondContact O-N 3.25Å; M303-A307 WeakPolarHBondContact O-CB 3.25Å; M303-A307 PolarHBondContact O-N 3.06Å |
| 304 | I | 95.8 | Very high | 93.9 | Very high | 76 Ų | 76 | 34.2 Ų | 34.2 | 39% | 0.39 | 20% | 0.196 | S | C | . | . | H | α-helix | trans | -66.3 | -43.8 | 175.5 | -67.7 | 164.7 | 0 | 0 | 0 | 109.9 | M143 I147 A300 C302 H306 A307 I308 | M143-I304 HydrophobicContact CE-CB 4.27Å; M143-I304 HydrophobicContact CE-CG2 3.55Å; I147-I304 HydrophobicContact CD1-CD1 4.31Å; A300-I304 VanDerWaalsContact O-CB 3.32Å; A300-I304 WeakPolarHBondContact O-CB 3.25Å; A300-I304 WeakPolarHBondContact O-CD1 3.22Å; A300-I304 WeakPolarHBondContact O-CG1 3.25Å; A300-I304 PolarHBondContact O-N 3.48Å; C302-I304 PolarHBondContact O-N 2.97Å; I304-H306 PolarHBondContact O-N 2.71Å; I304-A307 PolarHBondContact O-N 3.29Å; I304-I308 HydrophobicContact CG2-CD1 3.68Å; I304-I308 HydrophobicContact CG2-CG1 4.26Å; I304-I308 WeakPolarHBondContact O-CB 3.2Å; I304-I308 VanDerWaalsContact O-CG1 3.27Å; I304-I308 WeakPolarHBondContact O-CG1 3.33Å; I304-I308 PolarHBondContact O-N 2.8Å |
| 305 | G | 96.6 | Very high | 94.4 | Very high | 0 Ų | 0 | 34.3 Ų | 34.3 | 0% | 0 | 20% | 0.197 | C | C | . | . | H | α-helix | trans | -58.2 | -46.6 | 175.4 | 0 | 0 | 0 | 0 | 0 | 112.3 | C301 C302 A307 I308 H309 L385 | C301-G305 PolarHBondContact O-N 3.41Å; C302-G305 PolarHBondContact O-N 2.87Å; G305-A307 PolarHBondContact O-N 3.49Å; G305-I308 PolarHBondContact O-N 2.88Å; G305-H309 WeakPolarHBondContact O-CB 3.41Å; G305-H309 PolarHBondContact O-N 3.24Å; G305-L385 WeakPolarHBondContact O-CD1 3.34Å |
| 306 | H | 96.3 | Very high | 94.9 | Very high | 11 Ų | 11 | 39.8 Ų | 39.8 | 5% | 0.051 | 22% | 0.22 | C | C | . | . | H | α-helix | trans | -60.8 | -44.8 | 174.7 | -65.7 | 151.2 | 0 | 0 | 0 | 112.2 | C302 M303 I304 I308 H309 G310 G382 T459 C460 L463 | C302-H306 VanDerWaalsContact O-CG 3.23Å; C302-H306 PolarHBondContact O-N 3.5Å; C302-H306 PolarHBondContact O-ND1 3.35Å; M303-H306 PolarHBondContact O-N 3.25Å; I304-H306 PolarHBondContact O-N 2.71Å; H306-I308 PolarHBondContact O-N 3.24Å; H306-H309 PolarHBondContact O-N 3.44Å; H306-G310 PolarHBondContact O-N 3.36Å; H306-G382 PolarHBondContact NE2-O 3.5Å; H306-T459 PolarHBondContact CE1-OG1 3.46Å; H306-T459 PolarHBondContact ND1-OG1 3.08Å; H306-C460 PolarHBondContact CE1-SG 3.26Å; H306-C460 PolarHBondContact NE2-SG 3.33Å; H306-L463 VanDerWaalsContact CA-CD1 3.45Å; H306-L463 HydrophobicContact CB-CD1 3.74Å; H306-L463 WeakPolarHBondContact O-CD1 3.38Å |
| 307 | A | 96.1 | Very high | 95.2 | Very high | 46 Ų | 46 | 39.1 Ų | 39.1 | 38% | 0.38 | 21% | 0.208 | S | C | . | . | H | α-helix | trans | -63.9 | -41.5 | 178.4 | 0 | 0 | 0 | 0 | 0 | 112.2 | M303 I304 G305 L311 | M303-A307 WeakPolarHBondContact O-CB 3.25Å; M303-A307 PolarHBondContact O-N 3.06Å; I304-A307 PolarHBondContact O-N 3.29Å; G305-A307 PolarHBondContact O-N 3.49Å; A307-L311 WeakPolarHBondContact O-CA 3.38Å; A307-L311 WeakPolarHBondContact O-CB 3.24Å; A307-L311 PolarHBondContact O-N 3.41Å |
| 308 | I | 97.1 | Very high | 95.4 | Very high | 53 Ų | 53 | 35.5 Ų | 35.5 | 27% | 0.272 | 19% | 0.191 | S | C | . | . | H | α-helix | trans | -63.2 | -48.5 | 176.1 | -70.4 | 168.3 | 0 | 0 | 0 | 109.9 | I139 M143 I304 G305 H306 L312 V313 | I139-I308 HydrophobicContact CG2-CG2 4.43Å; M143-I308 HydrophobicContact CE-CD1 4.27Å; M143-I308 HydrophobicContact SD-CD1 3.81Å; I304-I308 HydrophobicContact CG2-CD1 3.68Å; I304-I308 HydrophobicContact CG2-CG1 4.26Å; I304-I308 WeakPolarHBondContact O-CB 3.2Å; I304-I308 VanDerWaalsContact O-CG1 3.27Å; I304-I308 WeakPolarHBondContact O-CG1 3.33Å; I304-I308 PolarHBondContact O-N 2.8Å; G305-I308 PolarHBondContact O-N 2.88Å; H306-I308 PolarHBondContact O-N 3.24Å; I308-L312 WeakPolarHBondContact O-CA 3.26Å; I308-L312 VanDerWaalsContact O-CB 3.26Å; I308-L312 WeakPolarHBondContact O-CB 3.4Å; I308-L312 PolarHBondContact O-N 2.82Å; I308-L312 VanDerWaalsContact O-N 3.1Å; I308-V313 HydrophobicContact CG2-CG2 4.28Å; I308-V313 PolarHBondContact O-N 3.11Å |
| 309 | H | 97.3 | Very high | 95.5 | Very high | 0 Ų | 0 | 40.2 Ų | 40.2 | 0% | 0 | 21% | 0.212 | C | C | . | . | I | π-helix | trans | -70.1 | -46.8 | -175.7 | -173 | 51.1 | 0 | 0 | 0 | 112.1 | A136 I139 G305 H306 V313 L314 D381 L385 L463 | A136-H309 WeakPolarHBondContact CB-NE2 3.39Å; I139-H309 HydrophobicContact CD1-CB 4.01Å; G305-H309 WeakPolarHBondContact O-CB 3.41Å; G305-H309 PolarHBondContact O-N 3.24Å; H306-H309 PolarHBondContact O-N 3.44Å; H309-V313 WeakPolarHBondContact O-CB 3.5Å; H309-V313 PolarHBondContact O-N 3.36Å; H309-L314 PolarHBondContact O-N 3.27Å; H309-D381 IonicContact NE2-OD2 3.3Å; H309-L385 HydrophobicContact CB-CD1 4.1Å; H309-L463 HydrophobicContact CB-CD1 4.18Å; H309-L463 WeakPolarHBondContact CD2-CD2 3.37Å |
| 310 | G | 95.6 | Very high | 95.7 | Very high | 1 Ų | 1 | 42.3 Ų | 42.3 | 1% | 0.01 | 22% | 0.223 | C | C | . | . | I | π-helix | trans | -71.2 | -44.7 | 179.6 | 0 | 0 | 0 | 0 | 0 | 114.4 | H306 P315 E466 | H306-G310 PolarHBondContact O-N 3.36Å; G310-P315 WeakPolarHBondContact O-CD 3.42Å; G310-P315 VanDerWaalsContact O-CG 3.28Å; G310-P315 WeakPolarHBondContact O-CG 3.39Å; G310-E466 WeakPolarHBondContact CA-OE2 3.3Å; G310-E466 VanDerWaalsContact O-OE1 3.09Å |
| 311 | L | 95.9 | Very high | 95.6 | Very high | 93 Ų | 93 | 45.2 Ų | 45.2 | 49% | 0.487 | 23% | 0.228 | S | C | . | . | I | π-helix | trans | -93.7 | -17.7 | -173.2 | -57.3 | 176.8 | 0 | 0 | 0 | 114.8 | A307 P315 Y327 | A307-L311 WeakPolarHBondContact O-CA 3.38Å; A307-L311 WeakPolarHBondContact O-CB 3.24Å; A307-L311 PolarHBondContact O-N 3.41Å; L311-P315 WeakPolarHBondContact O-CG 3.2Å; L311-Y327 PolarHBondContact O-OH 3.45Å |
| 312 | L | 95.9 | Very high | 95.5 | Very high | 103 Ų | 103 | 45.5 Ų | 45.5 | 54% | 0.539 | 23% | 0.23 | S | C | . | . | I | π-helix | trans | -115.8 | -56.5 | 179.8 | -54.7 | 174.9 | 0 | 0 | 0 | 111.5 | I308 F316 | I308-L312 WeakPolarHBondContact O-CA 3.26Å; I308-L312 VanDerWaalsContact O-CB 3.26Å; I308-L312 WeakPolarHBondContact O-CB 3.4Å; I308-L312 PolarHBondContact O-N 2.82Å; I308-L312 VanDerWaalsContact O-N 3.1Å; L312-F316 WeakPolarHBondContact O-CB 3.49Å; L312-F316 PolarHBondContact O-N 3.28Å |
| 313 | V | 97.1 | Very high | 95.4 | Very high | 32 Ų | 32 | 54.9 Ų | 54.9 | 19% | 0.194 | 27% | 0.265 | C | S | . | . | I | π-helix | trans | -72.3 | -52.1 | -168.9 | 177.8 | 0 | 0 | 0 | 0 | 112.5 | I135 I139 I308 H309 F316 I317 | I135-V313 HydrophobicContact CG2-CG1 3.78Å; I139-V313 HydrophobicContact CD1-CB 4.49Å; I139-V313 HydrophobicContact CD1-CG2 3.82Å; I308-V313 HydrophobicContact CG2-CG2 4.28Å; I308-V313 PolarHBondContact O-N 3.11Å; H309-V313 WeakPolarHBondContact O-CB 3.5Å; H309-V313 PolarHBondContact O-N 3.36Å; V313-F316 WeakPolarHBondContact O-CB 3.23Å; V313-F316 PolarHBondContact O-N 3.48Å; V313-I317 HydrophobicContact CG1-CD1 3.9Å; V313-I317 VanDerWaalsContact O-CG1 3.31Å; V313-I317 WeakPolarHBondContact O-CG1 3.34Å; V313-I317 PolarHBondContact O-N 3.02Å |
| 314 | L | 95.9 | Very high | 95.3 | Very high | 2 Ų | 2 | 56.6 Ų | 56.6 | 1% | 0.01 | 27% | 0.27 | C | S | . | . | H | α-helix | trans | -61 | -48.1 | 178.1 | -72.3 | 177.2 | 0 | 0 | 0 | 111.9 | T132 H309 F316 I317 Y318 L463 E466 F470 | T132-L314 HydrophobicContact CG2-CD2 3.76Å; H309-L314 PolarHBondContact O-N 3.27Å; L314-F316 VanDerWaalsContact C-N 3.31Å; L314-F316 PolarHBondContact O-N 2.84Å; L314-I317 PolarHBondContact O-N 3.49Å; L314-Y318 WeakPolarHBondContact O-CB 3.49Å; L314-Y318 PolarHBondContact O-N 3.11Å; L314-L463 HydrophobicContact CD1-CD2 3.92Å; L314-E466 HydrophobicContact CD1-CG 4.24Å; L314-F470 HydrophobicContact CB-CD2 3.81Å; L314-F470 HydrophobicContact CB-CE2 3.94Å; L314-F470 HydrophobicContact CD1-CD2 4.32Å |
| 315 | P | 96.3 | Very high | 95.2 | Very high | 3 Ų | 3 | 57.4 Ų | 57.4 | 2% | 0.019 | 28% | 0.276 | C | S | . | . | H | α-helix | trans | -56.3 | -40.3 | 171.1 | -33.9 | 38.9 | 0 | 0 | 0 | 114 | G310 L311 Y318 F319 P326 Y327 L330 F470 | G310-P315 WeakPolarHBondContact O-CD 3.42Å; G310-P315 VanDerWaalsContact O-CG 3.28Å; G310-P315 WeakPolarHBondContact O-CG 3.39Å; L311-P315 WeakPolarHBondContact O-CG 3.2Å; P315-Y318 PolarHBondContact O-N 3.45Å; P315-F319 VanDerWaalsContact O-CB 3.31Å; P315-F319 WeakPolarHBondContact O-CB 3.45Å; P315-F319 PolarHBondContact O-N 3.47Å; P315-P326 HydrophobicContact CB-CB 3.72Å; P315-P326 HydrophobicContact CB-CG 3.66Å; P315-Y327 HydrophobicContact CG-CE1 4.5Å; P315-L330 HydrophobicContact CG-CD1 4.11Å; P315-F470 HydrophobicContact CG-CE2 4.24Å; P315-F470 HydrophobicContact CG-CZ 3.95Å |
| 316 | F | 96 | Very high | 95.1 | Very high | 128 Ų | 128 | 57.8 Ų | 57.8 | 56% | 0.561 | 28% | 0.278 | S | S | * | . | H | α-helix | trans | -66.1 | -44.7 | 178.5 | 178.8 | -110.1 | 0 | 0 | 0 | 111.8 | L312 V313 L314 F319 I320 | L312-F316 WeakPolarHBondContact O-CB 3.49Å; L312-F316 PolarHBondContact O-N 3.28Å; V313-F316 WeakPolarHBondContact O-CB 3.23Å; V313-F316 PolarHBondContact O-N 3.48Å; L314-F316 VanDerWaalsContact C-N 3.31Å; L314-F316 PolarHBondContact O-N 2.84Å; F316-F319 PolarHBondContact O-N 3.1Å; F316-I320 HydrophobicContact CD1-CD1 3.69Å; F316-I320 HydrophobicContact CD2-CD1 4.33Å; F316-I320 HydrophobicContact CE1-CD1 3.28Å; F316-I320 HydrophobicContact CE1-CG1 4.41Å; F316-I320 HydrophobicContact CE2-CD1 3.97Å; F316-I320 HydrophobicContact CE2-CG1 4.32Å; F316-I320 HydrophobicContact CG-CD1 4.22Å; F316-I320 HydrophobicContact CZ-CD1 3.44Å; F316-I320 VanDerWaalsContact CZ-CD1 3.44Å; F316-I320 HydrophobicContact CZ-CG1 4.25Å; F316-I320 WeakPolarHBondContact O-CG1 3.5Å; F316-I320 PolarHBondContact O-N 3.18Å |
| 317 | I | 95.1 | Very high | 95.1 | Very high | 24 Ų | 24 | 62.9 Ų | 62.9 | 12% | 0.123 | 30% | 0.298 | C | S | . | . | H | α-helix | trans | -58.1 | -50.5 | 173.2 | -67.4 | 167.6 | 0 | 0 | 0 | 109.3 | F128 T132 I135 V313 L314 F319 I320 F321 | F128-I317 HydrophobicContact CE2-CG2 4.02Å; T132-I317 HydrophobicContact CG2-CD1 4.24Å; I135-I317 HydrophobicContact CD1-CD1 4.25Å; V313-I317 HydrophobicContact CG1-CD1 3.9Å; V313-I317 VanDerWaalsContact O-CG1 3.31Å; V313-I317 WeakPolarHBondContact O-CG1 3.34Å; V313-I317 PolarHBondContact O-N 3.02Å; L314-I317 PolarHBondContact O-N 3.49Å; I317-F319 VanDerWaalsContact C-N 3.33Å; I317-F319 PolarHBondContact O-N 2.85Å; I317-I320 PolarHBondContact O-N 3.05Å; I317-F321 HydrophobicContact CG2-CD2 3.98Å; I317-F321 HydrophobicContact CG2-CE2 4Å; I317-F321 VanDerWaalsContact O-CD2 3.23Å; I317-F321 WeakPolarHBondContact O-CD2 3.47Å; I317-F321 PolarHBondContact O-N 2.82Å |
| 318 | Y | 95 | Very high | 95 | Very high | 18 Ų | 18 | 65.2 Ų | 65.2 | 7% | 0.071 | 31% | 0.307 | C | S | . | . | H | α-helix | trans | -58 | -43.3 | 178.2 | -175.4 | -92.3 | 0 | 0 | 0 | 112.5 | L314 P315 T322 K324 P326 F470 | L314-Y318 WeakPolarHBondContact O-CB 3.49Å; L314-Y318 PolarHBondContact O-N 3.11Å; P315-Y318 PolarHBondContact O-N 3.45Å; Y318-T322 HydrophobicContact CD1-CG2 4.37Å; Y318-T322 WeakPolarHBondContact CD1-OG1 3.35Å; Y318-T322 HydrophobicContact CD2-CG2 3.92Å; Y318-T322 HydrophobicContact CE1-CG2 4.15Å; Y318-T322 WeakPolarHBondContact CE1-OG1 3.21Å; Y318-T322 HydrophobicContact CE2-CG2 3.67Å; Y318-T322 HydrophobicContact CG-CG2 4.28Å; Y318-T322 WeakPolarHBondContact O-CB 3.34Å; Y318-T322 WeakPolarHBondContact O-CG2 3.28Å; Y318-T322 PolarHBondContact O-N 2.97Å; Y318-T322 PolarHBondContact O-OG1 2.88Å; Y318-K324 HydrophobicContact CE1-CB 4.28Å; Y318-P326 HydrophobicContact CD1-CB 3.76Å; Y318-P326 HydrophobicContact CG-CB 4.42Å; Y318-F470 HydrophobicContact CD1-CE1 4.35Å; Y318-F470 AromaticContact CD2-CD1 3.58Å; Y318-F470 HydrophobicContact CD2-CD1 3.58Å; Y318-F470 HydrophobicContact CD2-CE1 4.19Å; Y318-F470 HydrophobicContact CE2-CD1 4.27Å; Y318-F470 AromaticContact CG-CD1 3.71Å; Y318-F470 HydrophobicContact CG-CD1 3.71Å; Y318-F470 AromaticContact CG-CE1 3.91Å; Y318-F470 HydrophobicContact CG-CE1 3.91Å |
| 319 | F | 95.9 | Very high | 94.8 | Very high | 98 Ų | 98 | 63.3 Ų | 63.3 | 43% | 0.43 | 30% | 0.297 | S | S | . | . | H | α-helix | trans | -65.8 | -41.4 | 179.5 | 178.7 | -102.5 | 0 | 0 | 0 | 112.7 | P315 F316 I317 F321 R323 K324 P326 | P315-F319 VanDerWaalsContact O-CB 3.31Å; P315-F319 WeakPolarHBondContact O-CB 3.45Å; P315-F319 PolarHBondContact O-N 3.47Å; F316-F319 PolarHBondContact O-N 3.1Å; I317-F319 VanDerWaalsContact C-N 3.33Å; I317-F319 PolarHBondContact O-N 2.85Å; F319-F321 VanDerWaalsContact C-N 3.32Å; F319-F321 PolarHBondContact O-N 3.38Å; F319-R323 WeakPolarHBondContact O-CA 3.49Å; F319-R323 PolarHBondContact O-N 3.35Å; F319-K324 WeakPolarHBondContact CD2-O 3.3Å; F319-P326 HydrophobicContact CB-CG 4.47Å |
| 320 | I | 95 | Very high | 94.7 | Very high | 76 Ų | 76 | 64.1 Ų | 64.1 | 39% | 0.39 | 30% | 0.301 | S | S | . | . | H | α-helix | trans | -58 | -47.2 | 179.1 | -76.5 | 168.2 | 0 | 0 | 0 | 111 | F316 I317 R323 | F316-I320 HydrophobicContact CD1-CD1 3.69Å; F316-I320 HydrophobicContact CD2-CD1 4.33Å; F316-I320 HydrophobicContact CE1-CD1 3.28Å; F316-I320 HydrophobicContact CE1-CG1 4.41Å; F316-I320 HydrophobicContact CE2-CD1 3.97Å; F316-I320 HydrophobicContact CE2-CG1 4.32Å; F316-I320 HydrophobicContact CG-CD1 4.22Å; F316-I320 HydrophobicContact CZ-CD1 3.44Å; F316-I320 VanDerWaalsContact CZ-CD1 3.44Å; F316-I320 HydrophobicContact CZ-CG1 4.25Å; F316-I320 WeakPolarHBondContact O-CG1 3.5Å; F316-I320 PolarHBondContact O-N 3.18Å; I317-I320 PolarHBondContact O-N 3.05Å; I320-R323 PolarHBondContact O-NE 3.34Å |
| 321 | F | 92.3 | Very high | 94.5 | Very high | 103 Ų | 103 | 73.8 Ų | 73.8 | 45% | 0.452 | 34% | 0.337 | S | S | . | . | H | α-helix | trans | -84.1 | -44 | -173.3 | -73.3 | -71.4 | 0 | 0 | 0 | 113.1 | I317 F319 L474 H477 F478 | I317-F321 HydrophobicContact CG2-CD2 3.98Å; I317-F321 HydrophobicContact CG2-CE2 4Å; I317-F321 VanDerWaalsContact O-CD2 3.23Å; I317-F321 WeakPolarHBondContact O-CD2 3.47Å; I317-F321 PolarHBondContact O-N 2.82Å; F319-F321 VanDerWaalsContact C-N 3.32Å; F319-F321 PolarHBondContact O-N 3.38Å; F321-L474 HydrophobicContact CB-CD1 3.31Å; F321-L474 HydrophobicContact CD2-CD1 4.14Å; F321-L474 HydrophobicContact CG-CD1 3.95Å; F321-H477 PolarHBondContact O-CD2 2.98Å; F321-H477 PolarHBondContact O-NE2 2.92Å; F321-F478 AromaticContact CD1-CZ 3.84Å; F321-F478 HydrophobicContact CD1-CZ 3.84Å; F321-F478 HydrophobicContact CE1-CZ 4.32Å; F321-F478 HydrophobicContact CG-CZ 4.36Å |
| 322 | T | 91.8 | Very high | 94.1 | Very high | 6 Ų | 6 | 69.7 Ų | 69.7 | 4% | 0.037 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -89 | -19.8 | -176 | 70 | 0 | 0 | 0 | 0 | 113.6 | Y318 K324 L474 H477 | Y318-T322 HydrophobicContact CD1-CG2 4.37Å; Y318-T322 WeakPolarHBondContact CD1-OG1 3.35Å; Y318-T322 HydrophobicContact CD2-CG2 3.92Å; Y318-T322 HydrophobicContact CE1-CG2 4.15Å; Y318-T322 WeakPolarHBondContact CE1-OG1 3.21Å; Y318-T322 HydrophobicContact CE2-CG2 3.67Å; Y318-T322 HydrophobicContact CG-CG2 4.28Å; Y318-T322 WeakPolarHBondContact O-CB 3.34Å; Y318-T322 WeakPolarHBondContact O-CG2 3.28Å; Y318-T322 PolarHBondContact O-N 2.97Å; Y318-T322 PolarHBondContact O-OG1 2.88Å; T322-K324 PolarHBondContact O-N 2.83Å; T322-K324 PolarHBondContact OG1-N 3.48Å; T322-L474 HydrophobicContact CG2-CD1 3.84Å; T322-H477 HydrophobicContact CG2-CB 3.84Å |
| 323 | R | 92.3 | Very high | 93.9 | Very high | 196 Ų | 196 | 64.8 Ų | 64.8 | 74% | 0.74 | 29% | 0.292 | S | S | * | . | trans | 52.5 | 20.9 | -171.4 | -60.6 | -68.5 | -172.1 | 131.9 | 2.7 | 113.8 | F319 I320 | F319-R323 WeakPolarHBondContact O-CA 3.49Å; F319-R323 PolarHBondContact O-N 3.35Å; I320-R323 PolarHBondContact O-NE 3.34Å | ||
| 324 | K | 91.2 | Very high | 93.5 | Very high | 119 Ų | 119 | 68.9 Ų | 68.9 | 52% | 0.517 | 31% | 0.308 | S | S | . | . | S | Bend | trans | -104.4 | 157.4 | 175.5 | -69.2 | -179.9 | -178.6 | 179.3 | 0 | 110.3 | Y318 F319 T322 P326 | Y318-K324 HydrophobicContact CE1-CB 4.28Å; F319-K324 WeakPolarHBondContact CD2-O 3.3Å; T322-K324 PolarHBondContact O-N 2.83Å; T322-K324 PolarHBondContact OG1-N 3.48Å; K324-P326 WeakPolarHBondContact O-CD 3.47Å |
| 325 | N | 94.8 | Very high | 92.2 | Very high | 94 Ų | 94 | 71.8 Ų | 71.8 | 50% | 0.503 | 33% | 0.326 | S | S | . | . | trans | -67.6 | 113.6 | 177.5 | -174.7 | -7.2 | 0 | 0 | 0 | 110.8 | Y327 | N325-Y327 VanDerWaalsContact C-N 3.32Å; N325-Y327 PolarHBondContact O-N 3.45Å; N325-Y327 PolarHBondContact OD1-N 3.45Å | ||
| 326 | P | 95 | Very high | 91.3 | Very high | 8 Ų | 8 | 71.7 Ų | 71.7 | 5% | 0.052 | 33% | 0.325 | C | S | . | . | H | α-helix | trans | -68.4 | -28.8 | -179.1 | 27.7 | -35 | 0 | 0 | 0 | 112.9 | P315 Y318 F319 K324 T328 F329 L330 F470 | P315-P326 HydrophobicContact CB-CB 3.72Å; P315-P326 HydrophobicContact CB-CG 3.66Å; Y318-P326 HydrophobicContact CD1-CB 3.76Å; Y318-P326 HydrophobicContact CG-CB 4.42Å; F319-P326 HydrophobicContact CB-CG 4.47Å; K324-P326 WeakPolarHBondContact O-CD 3.47Å; P326-T328 VanDerWaalsContact C-N 3.31Å; P326-T328 PolarHBondContact O-N 2.95Å; P326-F329 WeakPolarHBondContact O-CA 3.39Å; P326-F329 VanDerWaalsContact O-CB 3.29Å; P326-F329 WeakPolarHBondContact O-CB 3.28Å; P326-F329 PolarHBondContact O-N 3.27Å; P326-F329 VanDerWaalsContact O-N 3.1Å; P326-L330 PolarHBondContact O-N 2.99Å; P326-F470 HydrophobicContact CB-CE1 4.06Å; P326-F470 HydrophobicContact CB-CZ 4.35Å |
| 327 | Y | 95.5 | Very high | 90.8 | Very high | 118 Ų | 118 | 66.4 Ų | 66.4 | 46% | 0.463 | 30% | 0.302 | S | S | . | . | H | α-helix | trans | -72.5 | -26.9 | -176.8 | -63 | -73.1 | 0 | 0 | 0 | 112.5 | L311 P315 N325 F329 L330 W331 | L311-Y327 PolarHBondContact O-OH 3.45Å; P315-Y327 HydrophobicContact CG-CE1 4.5Å; N325-Y327 VanDerWaalsContact C-N 3.32Å; N325-Y327 PolarHBondContact O-N 3.45Å; N325-Y327 PolarHBondContact OD1-N 3.45Å; Y327-F329 VanDerWaalsContact C-N 3.31Å; Y327-L330 HydrophobicContact CD1-CD1 3.88Å; Y327-L330 HydrophobicContact CE1-CD1 4.25Å; Y327-L330 PolarHBondContact O-N 3.05Å; Y327-W331 WeakPolarHBondContact O-CB 3.18Å; Y327-W331 PolarHBondContact O-N 3.07Å |
| 328 | T | 93.5 | Very high | 89.8 | Confident | 94 Ų | 94 | 67.8 Ų | 67.8 | 58% | 0.577 | 32% | 0.317 | S | S | * | . | H | α-helix | trans | -65.8 | -38.8 | 169.6 | -51.2 | 0 | 0 | 0 | 0 | 110.8 | P326 W331 G332 | P326-T328 VanDerWaalsContact C-N 3.31Å; P326-T328 PolarHBondContact O-N 2.95Å; T328-W331 PolarHBondContact O-N 2.88Å; T328-G332 PolarHBondContact O-N 3.38Å |
| 329 | F | 94 | Very high | 88.5 | Confident | 13 Ų | 13 | 69.4 Ų | 69.4 | 6% | 0.057 | 33% | 0.329 | C | S | . | . | H | α-helix | trans | -65.2 | -45.4 | 175.2 | -173 | -83.3 | 0 | 0 | 0 | 111.2 | P326 Y327 W331 G332 I333 N361 V363 A469 F470 | P326-F329 WeakPolarHBondContact O-CA 3.39Å; P326-F329 VanDerWaalsContact O-CB 3.29Å; P326-F329 WeakPolarHBondContact O-CB 3.28Å; P326-F329 PolarHBondContact O-N 3.27Å; P326-F329 VanDerWaalsContact O-N 3.1Å; Y327-F329 VanDerWaalsContact C-N 3.31Å; F329-W331 VanDerWaalsContact C-N 3.32Å; F329-W331 PolarHBondContact O-N 2.99Å; F329-G332 PolarHBondContact O-N 3.41Å; F329-G332 VanDerWaalsContact O-N 3.16Å; F329-I333 HydrophobicContact CD1-CD1 4.4Å; F329-I333 HydrophobicContact CE1-CD1 4.15Å; F329-I333 PolarHBondContact O-N 2.98Å; F329-N361 VanDerWaalsContact CD1-ND2 3.33Å; F329-N361 WeakPolarHBondContact CD1-ND2 3.36Å; F329-N361 HydrophobicContact CD2-CB 3.86Å; F329-N361 WeakPolarHBondContact CD2-ND2 3.47Å; F329-N361 WeakPolarHBondContact CE1-ND2 3.06Å; F329-N361 HydrophobicContact CE2-CB 3.61Å; F329-N361 WeakPolarHBondContact CE2-ND2 3.41Å; F329-N361 WeakPolarHBondContact CG-ND2 3.3Å; F329-N361 HydrophobicContact CZ-CB 4.29Å; F329-N361 VanDerWaalsContact CZ-ND2 3.29Å; F329-N361 WeakPolarHBondContact CZ-ND2 3.24Å; F329-N361 PolarHBondContact O-ND2 3.29Å; F329-V363 HydrophobicContact CE2-CG2 4.32Å; F329-A469 HydrophobicContact CE1-CB 4.11Å; F329-A469 WeakPolarHBondContact CE1-O 3.29Å; F329-A469 WeakPolarHBondContact CZ-O 3.2Å; F329-F470 HydrophobicContact CD1-CD1 4.04Å; F329-F470 AromaticContact CD1-CE1 3.97Å; F329-F470 HydrophobicContact CD1-CE1 3.97Å; F329-F470 HydrophobicContact CE1-CD1 4.28Å |
| 330 | L | 93.9 | Very high | 87.5 | Confident | 17 Ų | 17 | 64.8 Ų | 64.8 | 9% | 0.089 | 31% | 0.309 | C | S | . | . | H | α-helix | trans | -59.1 | -41.3 | 175.4 | -76 | 172.8 | 0 | 0 | 0 | 112.8 | P315 P326 Y327 G332 I333 F334 L337 E466 F470 | P315-L330 HydrophobicContact CG-CD1 4.11Å; P326-L330 PolarHBondContact O-N 2.99Å; Y327-L330 HydrophobicContact CD1-CD1 3.88Å; Y327-L330 HydrophobicContact CE1-CD1 4.25Å; Y327-L330 PolarHBondContact O-N 3.05Å; L330-G332 PolarHBondContact O-N 3.39Å; L330-I333 HydrophobicContact CD2-CD1 4.18Å; L330-I333 WeakPolarHBondContact O-CG1 3.37Å; L330-I333 PolarHBondContact O-N 3.26Å; L330-I333 VanDerWaalsContact O-N 3.16Å; L330-F334 PolarHBondContact O-N 2.9Å; L330-L337 HydrophobicContact CD2-CD1 4.25Å; L330-E466 HydrophobicContact CD2-CG 4Å; L330-E466 WeakPolarHBondContact CD2-OE1 2.95Å; L330-F470 HydrophobicContact CD1-CE2 4.41Å; L330-F470 HydrophobicContact CD1-CZ 3.9Å; L330-F470 HydrophobicContact CD2-CE2 3.65Å; L330-F470 HydrophobicContact CD2-CZ 3.61Å; L330-F470 HydrophobicContact CG-CE1 4.44Å; L330-F470 HydrophobicContact CG-CE2 4.13Å; L330-F470 HydrophobicContact CG-CZ 3.57Å |
| 331 | W | 92.3 | Very high | 86.7 | Confident | 204 Ų | 204 | 65.6 Ų | 65.6 | 77% | 0.773 | 31% | 0.31 | S | S | * | . | H | α-helix | trans | -60.4 | -35.3 | 177.9 | -168.4 | -104.3 | 0 | 0 | 0 | 112.6 | Y327 T328 F329 | Y327-W331 WeakPolarHBondContact O-CB 3.18Å; Y327-W331 PolarHBondContact O-N 3.07Å; T328-W331 PolarHBondContact O-N 2.88Å; F329-W331 VanDerWaalsContact C-N 3.32Å; F329-W331 PolarHBondContact O-N 2.99Å |
| 332 | G | 86.9 | Confident | 85.2 | Confident | 8 Ų | 8 | 62 Ų | 62 | 8% | 0.082 | 30% | 0.302 | C | S | . | . | H | α-helix | trans | -64.6 | -41.4 | 175.5 | 0 | 0 | 0 | 0 | 0 | 113 | T328 F329 L330 K360 N361 | T328-G332 PolarHBondContact O-N 3.38Å; F329-G332 PolarHBondContact O-N 3.41Å; F329-G332 VanDerWaalsContact O-N 3.16Å; L330-G332 PolarHBondContact O-N 3.39Å; G332-K360 WeakPolarHBondContact O-CD 3.33Å; G332-K360 PolarHBondContact O-NZ 3.46Å; G332-N361 WeakPolarHBondContact CA-OD1 3.38Å |
| 333 | I | 91.8 | Very high | 83.9 | Confident | 0 Ų | 0 | 64.6 Ų | 64.6 | 0% | 0 | 32% | 0.318 | C | S | . | . | H | α-helix | trans | -90.6 | -2 | -178.3 | 64 | 173.4 | 0 | 0 | 0 | 114.5 | F329 L330 T335 A336 L337 M353 C356 V357 A469 | F329-I333 HydrophobicContact CD1-CD1 4.4Å; F329-I333 HydrophobicContact CE1-CD1 4.15Å; F329-I333 PolarHBondContact O-N 2.98Å; L330-I333 HydrophobicContact CD2-CD1 4.18Å; L330-I333 WeakPolarHBondContact O-CG1 3.37Å; L330-I333 PolarHBondContact O-N 3.26Å; L330-I333 VanDerWaalsContact O-N 3.16Å; I333-T335 PolarHBondContact O-N 3.17Å; I333-A336 WeakPolarHBondContact O-CA 3.42Å; I333-A336 WeakPolarHBondContact O-CB 3.09Å; I333-A336 PolarHBondContact O-N 3.02Å; I333-L337 HydrophobicContact CD1-CD1 4.38Å; I333-L337 HydrophobicContact CD1-CD2 4.35Å; I333-L337 HydrophobicContact CD1-CG 4.44Å; I333-L337 HydrophobicContact CG1-CD1 4.19Å; I333-L337 HydrophobicContact CG1-CG 4.26Å; I333-L337 PolarHBondContact O-N 2.84Å; I333-L337 VanDerWaalsContact O-N 3.11Å; I333-M353 HydrophobicContact CB-SD 3.94Å; I333-M353 HydrophobicContact CD1-CE 4.27Å; I333-M353 HydrophobicContact CD1-SD 4.45Å; I333-M353 HydrophobicContact CG2-SD 3.93Å; I333-C356 HydrophobicContact CG2-CB 4.18Å; I333-V357 HydrophobicContact CG2-CG2 3.68Å; I333-A469 HydrophobicContact CD1-CB 3.47Å; I333-A469 VanDerWaalsContact CD1-CB 3.47Å |
| 334 | F | 88.3 | Confident | 83 | Confident | 118 Ų | 118 | 55.4 Ų | 55.4 | 52% | 0.518 | 28% | 0.284 | S | S | . | . | H | α-helix | trans | -50.8 | -36.6 | -176.3 | -177.9 | -100.4 | 0 | 0 | 0 | 113.9 | L330 A336 L337 A338 | L330-F334 PolarHBondContact O-N 2.9Å; F334-A336 VanDerWaalsContact C-N 3.33Å; F334-A336 PolarHBondContact O-N 3.42Å; F334-L337 PolarHBondContact O-N 3.45Å; F334-A338 WeakPolarHBondContact O-CB 3.19Å; F334-A338 PolarHBondContact O-N 3.25Å |
| 335 | T | 69.6 | Low | 82.2 | Confident | 63 Ų | 63 | 50.4 Ų | 50.4 | 39% | 0.387 | 26% | 0.264 | S | S | . | . | H | α-helix | trans | -61.9 | -39.3 | 176.2 | 42.3 | 0 | 0 | 0 | 0 | 112.8 | I333 T339 C356 K360 | I333-T335 PolarHBondContact O-N 3.17Å; T335-T339 PolarHBondContact O-N 2.99Å; T335-T339 PolarHBondContact O-OG1 3.44Å; T335-T339 VanDerWaalsContact O-OG1 3.08Å; T335-C356 PolarHBondContact OG1-SG 3.25Å; T335-K360 PolarHBondContact OG1-NZ 3.41Å |
| 336 | A | 76.4 | Confident | 81.5 | Confident | 0 Ų | 0 | 46.1 Ų | 46.1 | 0% | 0 | 24% | 0.241 | C | C | . | . | H | α-helix | trans | -72.2 | -39.8 | 175.9 | 0 | 0 | 0 | 0 | 0 | 111.4 | I333 F334 A338 T339 A340 L352 M353 | I333-A336 WeakPolarHBondContact O-CA 3.42Å; I333-A336 WeakPolarHBondContact O-CB 3.09Å; I333-A336 PolarHBondContact O-N 3.02Å; F334-A336 VanDerWaalsContact C-N 3.33Å; F334-A336 PolarHBondContact O-N 3.42Å; A336-A338 PolarHBondContact O-N 3.33Å; A336-T339 WeakPolarHBondContact O-CB 3.47Å; A336-T339 PolarHBondContact O-N 3.48Å; A336-A340 WeakPolarHBondContact O-CB 3.47Å; A336-A340 PolarHBondContact O-N 3.46Å; A336-L352 HydrophobicContact CB-CD2 4.5Å; A336-L352 HydrophobicContact CB-CG 4.23Å; A336-M353 HydrophobicContact CB-CB 4.14Å; A336-M353 HydrophobicContact CB-CE 4.09Å; A336-M353 HydrophobicContact CB-SD 3.8Å |
| 337 | L | 86.3 | Confident | 80.4 | Confident | 18 Ų | 18 | 48.3 Ų | 48.3 | 9% | 0.094 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -60.3 | -44.5 | 175 | -59.3 | -177.4 | 0 | 0 | 0 | 111.7 | L330 I333 F334 T339 A340 F341 M353 V462 V465 E466 | L330-L337 HydrophobicContact CD2-CD1 4.25Å; I333-L337 HydrophobicContact CD1-CD1 4.38Å; I333-L337 HydrophobicContact CD1-CD2 4.35Å; I333-L337 HydrophobicContact CD1-CG 4.44Å; I333-L337 HydrophobicContact CG1-CD1 4.19Å; I333-L337 HydrophobicContact CG1-CG 4.26Å; I333-L337 PolarHBondContact O-N 2.84Å; I333-L337 VanDerWaalsContact O-N 3.11Å; F334-L337 PolarHBondContact O-N 3.45Å; L337-T339 VanDerWaalsContact C-N 3.31Å; L337-T339 PolarHBondContact O-N 3.44Å; L337-A340 PolarHBondContact O-N 3.47Å; L337-A340 VanDerWaalsContact O-N 3.17Å; L337-F341 PolarHBondContact O-N 3.43Å; L337-M353 HydrophobicContact CD2-CE 3.98Å; L337-V462 HydrophobicContact CB-CG1 4.33Å; L337-V462 HydrophobicContact CD2-CG1 4.31Å; L337-V465 HydrophobicContact CD2-CG2 3.72Å; L337-E466 HydrophobicContact CD2-CB 3.99Å |
| 338 | A | 73.5 | Confident | 78.9 | Confident | 52 Ų | 52 | 45.7 Ų | 45.7 | 43% | 0.43 | 26% | 0.259 | S | S | . | . | H | α-helix | trans | -63.5 | -36.9 | 176 | 0 | 0 | 0 | 0 | 0 | 112.2 | F334 A336 G342 | F334-A338 WeakPolarHBondContact O-CB 3.19Å; F334-A338 PolarHBondContact O-N 3.25Å; A336-A338 PolarHBondContact O-N 3.33Å; A338-G342 PolarHBondContact O-N 2.99Å |
| 339 | T | 67.5 | Low | 77.9 | Confident | 53 Ų | 53 | 41.2 Ų | 41.2 | 33% | 0.325 | 23% | 0.232 | S | C | . | . | H | α-helix | trans | -66 | -42.2 | 172.1 | -59.8 | 0 | 0 | 0 | 0 | 111.5 | T335 A336 L337 F341 G342 T343 T349 L352 | T335-T339 PolarHBondContact O-N 2.99Å; T335-T339 PolarHBondContact O-OG1 3.44Å; T335-T339 VanDerWaalsContact O-OG1 3.08Å; A336-T339 WeakPolarHBondContact O-CB 3.47Å; A336-T339 PolarHBondContact O-N 3.48Å; L337-T339 VanDerWaalsContact C-N 3.31Å; L337-T339 PolarHBondContact O-N 3.44Å; T339-F341 VanDerWaalsContact C-N 3.33Å; T339-F341 PolarHBondContact O-N 3.29Å; T339-G342 WeakPolarHBondContact O-CA 3.38Å; T339-G342 PolarHBondContact O-N 2.85Å; T339-T343 HydrophobicContact CG2-CG2 3.99Å; T339-T343 WeakPolarHBondContact O-CG2 3.44Å; T339-T343 PolarHBondContact O-N 2.87Å; T339-T343 PolarHBondContact O-OG1 3.5Å; T339-T343 VanDerWaalsContact O-OG1 3.09Å; T339-T349 HydrophobicContact CG2-CG2 3.99Å; T339-L352 HydrophobicContact CG2-CD2 4.09Å; T339-L352 VanDerWaalsContact OG1-CD2 3.24Å; T339-L352 WeakPolarHBondContact OG1-CD2 3.17Å |
| 340 | A | 75.9 | Confident | 76.9 | Confident | 0 Ų | 0 | 42.3 Ų | 42.3 | 0% | 0 | 24% | 0.238 | C | C | . | . | H | α-helix | trans | -63.1 | -39.2 | 178.8 | 0 | 0 | 0 | 0 | 0 | 112.5 | A336 L337 G342 S344 T349 T461 V462 V465 | A336-A340 WeakPolarHBondContact O-CB 3.47Å; A336-A340 PolarHBondContact O-N 3.46Å; L337-A340 PolarHBondContact O-N 3.47Å; L337-A340 VanDerWaalsContact O-N 3.17Å; A340-G342 VanDerWaalsContact C-N 3.29Å; A340-G342 PolarHBondContact O-N 2.91Å; A340-S344 WeakPolarHBondContact O-CA 3.35Å; A340-S344 PolarHBondContact O-N 3.49Å; A340-T349 HydrophobicContact CB-CG2 3.65Å; A340-T461 HydrophobicContact CB-CG2 4.01Å; A340-V462 HydrophobicContact CB-CG2 4.49Å; A340-V465 HydrophobicContact CB-CG1 4.38Å; A340-V465 HydrophobicContact CB-CG2 3.69Å |
| 341 | F | 78.6 | Confident | 75.7 | Confident | 93 Ų | 93 | 45.9 Ų | 45.9 | 41% | 0.408 | 26% | 0.262 | S | S | . | . | H | α-helix | trans | -61.1 | -38.4 | 170.7 | -173.9 | -92.1 | 0 | 0 | 0 | 112.6 | L337 T339 R458 T459 V462 | L337-F341 PolarHBondContact O-N 3.43Å; T339-F341 VanDerWaalsContact C-N 3.33Å; T339-F341 PolarHBondContact O-N 3.29Å; F341-R458 HydrophobicContact CD2-CB 3.79Å; F341-R458 HydrophobicContact CE2-CB 3.72Å; F341-R458 HydrophobicContact CG-CB 4.37Å; F341-R458 HydrophobicContact CZ-CB 4.24Å; F341-R458 WeakPolarHBondContact O-CG 3.49Å; F341-T459 HydrophobicContact CE2-CG2 4.11Å; F341-V462 HydrophobicContact CB-CG2 3.61Å; F341-V462 HydrophobicContact CD2-CG2 4.08Å; F341-V462 HydrophobicContact CG-CG2 4.36Å |
| 342 | G | 61.1 | Low | 74.5 | Confident | 29 Ų | 29 | 39.1 Ų | 39.1 | 30% | 0.299 | 24% | 0.241 | S | C | . | . | H | α-helix | trans | -72.1 | -47 | 179.7 | 0 | 0 | 0 | 0 | 0 | 113 | A338 T339 A340 | A338-G342 PolarHBondContact O-N 2.99Å; T339-G342 WeakPolarHBondContact O-CA 3.38Å; T339-G342 PolarHBondContact O-N 2.85Å; A340-G342 VanDerWaalsContact C-N 3.29Å; A340-G342 PolarHBondContact O-N 2.91Å |
| 343 | T | 64.6 | Low | 74.3 | Confident | 59 Ų | 59 | 39 Ų | 39 | 36% | 0.362 | 24% | 0.238 | S | C | . | . | H | α-helix | trans | -82.1 | -23.1 | -174.8 | 59.4 | 0 | 0 | 0 | 0 | 113.8 | T339 S345 T349 | T339-T343 HydrophobicContact CG2-CG2 3.99Å; T339-T343 WeakPolarHBondContact O-CG2 3.44Å; T339-T343 PolarHBondContact O-N 2.87Å; T339-T343 PolarHBondContact O-OG1 3.5Å; T339-T343 VanDerWaalsContact O-OG1 3.09Å; T343-S345 PolarHBondContact O-N 3.02Å; T343-S345 PolarHBondContact OG1-N 3.28Å; T343-S345 PolarHBondContact OG1-O 3.03Å; T343-T349 WeakPolarHBondContact OG1-CG2 3.26Å |
| 344 | S | 72.9 | Confident | 73.6 | Confident | 4 Ų | 4 | 40.6 Ų | 40.6 | 3% | 0.028 | 25% | 0.246 | C | C | . | . | trans | 54.3 | 29 | -170.9 | -63.1 | 0 | 0 | 0 | 0 | 113.3 | A340 P425 R458 T461 | A340-S344 WeakPolarHBondContact O-CA 3.35Å; A340-S344 PolarHBondContact O-N 3.49Å; S344-P425 WeakPolarHBondContact O-CA 3.03Å; S344-P425 WeakPolarHBondContact O-CG 3.3Å; S344-R458 WeakPolarHBondContact OG-CG 3.29Å; S344-T461 VanDerWaalsContact C-OG1 3.28Å; S344-T461 WeakPolarHBondContact CA-OG1 3.49Å; S344-T461 PolarHBondContact O-OG1 3.48Å | ||
| 345 | S | 74.2 | Confident | 72.7 | Confident | 13 Ų | 13 | 40.2 Ų | 40.2 | 9% | 0.091 | 24% | 0.244 | C | C | . | . | trans | -141.8 | 118.6 | -179.8 | 170.1 | 0 | 0 | 0 | 0 | 111.4 | T343 A348 T349 G423 | T343-S345 PolarHBondContact O-N 3.02Å; T343-S345 PolarHBondContact OG1-N 3.28Å; T343-S345 PolarHBondContact OG1-O 3.03Å; S345-A348 PolarHBondContact O-N 2.98Å; S345-A348 WeakPolarHBondContact OG-CB 3.35Å; S345-A348 PolarHBondContact OG-N 2.72Å; S345-A348 VanDerWaalsContact OG-N 3.16Å; S345-T349 VanDerWaalsContact O-CG2 3.27Å; S345-T349 WeakPolarHBondContact O-CG2 3.43Å; S345-T349 PolarHBondContact O-N 2.94Å; S345-G423 WeakPolarHBondContact CA-O 3.41Å; S345-G423 WeakPolarHBondContact CB-O 3.35Å; S345-G423 PolarHBondContact OG-O 3.18Å | ||
| 346 | S | 79.6 | Confident | 73.3 | Confident | 4 Ų | 4 | 37.5 Ų | 37.5 | 3% | 0.028 | 23% | 0.228 | C | C | . | . | H | α-helix | trans | -62.7 | -45.3 | 176.3 | -56 | 0 | 0 | 0 | 0 | 110.7 | A348 T349 L350 G423 | S346-A348 PolarHBondContact O-N 3.25Å; S346-T349 PolarHBondContact O-N 3.14Å; S346-T349 VanDerWaalsContact O-N 3.08Å; S346-T349 PolarHBondContact O-OG1 2.89Å; S346-L350 PolarHBondContact O-N 3.49Å; S346-G423 PolarHBondContact N-O 3.45Å |
| 347 | S | 72.7 | Confident | 73.9 | Confident | 54 Ų | 54 | 37.5 Ų | 37.5 | 38% | 0.378 | 23% | 0.228 | S | C | . | . | H | α-helix | trans | -63.3 | -38.4 | -179.8 | -51.9 | 0 | 0 | 0 | 0 | 112.6 | T349 L350 G423 | S347-T349 PolarHBondContact O-N 3.45Å; S347-L350 WeakPolarHBondContact O-CB 3.25Å; S347-L350 PolarHBondContact O-N 3.36Å; S347-G423 PolarHBondContact N-O 3.02Å; S347-G423 PolarHBondContact OG-O 3.34Å |
| 348 | A | 64.4 | Low | 74 | Confident | 63 Ų | 63 | 38.1 Ų | 38.1 | 52% | 0.521 | 23% | 0.231 | S | C | . | . | H | α-helix | trans | -66.4 | -24.4 | 176.7 | 0 | 0 | 0 | 0 | 0 | 113 | S345 S346 | S345-A348 PolarHBondContact O-N 2.98Å; S345-A348 WeakPolarHBondContact OG-CB 3.35Å; S345-A348 PolarHBondContact OG-N 2.72Å; S345-A348 VanDerWaalsContact OG-N 3.16Å; S346-A348 PolarHBondContact O-N 3.25Å |
| 349 | T | 70.7 | Confident | 74.6 | Confident | 1 Ų | 1 | 42.1 Ų | 42.1 | 1% | 0.006 | 24% | 0.24 | C | C | . | . | H | α-helix | trans | -94.3 | -12.6 | -178 | 66 | 0 | 0 | 0 | 0 | 114.2 | T339 A340 T343 S345 S346 S347 L352 M353 V465 | T339-T349 HydrophobicContact CG2-CG2 3.99Å; A340-T349 HydrophobicContact CB-CG2 3.65Å; T343-T349 WeakPolarHBondContact OG1-CG2 3.26Å; S345-T349 VanDerWaalsContact O-CG2 3.27Å; S345-T349 WeakPolarHBondContact O-CG2 3.43Å; S345-T349 PolarHBondContact O-N 2.94Å; S346-T349 PolarHBondContact O-N 3.14Å; S346-T349 VanDerWaalsContact O-N 3.08Å; S346-T349 PolarHBondContact O-OG1 2.89Å; S347-T349 PolarHBondContact O-N 3.45Å; T349-L352 PolarHBondContact O-N 3.38Å; T349-L352 VanDerWaalsContact O-N 3.08Å; T349-M353 PolarHBondContact O-N 2.85Å; T349-V465 WeakPolarHBondContact OG1-CG1 3.29Å |
| 350 | L | 73.1 | Confident | 75.6 | Confident | 35 Ų | 35 | 45 Ų | 45 | 18% | 0.183 | 25% | 0.248 | C | C | . | . | H | α-helix | trans | -51.1 | -48.3 | -174.4 | 177 | 64.9 | 0 | 0 | 0 | 113.3 | S346 S347 L352 M353 M354 L372 P373 | S346-L350 PolarHBondContact O-N 3.49Å; S347-L350 WeakPolarHBondContact O-CB 3.25Å; S347-L350 PolarHBondContact O-N 3.36Å; L350-L352 VanDerWaalsContact C-N 3.31Å; L350-L352 PolarHBondContact O-N 3.3Å; L350-M353 PolarHBondContact O-N 3.04Å; L350-M354 HydrophobicContact CD1-CG 4.11Å; L350-M354 HydrophobicContact CD1-SD 4.22Å; L350-M354 HydrophobicContact CG-CG 4.47Å; L350-M354 HydrophobicContact CG-SD 4.08Å; L350-M354 VanDerWaalsContact O-CG 3.22Å; L350-M354 WeakPolarHBondContact O-CG 3.43Å; L350-M354 PolarHBondContact O-N 3.4Å; L350-L372 HydrophobicContact CD1-CB 3.61Å; L350-L372 WeakPolarHBondContact CD1-O 3.25Å; L350-P373 HydrophobicContact CD1-CG 4.34Å; L350-P373 HydrophobicContact CD2-CB 3.98Å; L350-P373 HydrophobicContact CD2-CG 4.11Å |
| 351 | P | 69.8 | Low | 76.3 | Confident | 92 Ų | 92 | 46.7 Ų | 46.7 | 60% | 0.597 | 26% | 0.257 | S | S | * | . | H | α-helix | trans | -62.7 | -37 | -179.4 | -22.1 | 34.1 | 0 | 0 | 0 | 113.4 | K355 | P351-K355 PolarHBondContact O-N 3.43Å |
| 352 | L | 66.1 | Low | 76.7 | Confident | 63 Ų | 63 | 45 Ų | 45 | 33% | 0.33 | 27% | 0.266 | S | S | . | . | H | α-helix | trans | -72.9 | -38.7 | 178.3 | -178.6 | 61.7 | 0 | 0 | 0 | 111.2 | A336 T339 T349 L350 K355 C356 | A336-L352 HydrophobicContact CB-CD2 4.5Å; A336-L352 HydrophobicContact CB-CG 4.23Å; T339-L352 HydrophobicContact CG2-CD2 4.09Å; T339-L352 VanDerWaalsContact OG1-CD2 3.24Å; T339-L352 WeakPolarHBondContact OG1-CD2 3.17Å; T349-L352 PolarHBondContact O-N 3.38Å; T349-L352 VanDerWaalsContact O-N 3.08Å; L350-L352 VanDerWaalsContact C-N 3.31Å; L350-L352 PolarHBondContact O-N 3.3Å; L352-K355 PolarHBondContact O-N 3.14Å; L352-C356 PolarHBondContact O-N 3.34Å; L352-C356 PolarHBondContact O-SG 3.5Å |
| 353 | M | 83.9 | Confident | 78.1 | Confident | 4 Ų | 4 | 44 Ų | 44 | 2% | 0.02 | 25% | 0.254 | C | S | . | . | H | α-helix | trans | -61.9 | -48.2 | 175.5 | -176.1 | 59.4 | 96.8 | 0 | 0 | 111 | I333 A336 L337 T349 L350 K355 C356 V357 L372 V465 A469 | I333-M353 HydrophobicContact CB-SD 3.94Å; I333-M353 HydrophobicContact CD1-CE 4.27Å; I333-M353 HydrophobicContact CD1-SD 4.45Å; I333-M353 HydrophobicContact CG2-SD 3.93Å; A336-M353 HydrophobicContact CB-CB 4.14Å; A336-M353 HydrophobicContact CB-CE 4.09Å; A336-M353 HydrophobicContact CB-SD 3.8Å; L337-M353 HydrophobicContact CD2-CE 3.98Å; T349-M353 PolarHBondContact O-N 2.85Å; L350-M353 PolarHBondContact O-N 3.04Å; M353-K355 VanDerWaalsContact C-N 3.3Å; M353-K355 PolarHBondContact O-N 2.76Å; M353-C356 PolarHBondContact O-N 2.82Å; M353-C356 VanDerWaalsContact O-N 3.12Å; M353-V357 HydrophobicContact CG-CG2 4.22Å; M353-V357 WeakPolarHBondContact O-CB 3.25Å; M353-V357 WeakPolarHBondContact O-CG2 3.42Å; M353-V357 PolarHBondContact O-N 2.86Å; M353-V357 HydrophobicContact SD-CG2 3.89Å; M353-L372 HydrophobicContact CG-CD1 4.26Å; M353-L372 HydrophobicContact CG-CD2 4.41Å; M353-V465 HydrophobicContact CE-CB 3.76Å; M353-V465 HydrophobicContact CE-CG2 3.84Å; M353-V465 VanDerWaalsContact CE-O 3.27Å; M353-V465 WeakPolarHBondContact CE-O 3.14Å; M353-A469 HydrophobicContact CE-CB 3.87Å; M353-A469 HydrophobicContact SD-CB 3.85Å |
| 354 | M | 75.8 | Confident | 79.2 | Confident | 35 Ų | 35 | 43.3 Ų | 43.3 | 17% | 0.172 | 25% | 0.252 | C | S | . | . | H | α-helix | trans | -54.4 | -46.8 | 176.4 | -66.8 | 170 | 104 | 0 | 0 | 111.6 | L350 C356 V357 E358 R369 L372 P373 | L350-M354 HydrophobicContact CD1-CG 4.11Å; L350-M354 HydrophobicContact CD1-SD 4.22Å; L350-M354 HydrophobicContact CG-CG 4.47Å; L350-M354 HydrophobicContact CG-SD 4.08Å; L350-M354 VanDerWaalsContact O-CG 3.22Å; L350-M354 WeakPolarHBondContact O-CG 3.43Å; L350-M354 PolarHBondContact O-N 3.4Å; M354-C356 PolarHBondContact O-N 2.93Å; M354-V357 PolarHBondContact O-N 3.38Å; M354-E358 WeakPolarHBondContact O-CB 3.5Å; M354-E358 VanDerWaalsContact O-CG 3.24Å; M354-E358 WeakPolarHBondContact O-CG 3.38Å; M354-E358 PolarHBondContact O-N 3.2Å; M354-R369 VanDerWaalsContact CE-CA 3.46Å; M354-R369 HydrophobicContact CE-CB 3.89Å; M354-R369 HydrophobicContact CE-CG 3.54Å; M354-L372 HydrophobicContact CB-CD1 4.25Å; M354-L372 HydrophobicContact CG-CB 4.31Å; M354-L372 HydrophobicContact CG-CD1 3.73Å; M354-P373 HydrophobicContact CE-CG 4.07Å |
| 355 | K | 70.9 | Confident | 79.3 | Confident | 109 Ų | 109 | 49.1 Ų | 49.1 | 47% | 0.474 | 28% | 0.277 | S | S | . | . | H | α-helix | trans | -61.1 | -45.4 | 177.3 | -172.9 | 178.7 | 179.9 | 178.5 | 0 | 112.4 | P351 L352 M353 E359 | P351-K355 PolarHBondContact O-N 3.43Å; L352-K355 PolarHBondContact O-N 3.14Å; M353-K355 VanDerWaalsContact C-N 3.3Å; M353-K355 PolarHBondContact O-N 2.76Å; K355-E359 WeakPolarHBondContact CE-OE1 3.49Å; K355-E359 WeakPolarHBondContact CE-OE2 3.33Å; K355-E359 HydrophobicContact CG-CG 4.24Å; K355-E359 WeakPolarHBondContact O-CB 3.39Å; K355-E359 WeakPolarHBondContact O-CG 3.42Å; K355-E359 PolarHBondContact O-N 3.04Å |
| 356 | C | 80.8 | Confident | 79.3 | Confident | 6 Ų | 6 | 55.3 Ų | 55.3 | 4% | 0.041 | 30% | 0.304 | C | S | . | . | H | α-helix | trans | -64.6 | -43 | 179.9 | -65.1 | 0 | 0 | 0 | 0 | 111.7 | I333 T335 L352 M353 M354 K360 N361 | I333-C356 HydrophobicContact CG2-CB 4.18Å; T335-C356 PolarHBondContact OG1-SG 3.25Å; L352-C356 PolarHBondContact O-N 3.34Å; L352-C356 PolarHBondContact O-SG 3.5Å; M353-C356 PolarHBondContact O-N 2.82Å; M353-C356 VanDerWaalsContact O-N 3.12Å; M354-C356 PolarHBondContact O-N 2.93Å; C356-K360 VanDerWaalsContact O-CB 3.31Å; C356-K360 WeakPolarHBondContact O-CB 3.42Å; C356-K360 PolarHBondContact O-N 3.05Å; C356-N361 PolarHBondContact O-N 2.89Å |
| 357 | V | 89.9 | Confident | 79.4 | Confident | 0 Ų | 0 | 55.2 Ų | 55.2 | 0% | 0 | 30% | 0.303 | C | S | . | . | H | α-helix | trans | -66.8 | -40 | -180 | 168.8 | 0 | 0 | 0 | 0 | 111.6 | I333 M353 M354 N361 G362 V363 L372 A469 A472 | I333-V357 HydrophobicContact CG2-CG2 3.68Å; M353-V357 HydrophobicContact CG-CG2 4.22Å; M353-V357 WeakPolarHBondContact O-CB 3.25Å; M353-V357 WeakPolarHBondContact O-CG2 3.42Å; M353-V357 PolarHBondContact O-N 2.86Å; M353-V357 HydrophobicContact SD-CG2 3.89Å; M354-V357 PolarHBondContact O-N 3.38Å; V357-N361 CarbonylContact O-C 3.22Å; V357-G362 PolarHBondContact O-N 2.87Å; V357-V363 HydrophobicContact CG1-CB 3.54Å; V357-V363 HydrophobicContact CG1-CG1 3.98Å; V357-V363 HydrophobicContact CG1-CG2 3.64Å; V357-V363 PolarHBondContact O-N 3.1Å; V357-L372 HydrophobicContact CB-CD1 4.28Å; V357-L372 HydrophobicContact CG1-CD1 4.39Å; V357-L372 HydrophobicContact CG2-CD1 4.31Å; V357-A469 HydrophobicContact CG2-CB 4.11Å; V357-A472 HydrophobicContact CG1-CB 4.34Å |
| 358 | E | 87.7 | Confident | 79.6 | Confident | 32 Ų | 32 | 52.7 Ų | 52.7 | 15% | 0.15 | 29% | 0.285 | C | S | . | . | H | α-helix | trans | -71.4 | -51.2 | 177 | -71.7 | 175.3 | -166.4 | 0 | 0 | 112.5 | M354 G362 K365 S368 R369 | M354-E358 WeakPolarHBondContact O-CB 3.5Å; M354-E358 VanDerWaalsContact O-CG 3.24Å; M354-E358 WeakPolarHBondContact O-CG 3.38Å; M354-E358 PolarHBondContact O-N 3.2Å; E358-G362 PolarHBondContact O-N 3.37Å; E358-K365 HydrophobicContact CG-CG 4.18Å; E358-K365 WeakPolarHBondContact OE2-CE 3.19Å; E358-S368 VanDerWaalsContact CG-OG 3.29Å; E358-S368 WeakPolarHBondContact CG-OG 3.35Å; E358-S368 PolarHBondContact OE1-OG 3.49Å; E358-R369 IonicContact OE1-NE 3.99Å; E358-R369 PolarHBondContact OE1-NE 3.47Å; E358-R369 IonicContact OE2-NH2 3.7Å |
| 359 | E | 86.9 | Confident | 80.1 | Confident | 135 Ų | 135 | 56.6 Ų | 56.6 | 63% | 0.631 | 29% | 0.286 | S | S | * | . | H | α-helix | trans | -84.3 | -38.2 | -169.8 | -65.7 | 179.5 | 177.1 | 0 | 0 | 113.6 | K355 | K355-E359 WeakPolarHBondContact CE-OE1 3.49Å; K355-E359 WeakPolarHBondContact CE-OE2 3.33Å; K355-E359 HydrophobicContact CG-CG 4.24Å; K355-E359 WeakPolarHBondContact O-CB 3.39Å; K355-E359 WeakPolarHBondContact O-CG 3.42Å; K355-E359 PolarHBondContact O-N 3.04Å |
| 360 | K | 88 | Confident | 80.3 | Confident | 114 Ų | 114 | 59.3 Ų | 59.3 | 50% | 0.496 | 30% | 0.298 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -96.6 | -35.6 | -174.7 | -63.3 | 174.5 | 171.3 | 179.9 | 0 | 112.9 | G332 T335 C356 | G332-K360 WeakPolarHBondContact O-CD 3.33Å; G332-K360 PolarHBondContact O-NZ 3.46Å; T335-K360 PolarHBondContact OG1-NZ 3.41Å; C356-K360 VanDerWaalsContact O-CB 3.31Å; C356-K360 WeakPolarHBondContact O-CB 3.42Å; C356-K360 PolarHBondContact O-N 3.05Å |
| 361 | N | 89.8 | Confident | 80.8 | Confident | 35 Ų | 35 | 57.8 Ų | 57.8 | 19% | 0.187 | 29% | 0.29 | C | S | . | . | S | Bend | trans | -101.3 | -7.4 | -175.8 | -65.8 | 14.1 | 0 | 0 | 0 | 112.9 | F329 G332 C356 V357 V363 | F329-N361 VanDerWaalsContact CD1-ND2 3.33Å; F329-N361 WeakPolarHBondContact CD1-ND2 3.36Å; F329-N361 HydrophobicContact CD2-CB 3.86Å; F329-N361 WeakPolarHBondContact CD2-ND2 3.47Å; F329-N361 WeakPolarHBondContact CE1-ND2 3.06Å; F329-N361 HydrophobicContact CE2-CB 3.61Å; F329-N361 WeakPolarHBondContact CE2-ND2 3.41Å; F329-N361 WeakPolarHBondContact CG-ND2 3.3Å; F329-N361 HydrophobicContact CZ-CB 4.29Å; F329-N361 VanDerWaalsContact CZ-ND2 3.29Å; F329-N361 WeakPolarHBondContact CZ-ND2 3.24Å; F329-N361 PolarHBondContact O-ND2 3.29Å; G332-N361 WeakPolarHBondContact CA-OD1 3.38Å; C356-N361 PolarHBondContact O-N 2.89Å; V357-N361 CarbonylContact O-C 3.22Å; N361-V363 VanDerWaalsContact C-N 3.31Å; N361-V363 PolarHBondContact O-N 2.95Å |
| 362 | G | 88 | Confident | 81.3 | Confident | 58 Ų | 58 | 53.4 Ų | 53.4 | 60% | 0.598 | 26% | 0.262 | S | S | * | . | trans | 69.9 | 24.3 | 172.9 | 0 | 0 | 0 | 0 | 0 | 114.3 | V357 E358 | V357-G362 PolarHBondContact O-N 2.87Å; E358-G362 PolarHBondContact O-N 3.37Å | ||
| 363 | V | 90.7 | Very high | 81.8 | Confident | 8 Ų | 8 | 52.7 Ų | 52.7 | 5% | 0.048 | 26% | 0.261 | C | S | . | . | trans | -74.6 | 137.5 | 173.7 | 175.7 | 0 | 0 | 0 | 0 | 109.2 | F329 V357 N361 I367 A472 Q476 | F329-V363 HydrophobicContact CE2-CG2 4.32Å; V357-V363 HydrophobicContact CG1-CB 3.54Å; V357-V363 HydrophobicContact CG1-CG1 3.98Å; V357-V363 HydrophobicContact CG1-CG2 3.64Å; V357-V363 PolarHBondContact O-N 3.1Å; N361-V363 VanDerWaalsContact C-N 3.31Å; N361-V363 PolarHBondContact O-N 2.95Å; V363-I367 HydrophobicContact CG1-CB 4.16Å; V363-I367 HydrophobicContact CG1-CG2 4.16Å; V363-A472 HydrophobicContact CG1-CB 4.44Å; V363-Q476 HydrophobicContact CG1-CB 4.34Å; V363-Q476 HydrophobicContact CG2-CB 4.49Å | ||
| 364 | S | 87.2 | Confident | 81.6 | Confident | 45 Ų | 45 | 53.6 Ų | 53.6 | 32% | 0.315 | 27% | 0.266 | S | S | . | . | trans | -62.8 | 141.2 | -179.8 | 64.1 | 0 | 0 | 0 | 0 | 111.7 | H366 I367 S368 Q476 | S364-H366 PolarHBondContact O-N 3.05Å; S364-H366 VanDerWaalsContact O-N 3.15Å; S364-I367 PolarHBondContact O-N 3.17Å; S364-I367 WeakPolarHBondContact OG-CD1 3.39Å; S364-I367 VanDerWaalsContact OG-CG1 3.31Å; S364-I367 WeakPolarHBondContact OG-CG1 3.32Å; S364-S368 PolarHBondContact O-N 3.36Å; S364-S368 PolarHBondContact O-OG 3.49Å; S364-Q476 VanDerWaalsContact CB-OE1 3.23Å; S364-Q476 PolarHBondContact OG-OE1 3.35Å | ||
| 365 | K | 75.7 | Confident | 81.9 | Confident | 125 Ų | 125 | 52 Ų | 52 | 54% | 0.543 | 26% | 0.258 | S | S | . | . | H | α-helix | trans | -56.4 | -33.2 | 180 | -62.3 | -169.5 | 172.4 | 173.8 | 0 | 113 | E358 S368 R369 | E358-K365 HydrophobicContact CG-CG 4.18Å; E358-K365 WeakPolarHBondContact OE2-CE 3.19Å; K365-S368 WeakPolarHBondContact CA-OG 3.27Å; K365-S368 PolarHBondContact O-OG 2.92Å; K365-R369 WeakPolarHBondContact O-CB 3.48Å; K365-R369 WeakPolarHBondContact O-CD 3.46Å; K365-R369 WeakPolarHBondContact O-CG 3.47Å; K365-R369 PolarHBondContact O-N 3.39Å |
| 366 | H | 74.4 | Confident | 82.1 | Confident | 143 Ų | 143 | 47 Ų | 47 | 66% | 0.662 | 24% | 0.237 | S | C | * | . | H | α-helix | trans | -63.2 | -43.5 | 177.7 | 178.5 | -92.1 | 0 | 0 | 0 | 111.4 | S364 F370 | S364-H366 PolarHBondContact O-N 3.05Å; S364-H366 VanDerWaalsContact O-N 3.15Å; H366-F370 VanDerWaalsContact O-CB 3.24Å; H366-F370 WeakPolarHBondContact O-CB 3.35Å; H366-F370 PolarHBondContact O-N 3.3Å |
| 367 | I | 81.6 | Confident | 81.7 | Confident | 3 Ų | 3 | 49.1 Ų | 49.1 | 2% | 0.015 | 25% | 0.25 | C | C | . | . | H | α-helix | trans | -75.5 | -47.2 | -179.7 | -63.2 | 179.3 | 0 | 0 | 0 | 111 | L121 V363 S364 R369 F370 I371 L475 Q476 V479 | L121-I367 HydrophobicContact CD2-CG1 4.46Å; V363-I367 HydrophobicContact CG1-CB 4.16Å; V363-I367 HydrophobicContact CG1-CG2 4.16Å; S364-I367 PolarHBondContact O-N 3.17Å; S364-I367 WeakPolarHBondContact OG-CD1 3.39Å; S364-I367 VanDerWaalsContact OG-CG1 3.31Å; S364-I367 WeakPolarHBondContact OG-CG1 3.32Å; I367-R369 VanDerWaalsContact C-N 3.34Å; I367-R369 PolarHBondContact O-N 3.4Å; I367-F370 PolarHBondContact O-N 2.73Å; I367-I371 HydrophobicContact CG2-CG1 4.17Å; I367-I371 WeakPolarHBondContact O-CB 2.99Å; I367-I371 WeakPolarHBondContact O-CG1 3.46Å; I367-I371 PolarHBondContact O-N 3.49Å; I367-L475 HydrophobicContact CG2-CB 4.22Å; I367-L475 HydrophobicContact CG2-CD2 4.27Å; I367-Q476 HydrophobicContact CD1-CB 4.12Å; I367-V479 HydrophobicContact CD1-CB 4.24Å; I367-V479 HydrophobicContact CD1-CG2 3.71Å |
| 368 | S | 76.7 | Confident | 81.2 | Confident | 0 Ų | 0 | 49.4 Ų | 49.4 | 0% | 0 | 25% | 0.251 | C | S | . | . | H | α-helix | trans | -60.5 | -42.6 | -179.2 | 59 | 0 | 0 | 0 | 0 | 112.2 | E358 S364 K365 F370 L372 | E358-S368 VanDerWaalsContact CG-OG 3.29Å; E358-S368 WeakPolarHBondContact CG-OG 3.35Å; E358-S368 PolarHBondContact OE1-OG 3.49Å; S364-S368 PolarHBondContact O-N 3.36Å; S364-S368 PolarHBondContact O-OG 3.49Å; K365-S368 WeakPolarHBondContact CA-OG 3.27Å; K365-S368 PolarHBondContact O-OG 2.92Å; S368-F370 VanDerWaalsContact C-N 3.29Å; S368-F370 PolarHBondContact O-N 2.77Å; S368-L372 VanDerWaalsContact O-CB 3.31Å; S368-L372 WeakPolarHBondContact O-CB 3.4Å; S368-L372 WeakPolarHBondContact O-CG 3.19Å; S368-L372 PolarHBondContact O-N 3.22Å; S368-L372 VanDerWaalsContact O-N 3.16Å |
| 369 | R | 75.1 | Confident | 81.3 | Confident | 145 Ų | 145 | 47.9 Ų | 47.9 | 55% | 0.547 | 24% | 0.244 | S | C | . | . | H | α-helix | trans | -75.6 | -18.2 | -178.4 | -64.8 | 171.2 | -178.1 | -154.5 | -7 | 114.2 | M354 E358 K365 I367 P373 | M354-R369 VanDerWaalsContact CE-CA 3.46Å; M354-R369 HydrophobicContact CE-CB 3.89Å; M354-R369 HydrophobicContact CE-CG 3.54Å; E358-R369 IonicContact OE1-NE 3.99Å; E358-R369 PolarHBondContact OE1-NE 3.47Å; E358-R369 IonicContact OE2-NH2 3.7Å; K365-R369 WeakPolarHBondContact O-CB 3.48Å; K365-R369 WeakPolarHBondContact O-CD 3.46Å; K365-R369 WeakPolarHBondContact O-CG 3.47Å; K365-R369 PolarHBondContact O-N 3.39Å; I367-R369 VanDerWaalsContact C-N 3.34Å; I367-R369 PolarHBondContact O-N 3.4Å; R369-P373 WeakPolarHBondContact O-CD 3.3Å; R369-P373 WeakPolarHBondContact O-CG 3.45Å |
| 370 | F | 74.4 | Confident | 81.4 | Confident | 59 Ų | 59 | 41.6 Ų | 41.6 | 26% | 0.259 | 22% | 0.215 | S | C | . | . | H | α-helix | trans | -88.8 | -50.2 | 175 | -176.2 | -111.3 | 0 | 0 | 0 | 111.3 | L118 H366 I367 S368 I374 | L118-F370 HydrophobicContact CD1-CZ 3.79Å; L118-F370 HydrophobicContact CG-CZ 4.33Å; H366-F370 VanDerWaalsContact O-CB 3.24Å; H366-F370 WeakPolarHBondContact O-CB 3.35Å; H366-F370 PolarHBondContact O-N 3.3Å; I367-F370 PolarHBondContact O-N 2.73Å; S368-F370 VanDerWaalsContact C-N 3.29Å; S368-F370 PolarHBondContact O-N 2.77Å; F370-I374 HydrophobicContact CD2-CD1 4.38Å; F370-I374 HydrophobicContact CE1-CD1 4.39Å; F370-I374 HydrophobicContact CE2-CD1 4.13Å; F370-I374 HydrophobicContact CZ-CD1 4.15Å; F370-I374 VanDerWaalsContact O-CD1 3.29Å; F370-I374 WeakPolarHBondContact O-CD1 3.34Å; F370-I374 WeakPolarHBondContact O-CG1 3.41Å |
| 371 | I | 83 | Confident | 81.7 | Confident | 2 Ų | 2 | 36.2 Ų | 36.2 | 1% | 0.01 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -82.1 | -44.1 | -169.3 | -63.1 | -58.5 | 0 | 0 | 0 | 113.3 | A125 F129 I367 I374 G375 A472 L475 | A125-I371 HydrophobicContact CB-CD1 3.43Å; A125-I371 VanDerWaalsContact CB-CD1 3.43Å; F129-I371 HydrophobicContact CE2-CG2 4.45Å; F129-I371 HydrophobicContact CZ-CG2 3.69Å; I367-I371 HydrophobicContact CG2-CG1 4.17Å; I367-I371 WeakPolarHBondContact O-CB 2.99Å; I367-I371 WeakPolarHBondContact O-CG1 3.46Å; I367-I371 PolarHBondContact O-N 3.49Å; I371-I374 PolarHBondContact O-N 3.4Å; I371-G375 PolarHBondContact O-N 3.32Å; I371-A472 HydrophobicContact CG2-CB 4.47Å; I371-L475 HydrophobicContact CD1-CD2 3.53Å; I371-L475 HydrophobicContact CG1-CD2 3.51Å |
| 372 | L | 81.3 | Confident | 81.9 | Confident | 1 Ų | 1 | 34.5 Ų | 34.5 | 1% | 0.005 | 18% | 0.183 | C | C | . | . | H | α-helix | trans | -64 | -40.7 | -173.3 | -61.3 | 173.5 | 0 | 0 | 0 | 112.9 | L350 M353 M354 V357 S368 I374 G375 A376 D468 A472 | L350-L372 HydrophobicContact CD1-CB 3.61Å; L350-L372 WeakPolarHBondContact CD1-O 3.25Å; M353-L372 HydrophobicContact CG-CD1 4.26Å; M353-L372 HydrophobicContact CG-CD2 4.41Å; M354-L372 HydrophobicContact CB-CD1 4.25Å; M354-L372 HydrophobicContact CG-CB 4.31Å; M354-L372 HydrophobicContact CG-CD1 3.73Å; V357-L372 HydrophobicContact CB-CD1 4.28Å; V357-L372 HydrophobicContact CG1-CD1 4.39Å; V357-L372 HydrophobicContact CG2-CD1 4.31Å; S368-L372 VanDerWaalsContact O-CB 3.31Å; S368-L372 WeakPolarHBondContact O-CB 3.4Å; S368-L372 WeakPolarHBondContact O-CG 3.19Å; S368-L372 PolarHBondContact O-N 3.22Å; S368-L372 VanDerWaalsContact O-N 3.16Å; L372-I374 VanDerWaalsContact C-N 3.34Å; L372-I374 PolarHBondContact O-N 3.39Å; L372-G375 PolarHBondContact O-N 2.98Å; L372-A376 WeakPolarHBondContact O-CB 3.3Å; L372-A376 PolarHBondContact O-N 3.21Å; L372-D468 HydrophobicContact CD2-CB 3.81Å; L372-D468 WeakPolarHBondContact CD2-O 3.14Å; L372-A472 HydrophobicContact CD2-CB 4.02Å; L372-A472 HydrophobicContact CG-CB 4.37Å |
| 373 | P | 76.4 | Confident | 82 | Confident | 47 Ų | 47 | 32 Ų | 32 | 31% | 0.305 | 16% | 0.156 | S | C | . | . | H | α-helix | trans | -66.3 | -35 | 176 | -23 | 35.6 | 0 | 0 | 0 | 113.6 | L350 M354 R369 | L350-P373 HydrophobicContact CD1-CG 4.34Å; L350-P373 HydrophobicContact CD2-CB 3.98Å; L350-P373 HydrophobicContact CD2-CG 4.11Å; M354-P373 HydrophobicContact CE-CG 4.07Å; R369-P373 WeakPolarHBondContact O-CD 3.3Å; R369-P373 WeakPolarHBondContact O-CG 3.45Å |
| 374 | I | 79.1 | Confident | 82.1 | Confident | 24 Ų | 24 | 31.6 Ų | 31.6 | 12% | 0.123 | 15% | 0.154 | C | C | . | . | H | α-helix | trans | -71 | -42.5 | 175.8 | -63.1 | 173.6 | 0 | 0 | 0 | 110 | M126 F370 I371 L372 A376 T377 V378 | M126-I374 HydrophobicContact SD-CG2 4.5Å; F370-I374 HydrophobicContact CD2-CD1 4.38Å; F370-I374 HydrophobicContact CE1-CD1 4.39Å; F370-I374 HydrophobicContact CE2-CD1 4.13Å; F370-I374 HydrophobicContact CZ-CD1 4.15Å; F370-I374 VanDerWaalsContact O-CD1 3.29Å; F370-I374 WeakPolarHBondContact O-CD1 3.34Å; F370-I374 WeakPolarHBondContact O-CG1 3.41Å; I371-I374 PolarHBondContact O-N 3.4Å; L372-I374 VanDerWaalsContact C-N 3.34Å; L372-I374 PolarHBondContact O-N 3.39Å; I374-A376 VanDerWaalsContact C-N 3.33Å; I374-A376 PolarHBondContact O-N 3.25Å; I374-T377 PolarHBondContact O-N 2.95Å; I374-T377 PolarHBondContact O-OG1 3.18Å; I374-V378 HydrophobicContact CG2-CB 4.46Å; I374-V378 HydrophobicContact CG2-CG2 3.94Å; I374-V378 WeakPolarHBondContact O-CB 3.16Å; I374-V378 WeakPolarHBondContact O-CG2 3.23Å; I374-V378 PolarHBondContact O-N 3.48Å |
| 375 | G | 81.4 | Confident | 82.5 | Confident | 0 Ų | 0 | 29.5 Ų | 29.5 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -60.1 | -42 | 177.2 | 0 | 0 | 0 | 0 | 0 | 112.4 | I371 L372 T377 V378 N379 D468 | I371-G375 PolarHBondContact O-N 3.32Å; L372-G375 PolarHBondContact O-N 2.98Å; G375-T377 PolarHBondContact O-N 3.05Å; G375-V378 PolarHBondContact O-N 2.98Å; G375-N379 PolarHBondContact O-N 3.17Å; G375-D468 VanDerWaalsContact C-CG 3.45Å; G375-D468 VanDerWaalsContact C-OD1 3.26Å; G375-D468 VanDerWaalsContact CA-OD1 3.22Å; G375-D468 WeakPolarHBondContact CA-OD1 3.2Å |
| 376 | A | 76.3 | Confident | 83.4 | Confident | 5 Ų | 5 | 23.6 Ų | 23.6 | 4% | 0.041 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -60.3 | -13.9 | -179.6 | 0 | 0 | 0 | 0 | 0 | 114.7 | L372 I374 M380 D468 | L372-A376 WeakPolarHBondContact O-CB 3.3Å; L372-A376 PolarHBondContact O-N 3.21Å; I374-A376 VanDerWaalsContact C-N 3.33Å; I374-A376 PolarHBondContact O-N 3.25Å; A376-M380 WeakPolarHBondContact O-CE 3.45Å; A376-D468 PolarHBondContact N-OD2 2.83Å; A376-D468 VanDerWaalsContact N-OD2 3.15Å |
| 377 | T | 72.2 | Confident | 84.2 | Confident | 51 Ų | 51 | 16.8 Ų | 16.8 | 31% | 0.313 | 8% | 0.082 | S | C | . | . | H | α-helix | trans | -112.1 | -40.2 | 172.7 | 57 | 0 | 0 | 0 | 0 | 112.6 | I374 G375 V419 | I374-T377 PolarHBondContact O-N 2.95Å; I374-T377 PolarHBondContact O-OG1 3.18Å; G375-T377 PolarHBondContact O-N 3.05Å; T377-V419 VanDerWaalsContact O-O 3.06Å |
| 378 | V | 79.8 | Confident | 84.9 | Confident | 5 Ų | 5 | 16.6 Ų | 16.6 | 3% | 0.03 | 8% | 0.081 | C | C | . | . | H | α-helix | trans | -87.8 | -41.4 | -172.3 | 176.5 | 0 | 0 | 0 | 0 | 112.7 | M126 F129 I374 G375 M380 V419 | M126-V378 HydrophobicContact CE-CG1 3.8Å; M126-V378 HydrophobicContact SD-CG1 4.32Å; F129-V378 HydrophobicContact CD2-CG1 4.37Å; I374-V378 HydrophobicContact CG2-CB 4.46Å; I374-V378 HydrophobicContact CG2-CG2 3.94Å; I374-V378 WeakPolarHBondContact O-CB 3.16Å; I374-V378 WeakPolarHBondContact O-CG2 3.23Å; I374-V378 PolarHBondContact O-N 3.48Å; G375-V378 PolarHBondContact O-N 2.98Å; V378-M380 PolarHBondContact O-N 3.4Å; V378-V419 HydrophobicContact CB-CG1 4.4Å; V378-V419 HydrophobicContact CG1-CG1 4.09Å; V378-V419 HydrophobicContact CG1-CG2 4.23Å; V378-V419 HydrophobicContact CG2-CG1 4.31Å |
| 379 | N | 88.8 | Confident | 85.8 | Confident | 0 Ų | 0 | 16.6 Ų | 16.6 | 0% | 0 | 8% | 0.081 | C | C | . | . | trans | -99 | 88.1 | -169.1 | -178.8 | 59.1 | 0 | 0 | 0 | 110.7 | F129 T132 G375 D381 D468 | F129-N379 HydrophobicContact CB-CB 3.98Å; F129-N379 HydrophobicContact CD1-CB 3.47Å; F129-N379 VanDerWaalsContact CD1-CB 3.47Å; F129-N379 WeakPolarHBondContact CD1-OD1 3.37Å; F129-N379 HydrophobicContact CD2-CB 4.02Å; F129-N379 HydrophobicContact CE1-CB 3.81Å; F129-N379 HydrophobicContact CE2-CB 4.31Å; F129-N379 HydrophobicContact CG-CB 3.59Å; F129-N379 HydrophobicContact CZ-CB 4.2Å; T132-N379 PolarHBondContact OG1-OD1 3.27Å; G375-N379 PolarHBondContact O-N 3.17Å; N379-D381 PolarHBondContact OD1-OD1 3.44Å; N379-D468 VanDerWaalsContact CB-OD1 3.32Å; N379-D468 WeakPolarHBondContact CB-OD1 3.36Å; N379-D468 PolarHBondContact ND2-N 2.81Å; N379-D468 PolarHBondContact ND2-OD1 2.96Å | ||
| 380 | M | 90.3 | Very high | 86.6 | Confident | 4 Ų | 4 | 9.7 Ų | 9.7 | 2% | 0.02 | 6% | 0.055 | C | C | . | . | trans | -116.4 | 60.4 | -178.5 | -59.5 | -152.2 | 177 | 0 | 0 | 112.8 | A376 V378 G382 A383 A384 S418 A421 N464 | A376-M380 WeakPolarHBondContact O-CE 3.45Å; V378-M380 PolarHBondContact O-N 3.4Å; M380-G382 VanDerWaalsContact C-N 3.28Å; M380-G382 PolarHBondContact O-N 3.27Å; M380-A383 HydrophobicContact CB-CB 3.81Å; M380-A383 WeakPolarHBondContact O-CB 3.24Å; M380-A383 PolarHBondContact O-N 2.93Å; M380-A384 PolarHBondContact O-N 2.86Å; M380-S418 WeakPolarHBondContact CB-O 3.45Å; M380-S418 WeakPolarHBondContact CG-O 2.98Å; M380-A421 WeakPolarHBondContact CE-O 3.45Å; M380-A421 HydrophobicContact SD-CB 3.51Å; M380-A421 VanDerWaalsContact SD-CB 3.51Å; M380-N464 VanDerWaalsContact CA-OD1 3.32Å; M380-N464 WeakPolarHBondContact CA-OD1 3.45Å | ||
| 381 | D | 94.4 | Very high | 87.4 | Confident | 0 Ų | 0 | 6.9 Ų | 6.9 | 0% | 0 | 4% | 0.043 | C | C | . | . | H | α-helix | trans | -51.6 | -44 | 179.4 | -65.4 | -26.3 | 0 | 0 | 0 | 113.2 | T132 T133 A136 H309 N379 A384 L385 L463 N464 | T132-D381 VanDerWaalsContact C-OD1 3.3Å; T132-D381 PolarHBondContact OG1-OD1 2.92Å; T133-D381 WeakPolarHBondContact CA-OD1 3.37Å; T133-D381 WeakPolarHBondContact CB-OD1 3.41Å; T133-D381 PolarHBondContact N-OD1 3.24Å; T133-D381 PolarHBondContact OG1-OD1 3.15Å; A136-D381 HydrophobicContact CB-CB 3.97Å; A136-D381 WeakPolarHBondContact CB-O 3.5Å; H309-D381 IonicContact NE2-OD2 3.3Å; N379-D381 PolarHBondContact OD1-OD1 3.44Å; D381-A384 PolarHBondContact O-N 3.31Å; D381-L385 WeakPolarHBondContact O-CB 3.34Å; D381-L385 PolarHBondContact O-N 3.46Å; D381-L463 HydrophobicContact CB-CD2 3.65Å; D381-N464 PolarHBondContact N-OD1 3.42Å |
| 382 | G | 92.7 | Very high | 87.9 | Confident | 0 Ų | 0 | 6.9 Ų | 6.9 | 0% | 0 | 4% | 0.042 | C | C | . | . | H | α-helix | trans | -66.4 | -38 | 177.8 | 0 | 0 | 0 | 0 | 0 | 112.8 | H306 M380 F386 C460 N464 | H306-G382 PolarHBondContact NE2-O 3.5Å; M380-G382 VanDerWaalsContact C-N 3.28Å; M380-G382 PolarHBondContact O-N 3.27Å; G382-F386 VanDerWaalsContact O-CB 3.25Å; G382-F386 WeakPolarHBondContact O-CB 3.48Å; G382-F386 PolarHBondContact O-N 3.45Å; G382-C460 PolarHBondContact O-SG 3.41Å; G382-N464 VanDerWaalsContact CA-OD1 3.3Å; G382-N464 WeakPolarHBondContact CA-OD1 3.02Å; G382-N464 PolarHBondContact N-OD1 3.37Å |
| 383 | A | 90.6 | Very high | 88.4 | Confident | 5 Ų | 5 | 6.9 Ų | 6.9 | 4% | 0.041 | 4% | 0.042 | C | C | . | . | H | α-helix | trans | -67.8 | -44.1 | 176.2 | 0 | 0 | 0 | 0 | 0 | 111.2 | M380 F386 Q387 N464 | M380-A383 HydrophobicContact CB-CB 3.81Å; M380-A383 WeakPolarHBondContact O-CB 3.24Å; M380-A383 PolarHBondContact O-N 2.93Å; A383-F386 PolarHBondContact O-N 3.36Å; A383-Q387 VanDerWaalsContact O-CB 3.25Å; A383-Q387 WeakPolarHBondContact O-CB 3.32Å; A383-Q387 WeakPolarHBondContact O-CG 3.21Å; A383-Q387 PolarHBondContact O-N 3.38Å; A383-N464 PolarHBondContact N-OD1 3.39Å |
| 384 | A | 93.4 | Very high | 88.9 | Confident | 0 Ų | 0 | 4.6 Ų | 4.6 | 0% | 0 | 3% | 0.028 | C | C | . | . | H | α-helix | trans | -63.3 | -44 | 179.5 | 0 | 0 | 0 | 0 | 0 | 111.8 | T133 S137 M380 D381 Q387 C388 | T133-A384 HydrophobicContact CG2-CB 3.58Å; S137-A384 VanDerWaalsContact OG-CB 3.3Å; S137-A384 WeakPolarHBondContact OG-CB 3.49Å; M380-A384 PolarHBondContact O-N 2.86Å; D381-A384 PolarHBondContact O-N 3.31Å; A384-Q387 PolarHBondContact O-N 3.47Å; A384-C388 PolarHBondContact O-N 3.32Å; A384-C388 PolarHBondContact O-SG 3.38Å; A384-C388 VanDerWaalsContact O-SG 3.36Å |
| 385 | L | 95.8 | Very high | 89.3 | Confident | 0 Ų | 0 | 3.5 Ų | 3.5 | 0% | 0 | 2% | 0.022 | C | C | . | . | H | α-helix | trans | -61.1 | -51.2 | 175.2 | -168.7 | 156.3 | 0 | 0 | 0 | 111.3 | A136 I139 G305 H309 D381 Q387 C388 V389 | A136-L385 HydrophobicContact CB-CB 4.34Å; A136-L385 WeakPolarHBondContact O-CG 3.47Å; I139-L385 HydrophobicContact CB-CD1 4.37Å; I139-L385 HydrophobicContact CG2-CD1 4.1Å; G305-L385 WeakPolarHBondContact O-CD1 3.34Å; H309-L385 HydrophobicContact CB-CD1 4.1Å; D381-L385 WeakPolarHBondContact O-CB 3.34Å; D381-L385 PolarHBondContact O-N 3.46Å; L385-Q387 VanDerWaalsContact C-N 3.32Å; L385-Q387 PolarHBondContact O-N 3.39Å; L385-C388 PolarHBondContact O-N 3.29Å; L385-V389 HydrophobicContact CD2-CG2 3.94Å; L385-V389 WeakPolarHBondContact O-CG2 3.39Å; L385-V389 PolarHBondContact O-N 2.99Å |
| 386 | F | 93.9 | Very high | 89.7 | Confident | 1 Ų | 1 | 4.8 Ų | 4.8 | 0% | 0.004 | 3% | 0.028 | C | C | . | . | H | α-helix | trans | -55.3 | -46.9 | 177.6 | 154.7 | -95.4 | 0 | 0 | 0 | 111.9 | Y298 G382 A383 C388 V389 A390 V429 I449 V456 C460 | Y298-F386 VanDerWaalsContact OH-CD2 3.25Å; Y298-F386 WeakPolarHBondContact OH-CD2 3.36Å; Y298-F386 WeakPolarHBondContact OH-CE2 3.24Å; G382-F386 VanDerWaalsContact O-CB 3.25Å; G382-F386 WeakPolarHBondContact O-CB 3.48Å; G382-F386 PolarHBondContact O-N 3.45Å; A383-F386 PolarHBondContact O-N 3.36Å; F386-C388 PolarHBondContact O-N 2.98Å; F386-V389 PolarHBondContact O-N 2.91Å; F386-A390 VanDerWaalsContact O-CB 3.3Å; F386-A390 WeakPolarHBondContact O-CB 3.43Å; F386-A390 PolarHBondContact O-N 3.46Å; F386-V429 HydrophobicContact CE1-CG2 4.27Å; F386-V429 HydrophobicContact CZ-CG2 3.79Å; F386-I449 HydrophobicContact CE2-CG2 3.7Å; F386-I449 HydrophobicContact CZ-CG2 3.5Å; F386-V456 HydrophobicContact CD2-CG1 3.68Å; F386-V456 HydrophobicContact CE2-CG1 4.31Å; F386-C460 VanDerWaalsContact CB-SG 3.56Å |
| 387 | Q | 92.1 | Very high | 90 | Very high | 0 Ų | 0 | 5.8 Ų | 5.8 | 0% | 0 | 3% | 0.033 | C | C | . | . | H | α-helix | trans | -61 | -45 | -179.8 | -83.8 | 170.8 | -2.1 | 0 | 0 | 112 | A383 A384 L385 A390 A391 A414 G428 T431 I435 | A383-Q387 VanDerWaalsContact O-CB 3.25Å; A383-Q387 WeakPolarHBondContact O-CB 3.32Å; A383-Q387 WeakPolarHBondContact O-CG 3.21Å; A383-Q387 PolarHBondContact O-N 3.38Å; A384-Q387 PolarHBondContact O-N 3.47Å; L385-Q387 VanDerWaalsContact C-N 3.32Å; L385-Q387 PolarHBondContact O-N 3.39Å; Q387-A390 PolarHBondContact O-N 3.26Å; Q387-A391 WeakPolarHBondContact O-CB 3.4Å; Q387-A391 PolarHBondContact O-N 3.47Å; Q387-A414 HydrophobicContact CB-CB 4.28Å; Q387-A414 PolarHBondContact OE1-O 3.07Å; Q387-G428 PolarHBondContact NE2-O 3.39Å; Q387-T431 PolarHBondContact NE2-OG1 3.24Å; Q387-I435 HydrophobicContact CB-CD1 3.48Å; Q387-I435 VanDerWaalsContact CB-CD1 3.48Å; Q387-I435 HydrophobicContact CG-CD1 3.77Å |
| 388 | C | 94.5 | Very high | 90.4 | Very high | 0 Ų | 0 | 6.2 Ų | 6.2 | 0% | 0 | 3% | 0.033 | C | C | . | . | H | α-helix | trans | -61.5 | -45.5 | 175.7 | -73.3 | 0 | 0 | 0 | 0 | 112.1 | V141 A384 L385 F386 A390 V392 I410 A414 | V141-C388 HydrophobicContact CG2-CB 3.74Å; A384-C388 PolarHBondContact O-N 3.32Å; A384-C388 PolarHBondContact O-SG 3.38Å; A384-C388 VanDerWaalsContact O-SG 3.36Å; L385-C388 PolarHBondContact O-N 3.29Å; F386-C388 PolarHBondContact O-N 2.98Å; C388-A390 VanDerWaalsContact C-N 3.35Å; C388-V392 WeakPolarHBondContact O-CG2 3.17Å; C388-V392 PolarHBondContact O-N 3.07Å; C388-V392 VanDerWaalsContact O-N 3.12Å; C388-I410 HydrophobicContact CB-CG2 4.29Å; C388-A414 WeakPolarHBondContact SG-CB 3.49Å |
| 389 | V | 95.3 | Very high | 90.5 | Very high | 0 Ų | 0 | 11.5 Ų | 11.5 | 0% | 0 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -63.5 | -43.2 | 177.9 | 178.8 | 0 | 0 | 0 | 0 | 110.7 | G140 A144 Y298 C301 C302 L385 F386 V392 F393 | G140-V389 WeakPolarHBondContact O-CG2 3.14Å; A144-V389 HydrophobicContact CB-CG1 4.28Å; Y298-V389 HydrophobicContact CD2-CG1 3.94Å; Y298-V389 HydrophobicContact CE2-CG1 3.85Å; C301-V389 HydrophobicContact CB-CG1 4.16Å; C302-V389 VanDerWaalsContact SG-CG1 3.51Å; L385-V389 HydrophobicContact CD2-CG2 3.94Å; L385-V389 WeakPolarHBondContact O-CG2 3.39Å; L385-V389 PolarHBondContact O-N 2.99Å; F386-V389 PolarHBondContact O-N 2.91Å; V389-V392 PolarHBondContact O-N 3.42Å; V389-F393 WeakPolarHBondContact O-CB 3.46Å; V389-F393 PolarHBondContact O-N 2.98Å |
| 390 | A | 92.4 | Very high | 90 | Very high | 0 Ų | 0 | 14.3 Ų | 14.3 | 0% | 0 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -65.6 | -42.5 | 180 | 0 | 0 | 0 | 0 | 0 | 112.5 | Y298 F386 Q387 C388 F393 I394 L432 I449 | Y298-A390 HydrophobicContact CE2-CB 4.06Å; F386-A390 VanDerWaalsContact O-CB 3.3Å; F386-A390 WeakPolarHBondContact O-CB 3.43Å; F386-A390 PolarHBondContact O-N 3.46Å; Q387-A390 PolarHBondContact O-N 3.26Å; C388-A390 VanDerWaalsContact C-N 3.35Å; A390-F393 PolarHBondContact O-N 3.17Å; A390-I394 WeakPolarHBondContact O-CG1 3.2Å; A390-I394 PolarHBondContact O-N 3.05Å; A390-L432 HydrophobicContact CB-CD1 3.86Å; A390-L432 HydrophobicContact CB-CD2 3.55Å; A390-L432 HydrophobicContact CB-CG 4.37Å; A390-I449 HydrophobicContact CB-CD1 4.21Å; A390-I449 HydrophobicContact CB-CG1 4.39Å; A390-I449 HydrophobicContact CB-CG2 4.48Å |
| 391 | A | 91.3 | Very high | 89.4 | Confident | 0 Ų | 0 | 19.4 Ų | 19.4 | 0% | 0 | 12% | 0.115 | C | C | . | . | H | α-helix | trans | -62.3 | -46.1 | 176.9 | 0 | 0 | 0 | 0 | 0 | 111.8 | Q387 F393 I394 A395 I410 L432 I435 L436 | Q387-A391 WeakPolarHBondContact O-CB 3.4Å; Q387-A391 PolarHBondContact O-N 3.47Å; A391-F393 VanDerWaalsContact C-N 3.35Å; A391-I394 PolarHBondContact O-N 3.48Å; A391-A395 PolarHBondContact O-N 3.35Å; A391-I410 HydrophobicContact CB-CD1 4.28Å; A391-I410 HydrophobicContact CB-CG1 4.31Å; A391-I410 HydrophobicContact CB-CG2 4.21Å; A391-L432 HydrophobicContact CB-CD1 4.32Å; A391-I435 HydrophobicContact CB-CG2 3.87Å; A391-L436 HydrophobicContact CB-CD2 4.27Å |
| 392 | V | 93.1 | Very high | 88.9 | Confident | 1 Ų | 1 | 20.9 Ų | 20.9 | 1% | 0.006 | 12% | 0.122 | C | C | . | . | H | α-helix | trans | -66.7 | -38 | 177 | 176.1 | 0 | 0 | 0 | 0 | 111.3 | A144 F145 C388 V389 A395 Q396 L402 I410 | A144-V392 HydrophobicContact CB-CB 3.7Å; A144-V392 HydrophobicContact CB-CG1 3.56Å; A144-V392 HydrophobicContact CB-CG2 4.33Å; F145-V392 HydrophobicContact CE1-CG1 4.4Å; F145-V392 HydrophobicContact CE2-CG1 4.42Å; F145-V392 HydrophobicContact CE2-CG2 4.33Å; F145-V392 HydrophobicContact CZ-CG1 4.33Å; C388-V392 WeakPolarHBondContact O-CG2 3.17Å; C388-V392 PolarHBondContact O-N 3.07Å; C388-V392 VanDerWaalsContact O-N 3.12Å; V389-V392 PolarHBondContact O-N 3.42Å; V392-A395 PolarHBondContact O-N 2.84Å; V392-Q396 HydrophobicContact CG1-CG 4.46Å; V392-Q396 WeakPolarHBondContact O-CB 3.4Å; V392-Q396 VanDerWaalsContact O-CG 3.24Å; V392-Q396 WeakPolarHBondContact O-CG 3.35Å; V392-Q396 PolarHBondContact O-N 2.79Å; V392-L402 HydrophobicContact CB-CD1 4.31Å; V392-L402 HydrophobicContact CG1-CD1 4.35Å; V392-L402 HydrophobicContact CG2-CD1 3.89Å; V392-I410 HydrophobicContact CG2-CD1 4.47Å |
| 393 | F | 92.2 | Very high | 88.4 | Confident | 1 Ų | 1 | 23.8 Ų | 23.8 | 0% | 0.004 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -62 | -46.8 | 175.4 | 170.9 | -105.8 | 0 | 0 | 0 | 112.4 | P149 S294 L295 Y298 V389 A390 A391 A395 Q396 L397 I449 | P149-F393 HydrophobicContact CB-CD2 3.77Å; P149-F393 HydrophobicContact CB-CE2 4.23Å; P149-F393 HydrophobicContact CG-CB 4.28Å; P149-F393 HydrophobicContact CG-CD2 3.85Å; S294-F393 VanDerWaalsContact OG-CE2 3.3Å; S294-F393 WeakPolarHBondContact OG-CE2 3.21Å; L295-F393 HydrophobicContact CD2-CE1 4.24Å; L295-F393 HydrophobicContact CD2-CZ 4.02Å; Y298-F393 HydrophobicContact CD2-CB 3.85Å; Y298-F393 AromaticContact CD2-CD1 3.97Å; Y298-F393 HydrophobicContact CD2-CD1 3.97Å; Y298-F393 HydrophobicContact CD2-CD2 4.15Å; Y298-F393 AromaticContact CD2-CG 3.73Å; Y298-F393 HydrophobicContact CD2-CG 3.73Å; Y298-F393 HydrophobicContact CE2-CB 4.36Å; Y298-F393 HydrophobicContact CE2-CD1 4.49Å; Y298-F393 HydrophobicContact CE2-CG 4.49Å; Y298-F393 HydrophobicContact CG-CD1 4.27Å; Y298-F393 HydrophobicContact CG-CD2 4.32Å; Y298-F393 HydrophobicContact CG-CE1 4.36Å; Y298-F393 HydrophobicContact CG-CE2 4.42Å; Y298-F393 HydrophobicContact CG-CG 4.21Å; Y298-F393 HydrophobicContact CG-CZ 4.43Å; V389-F393 WeakPolarHBondContact O-CB 3.46Å; V389-F393 PolarHBondContact O-N 2.98Å; A390-F393 PolarHBondContact O-N 3.17Å; A391-F393 VanDerWaalsContact C-N 3.35Å; F393-A395 VanDerWaalsContact C-N 3.33Å; F393-A395 PolarHBondContact O-N 2.9Å; F393-Q396 PolarHBondContact O-N 3.27Å; F393-L397 HydrophobicContact CD1-CD1 3.89Å; F393-L397 HydrophobicContact CD1-CG 4.39Å; F393-L397 HydrophobicContact CD2-CG 4.39Å; F393-L397 HydrophobicContact CE1-CD1 3.29Å; F393-L397 HydrophobicContact CE1-CG 4.05Å; F393-L397 HydrophobicContact CE2-CD1 4.13Å; F393-L397 HydrophobicContact CE2-CD2 4.19Å; F393-L397 HydrophobicContact CE2-CG 4.04Å; F393-L397 HydrophobicContact CZ-CD1 3.45Å; F393-L397 VanDerWaalsContact CZ-CD1 3.45Å; F393-L397 HydrophobicContact CZ-CD2 4.11Å; F393-L397 HydrophobicContact CZ-CG 3.87Å; F393-L397 WeakPolarHBondContact O-CG 3.12Å; F393-L397 PolarHBondContact O-N 2.99Å; F393-I449 HydrophobicContact CD1-CD1 3.67Å; F393-I449 HydrophobicContact CE1-CD1 3.85Å |
| 394 | I | 87.8 | Confident | 88 | Confident | 0 Ų | 0 | 30.7 Ų | 30.7 | 0% | 0 | 17% | 0.167 | C | C | . | . | H | α-helix | trans | -64.3 | -38.9 | 177.7 | -69.9 | 170.1 | 0 | 0 | 0 | 111 | A390 A391 Q396 L397 N398 L432 L436 L441 D445 I449 | A390-I394 WeakPolarHBondContact O-CG1 3.2Å; A390-I394 PolarHBondContact O-N 3.05Å; A391-I394 PolarHBondContact O-N 3.48Å; I394-Q396 VanDerWaalsContact C-N 3.34Å; I394-Q396 PolarHBondContact O-N 3.17Å; I394-L397 PolarHBondContact O-N 3.05Å; I394-N398 PolarHBondContact O-N 3.16Å; I394-N398 VanDerWaalsContact O-N 3.09Å; I394-N398 PolarHBondContact O-ND2 2.66Å; I394-L432 HydrophobicContact CD1-CD2 4.32Å; I394-L436 HydrophobicContact CB-CD2 4.2Å; I394-L436 HydrophobicContact CD1-CD1 3.61Å; I394-L436 HydrophobicContact CD1-CD2 4.03Å; I394-L436 HydrophobicContact CD1-CG 4.43Å; I394-L436 HydrophobicContact CG2-CD2 4.12Å; I394-L441 HydrophobicContact CG2-CD1 4.41Å; I394-D445 HydrophobicContact CD1-CB 4.36Å; I394-D445 HydrophobicContact CG1-CB 4.21Å; I394-D445 HydrophobicContact CG2-CB 4.05Å; I394-I449 HydrophobicContact CD1-CG1 4Å; I394-I449 HydrophobicContact CG1-CG1 4.47Å |
| 395 | A | 88.1 | Confident | 87.2 | Confident | 1 Ų | 1 | 32.2 Ų | 32.2 | 1% | 0.008 | 18% | 0.175 | C | C | . | . | H | α-helix | trans | -60.3 | -44.9 | 174.1 | 0 | 0 | 0 | 0 | 0 | 111.8 | A391 V392 F393 N398 N399 T400 L402 L441 | A391-A395 PolarHBondContact O-N 3.35Å; V392-A395 PolarHBondContact O-N 2.84Å; F393-A395 VanDerWaalsContact C-N 3.33Å; F393-A395 PolarHBondContact O-N 2.9Å; A395-N398 PolarHBondContact O-N 3.02Å; A395-N399 PolarHBondContact O-N 2.94Å; A395-T400 PolarHBondContact O-N 2.98Å; A395-L402 HydrophobicContact CB-CD1 3.7Å; A395-L402 HydrophobicContact CB-CD2 3.73Å; A395-L402 HydrophobicContact CB-CG 3.6Å; A395-L441 HydrophobicContact CB-CD1 3.69Å |
| 396 | Q | 88.8 | Confident | 86.5 | Confident | 27 Ų | 27 | 34.3 Ų | 34.3 | 13% | 0.126 | 19% | 0.185 | C | C | . | . | H | α-helix | trans | -65.1 | -41.6 | 177.4 | -71.7 | 171.6 | 6.4 | 0 | 0 | 112.1 | A144 P149 V392 F393 I394 N398 N399 | A144-Q396 PolarHBondContact O-NE2 2.98Å; A144-Q396 VanDerWaalsContact O-NE2 3.1Å; P149-Q396 VanDerWaalsContact CD-OE1 3.29Å; V392-Q396 HydrophobicContact CG1-CG 4.46Å; V392-Q396 WeakPolarHBondContact O-CB 3.4Å; V392-Q396 VanDerWaalsContact O-CG 3.24Å; V392-Q396 WeakPolarHBondContact O-CG 3.35Å; V392-Q396 PolarHBondContact O-N 2.79Å; F393-Q396 PolarHBondContact O-N 3.27Å; I394-Q396 VanDerWaalsContact C-N 3.34Å; I394-Q396 PolarHBondContact O-N 3.17Å; Q396-N398 VanDerWaalsContact C-N 3.27Å; Q396-N398 PolarHBondContact O-N 3.2Å; Q396-N399 PolarHBondContact O-N 3.1Å; Q396-N399 VanDerWaalsContact O-N 3.12Å |
| 397 | L | 83.2 | Confident | 86.2 | Confident | 25 Ų | 25 | 35.5 Ų | 35.5 | 13% | 0.131 | 19% | 0.192 | C | C | . | . | H | α-helix | trans | -60.1 | -37.8 | 176.4 | -78.8 | -178.4 | 0 | 0 | 0 | 112.5 | M154 F393 I394 N399 L448 | M154-L397 HydrophobicContact CE-CD2 3.96Å; F393-L397 HydrophobicContact CD1-CD1 3.89Å; F393-L397 HydrophobicContact CD1-CG 4.39Å; F393-L397 HydrophobicContact CD2-CG 4.39Å; F393-L397 HydrophobicContact CE1-CD1 3.29Å; F393-L397 HydrophobicContact CE1-CG 4.05Å; F393-L397 HydrophobicContact CE2-CD1 4.13Å; F393-L397 HydrophobicContact CE2-CD2 4.19Å; F393-L397 HydrophobicContact CE2-CG 4.04Å; F393-L397 HydrophobicContact CZ-CD1 3.45Å; F393-L397 VanDerWaalsContact CZ-CD1 3.45Å; F393-L397 HydrophobicContact CZ-CD2 4.11Å; F393-L397 HydrophobicContact CZ-CG 3.87Å; F393-L397 WeakPolarHBondContact O-CG 3.12Å; F393-L397 PolarHBondContact O-N 2.99Å; I394-L397 PolarHBondContact O-N 3.05Å; L397-N399 VanDerWaalsContact C-N 3.25Å; L397-N399 PolarHBondContact O-N 2.66Å; L397-L448 HydrophobicContact CD1-CD1 4.04Å |
| 398 | N | 80.6 | Confident | 85.9 | Confident | 60 Ų | 60 | 39.2 Ų | 39.2 | 32% | 0.321 | 21% | 0.211 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -86.6 | 11.4 | 178.7 | -72.3 | -63.4 | 0 | 0 | 0 | 113.5 | I394 A395 Q396 T400 D445 | I394-N398 PolarHBondContact O-N 3.16Å; I394-N398 VanDerWaalsContact O-N 3.09Å; I394-N398 PolarHBondContact O-ND2 2.66Å; A395-N398 PolarHBondContact O-N 3.02Å; Q396-N398 VanDerWaalsContact C-N 3.27Å; Q396-N398 PolarHBondContact O-N 3.2Å; N398-T400 PolarHBondContact O-N 3.22Å; N398-T400 PolarHBondContact O-OG1 3.47Å; N398-D445 PolarHBondContact ND2-OD2 3.2Å; N398-D445 PolarHBondContact OD1-OD2 2.87Å |
| 399 | N | 80.4 | Confident | 85.1 | Confident | 117 Ų | 117 | 39.6 Ų | 39.6 | 63% | 0.626 | 21% | 0.213 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 50.4 | 28.5 | -175.3 | -63.8 | -55.5 | 0 | 0 | 0 | 113.6 | A395 Q396 L397 | A395-N399 PolarHBondContact O-N 2.94Å; Q396-N399 PolarHBondContact O-N 3.1Å; Q396-N399 VanDerWaalsContact O-N 3.12Å; L397-N399 VanDerWaalsContact C-N 3.25Å; L397-N399 PolarHBondContact O-N 2.66Å |
| 400 | T | 78.8 | Confident | 84.8 | Confident | 59 Ų | 59 | 39.6 Ų | 39.6 | 36% | 0.362 | 21% | 0.213 | S | C | . | . | P | Polyproline II helix | trans | -93 | 116.7 | -179.4 | -58.6 | 0 | 0 | 0 | 0 | 108.9 | A395 N398 L402 L441 | A395-T400 PolarHBondContact O-N 2.98Å; N398-T400 PolarHBondContact O-N 3.22Å; N398-T400 PolarHBondContact O-OG1 3.47Å; T400-L402 PolarHBondContact O-N 3.32Å; T400-L441 HydrophobicContact CG2-CD2 3.93Å |
| 401 | S | 79.1 | Confident | 84.6 | Confident | 111 Ų | 111 | 41.2 Ų | 41.2 | 78% | 0.776 | 22% | 0.222 | S | C | * | . | P | Polyproline II helix | trans | -72.2 | 119.6 | 176.6 | 58.8 | 0 | 0 | 0 | 0 | 110.4 | ||
| 402 | L | 82.3 | Confident | 84.3 | Confident | 30 Ų | 30 | 45.1 Ų | 45.1 | 16% | 0.157 | 25% | 0.245 | C | C | . | . | P | Polyproline II helix | trans | -76.6 | 124.7 | 173.7 | -66.7 | 174.3 | 0 | 0 | 0 | 110.7 | F145 V392 A395 T400 Q406 V407 I410 I439 | F145-L402 HydrophobicContact CZ-CB 4.33Å; F145-L402 HydrophobicContact CZ-CD1 4.17Å; V392-L402 HydrophobicContact CB-CD1 4.31Å; V392-L402 HydrophobicContact CG1-CD1 4.35Å; V392-L402 HydrophobicContact CG2-CD1 3.89Å; A395-L402 HydrophobicContact CB-CD1 3.7Å; A395-L402 HydrophobicContact CB-CD2 3.73Å; A395-L402 HydrophobicContact CB-CG 3.6Å; T400-L402 PolarHBondContact O-N 3.32Å; L402-Q406 HydrophobicContact CD2-CB 4.23Å; L402-V407 HydrophobicContact CB-CG2 4.17Å; L402-I410 HydrophobicContact CD1-CD1 3.86Å; L402-I410 HydrophobicContact CD2-CD1 4.22Å; L402-I439 HydrophobicContact CD2-CD1 4.3Å |
| 403 | N | 82.6 | Confident | 83.6 | Confident | 62 Ų | 62 | 45.3 Ų | 45.3 | 33% | 0.332 | 25% | 0.247 | S | C | . | . | P | Polyproline II helix | trans | -77.1 | 157.7 | 171 | -170 | -0.2 | 0 | 0 | 0 | 111 | V173 I405 Q406 V407 | V173-N403 WeakPolarHBondContact CG2-ND2 3.31Å; N403-I405 PolarHBondContact O-N 2.99Å; N403-Q406 HydrophobicContact CB-CG 4.49Å; N403-Q406 WeakPolarHBondContact O-CB 3.24Å; N403-Q406 PolarHBondContact O-N 3.41Å; N403-V407 WeakPolarHBondContact O-CG2 3.26Å; N403-V407 PolarHBondContact O-N 3.48Å |
| 404 | F | 82.9 | Confident | 83.4 | Confident | 150 Ų | 150 | 45.2 Ų | 45.2 | 66% | 0.658 | 25% | 0.246 | S | C | * | . | H | α-helix | trans | -50.7 | -41.1 | 175.5 | -178.9 | -107.2 | 0 | 0 | 0 | 112.9 | V407 I408 | F404-V407 WeakPolarHBondContact O-CB 3.28Å; F404-V407 PolarHBondContact O-N 3.31Å; F404-I408 HydrophobicContact CD1-CD1 3.9Å; F404-I408 HydrophobicContact CE1-CD1 3.34Å; F404-I408 HydrophobicContact CE1-CG1 4.35Å; F404-I408 HydrophobicContact CE2-CD1 4.38Å; F404-I408 HydrophobicContact CZ-CD1 3.62Å; F404-I408 HydrophobicContact CZ-CG1 4.34Å; F404-I408 PolarHBondContact O-N 3.32Å |
| 405 | I | 77.1 | Confident | 83.4 | Confident | 31 Ų | 31 | 45.9 Ų | 45.9 | 16% | 0.159 | 25% | 0.25 | C | S | . | . | H | α-helix | trans | -66.6 | -42.9 | 176.6 | -62 | -159.6 | 0 | 0 | 0 | 111.5 | V173 F177 N403 V407 I408 T409 | V173-I405 HydrophobicContact CB-CD1 4.5Å; V173-I405 HydrophobicContact CG1-CB 4.42Å; V173-I405 HydrophobicContact CG1-CD1 3.21Å; V173-I405 HydrophobicContact CG1-CG1 3.59Å; F177-I405 HydrophobicContact CB-CD1 3.92Å; F177-I405 HydrophobicContact CB-CG2 4.42Å; F177-I405 HydrophobicContact CD2-CD1 4.42Å; F177-I405 HydrophobicContact CD2-CG2 4.41Å; F177-I405 HydrophobicContact CG-CD1 4.47Å; N403-I405 PolarHBondContact O-N 2.99Å; I405-V407 PolarHBondContact O-N 3.5Å; I405-I408 PolarHBondContact O-N 3.39Å; I405-I408 VanDerWaalsContact O-N 3.17Å; I405-T409 PolarHBondContact O-N 3.43Å; I405-T409 PolarHBondContact O-OG1 3.1Å |
| 406 | Q | 79.7 | Confident | 82.9 | Confident | 45 Ų | 45 | 47.2 Ų | 47.2 | 21% | 0.21 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -62.4 | -34.8 | 176.3 | -69.8 | 171.1 | -51.4 | 0 | 0 | 111.3 | L402 N403 T409 I410 I439 | L402-Q406 HydrophobicContact CD2-CB 4.23Å; N403-Q406 HydrophobicContact CB-CG 4.49Å; N403-Q406 WeakPolarHBondContact O-CB 3.24Å; N403-Q406 PolarHBondContact O-N 3.41Å; Q406-T409 WeakPolarHBondContact O-CB 3.32Å; Q406-T409 PolarHBondContact O-N 3.23Å; Q406-I410 VanDerWaalsContact O-CG1 3.23Å; Q406-I410 WeakPolarHBondContact O-CG1 3.3Å; Q406-I410 PolarHBondContact O-N 3.44Å; Q406-I439 HydrophobicContact CB-CG2 4.24Å; Q406-I439 HydrophobicContact CG-CB 4.48Å; Q406-I439 HydrophobicContact CG-CG2 4.49Å; Q406-I439 PolarHBondContact NE2-O 3.23Å |
| 407 | V | 88.5 | Confident | 82.2 | Confident | 26 Ų | 26 | 46.1 Ų | 46.1 | 16% | 0.158 | 26% | 0.257 | C | S | . | . | H | α-helix | trans | -64.8 | -44.6 | 174 | 175.9 | 0 | 0 | 0 | 0 | 111.6 | V141 F145 L402 N403 F404 I405 T409 I410 L411 | V141-V407 HydrophobicContact CG1-CG1 3.66Å; F145-V407 HydrophobicContact CE2-CG2 3.9Å; F145-V407 HydrophobicContact CZ-CG2 3.91Å; L402-V407 HydrophobicContact CB-CG2 4.17Å; N403-V407 WeakPolarHBondContact O-CG2 3.26Å; N403-V407 PolarHBondContact O-N 3.48Å; F404-V407 WeakPolarHBondContact O-CB 3.28Å; F404-V407 PolarHBondContact O-N 3.31Å; I405-V407 PolarHBondContact O-N 3.5Å; V407-T409 VanDerWaalsContact C-N 3.33Å; V407-I410 PolarHBondContact O-N 2.92Å; V407-L411 WeakPolarHBondContact O-CB 3.24Å; V407-L411 PolarHBondContact O-N 3.37Å |
| 408 | I | 84.7 | Confident | 82.1 | Confident | 78 Ų | 78 | 45 Ų | 45 | 40% | 0.4 | 25% | 0.251 | S | S | . | . | H | α-helix | trans | -62.1 | -44 | 173.9 | -68.8 | 173 | 0 | 0 | 0 | 110.5 | F404 I405 I410 L411 V412 | F404-I408 HydrophobicContact CD1-CD1 3.9Å; F404-I408 HydrophobicContact CE1-CD1 3.34Å; F404-I408 HydrophobicContact CE1-CG1 4.35Å; F404-I408 HydrophobicContact CE2-CD1 4.38Å; F404-I408 HydrophobicContact CZ-CD1 3.62Å; F404-I408 HydrophobicContact CZ-CG1 4.34Å; F404-I408 PolarHBondContact O-N 3.32Å; I405-I408 PolarHBondContact O-N 3.39Å; I405-I408 VanDerWaalsContact O-N 3.17Å; I408-I410 PolarHBondContact O-N 3.12Å; I408-L411 PolarHBondContact O-N 3.15Å; I408-L411 VanDerWaalsContact O-N 3.15Å; I408-V412 HydrophobicContact CG2-CG2 4.24Å; I408-V412 WeakPolarHBondContact O-CG2 3.45Å; I408-V412 PolarHBondContact O-N 2.87Å |
| 409 | T | 78.1 | Confident | 81.8 | Confident | 8 Ų | 8 | 43.6 Ų | 43.6 | 5% | 0.049 | 24% | 0.244 | C | C | . | . | H | α-helix | trans | -56.4 | -50.4 | 175.9 | -60.2 | 0 | 0 | 0 | 0 | 110.3 | L180 I405 Q406 V407 L411 V412 T413 A438 I439 | L180-T409 HydrophobicContact CD1-CG2 3.75Å; I405-T409 PolarHBondContact O-N 3.43Å; I405-T409 PolarHBondContact O-OG1 3.1Å; Q406-T409 WeakPolarHBondContact O-CB 3.32Å; Q406-T409 PolarHBondContact O-N 3.23Å; V407-T409 VanDerWaalsContact C-N 3.33Å; T409-L411 VanDerWaalsContact C-N 3.26Å; T409-L411 PolarHBondContact O-N 3.04Å; T409-V412 PolarHBondContact O-N 3.47Å; T409-T413 HydrophobicContact CG2-CG2 3.92Å; T409-T413 WeakPolarHBondContact O-CB 3.18Å; T409-T413 VanDerWaalsContact O-CG2 3.23Å; T409-T413 WeakPolarHBondContact O-CG2 3.35Å; T409-T413 PolarHBondContact O-N 3.35Å; T409-T413 PolarHBondContact O-OG1 2.84Å; T409-A438 HydrophobicContact CG2-CB 4.18Å; T409-I439 HydrophobicContact CG2-CG2 3.88Å |
| 410 | I | 88.7 | Confident | 80.9 | Confident | 0 Ų | 0 | 38.2 Ų | 38.2 | 0% | 0 | 22% | 0.217 | C | C | . | . | H | α-helix | trans | -54 | -44.9 | 176.2 | -71.5 | 162 | 0 | 0 | 0 | 111.1 | V141 C388 A391 V392 L402 Q406 V407 I408 T413 A414 I435 I439 | V141-I410 HydrophobicContact CG2-CG2 4.32Å; C388-I410 HydrophobicContact CB-CG2 4.29Å; A391-I410 HydrophobicContact CB-CD1 4.28Å; A391-I410 HydrophobicContact CB-CG1 4.31Å; A391-I410 HydrophobicContact CB-CG2 4.21Å; V392-I410 HydrophobicContact CG2-CD1 4.47Å; L402-I410 HydrophobicContact CD1-CD1 3.86Å; L402-I410 HydrophobicContact CD2-CD1 4.22Å; Q406-I410 VanDerWaalsContact O-CG1 3.23Å; Q406-I410 WeakPolarHBondContact O-CG1 3.3Å; Q406-I410 PolarHBondContact O-N 3.44Å; V407-I410 PolarHBondContact O-N 2.92Å; I408-I410 PolarHBondContact O-N 3.12Å; I410-T413 PolarHBondContact O-OG1 3.03Å; I410-A414 WeakPolarHBondContact O-CB 3.23Å; I410-A414 PolarHBondContact O-N 2.94Å; I410-I435 HydrophobicContact CB-CG2 4.33Å; I410-I435 HydrophobicContact CG1-CG2 4.02Å; I410-I435 HydrophobicContact CG2-CG2 4.19Å; I410-I439 HydrophobicContact CD1-CD1 3.75Å; I410-I439 HydrophobicContact CG1-CD1 3.78Å; I410-I439 HydrophobicContact CG1-CG2 3.91Å |
| 411 | L | 89.7 | Confident | 80.3 | Confident | 33 Ų | 33 | 35.5 Ų | 35.5 | 17% | 0.173 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -69.5 | -43 | -174.1 | -167 | 137.3 | 0 | 0 | 0 | 112.1 | L134 V407 I408 T409 T415 | L134-L411 HydrophobicContact CD1-CD2 3.27Å; L134-L411 HydrophobicContact CD1-CG 4.41Å; L134-L411 HydrophobicContact CG-CD2 4.13Å; V407-L411 WeakPolarHBondContact O-CB 3.24Å; V407-L411 PolarHBondContact O-N 3.37Å; I408-L411 PolarHBondContact O-N 3.15Å; I408-L411 VanDerWaalsContact O-N 3.15Å; T409-L411 VanDerWaalsContact C-N 3.26Å; T409-L411 PolarHBondContact O-N 3.04Å; L411-T415 WeakPolarHBondContact O-CB 3.49Å; L411-T415 PolarHBondContact O-N 3.3Å; L411-T415 VanDerWaalsContact O-N 3.14Å; L411-T415 PolarHBondContact O-OG1 3.32Å |
| 412 | V | 83.1 | Confident | 79.4 | Confident | 82 Ų | 82 | 30.8 Ų | 30.8 | 50% | 0.497 | 17% | 0.168 | S | C | . | . | H | α-helix | trans | -71.7 | -44.2 | 177.4 | 175.4 | 0 | 0 | 0 | 0 | 111.1 | I408 T409 T415 A416 | I408-V412 HydrophobicContact CG2-CG2 4.24Å; I408-V412 WeakPolarHBondContact O-CG2 3.45Å; I408-V412 PolarHBondContact O-N 2.87Å; T409-V412 PolarHBondContact O-N 3.47Å; V412-T415 PolarHBondContact O-N 2.99Å; V412-A416 WeakPolarHBondContact O-CB 3.34Å; V412-A416 PolarHBondContact O-N 3.01Å |
| 413 | T | 78.9 | Confident | 78.3 | Confident | 5 Ų | 5 | 29.6 Ų | 29.6 | 3% | 0.031 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -68.7 | -38.4 | -179.9 | 58.7 | 0 | 0 | 0 | 0 | 111.7 | L225 T409 I410 A416 S417 A438 | L225-T413 HydrophobicContact CD1-CG2 4.25Å; T409-T413 HydrophobicContact CG2-CG2 3.92Å; T409-T413 WeakPolarHBondContact O-CB 3.18Å; T409-T413 VanDerWaalsContact O-CG2 3.23Å; T409-T413 WeakPolarHBondContact O-CG2 3.35Å; T409-T413 PolarHBondContact O-N 3.35Å; T409-T413 PolarHBondContact O-OG1 2.84Å; I410-T413 PolarHBondContact O-OG1 3.03Å; T413-A416 PolarHBondContact O-N 3.22Å; T413-S417 WeakPolarHBondContact O-CA 3.46Å; T413-S417 WeakPolarHBondContact O-CB 3.07Å; T413-S417 PolarHBondContact O-N 2.74Å; T413-A438 HydrophobicContact CG2-CB 4.11Å |
| 414 | A | 88.4 | Confident | 77.4 | Confident | 0 Ų | 0 | 28.4 Ų | 28.4 | 0% | 0 | 16% | 0.156 | C | C | . | . | H | α-helix | trans | -62.3 | -46.1 | 172.8 | 0 | 0 | 0 | 0 | 0 | 111.6 | Q387 C388 I410 A416 S417 S418 I435 | Q387-A414 HydrophobicContact CB-CB 4.28Å; Q387-A414 PolarHBondContact OE1-O 3.07Å; C388-A414 WeakPolarHBondContact SG-CB 3.49Å; I410-A414 WeakPolarHBondContact O-CB 3.23Å; I410-A414 PolarHBondContact O-N 2.94Å; A414-A416 PolarHBondContact O-N 3.48Å; A414-S417 PolarHBondContact O-N 2.73Å; A414-S418 VanDerWaalsContact O-CB 3.28Å; A414-S418 WeakPolarHBondContact O-CB 3.44Å; A414-S418 PolarHBondContact O-N 3.47Å; A414-I435 HydrophobicContact CB-CD1 3.8Å |
| 415 | T | 87.4 | Confident | 76.3 | Confident | 13 Ų | 13 | 23.4 Ų | 23.4 | 8% | 0.08 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -60.1 | -50 | 177.4 | -57.4 | 0 | 0 | 0 | 0 | 110.9 | T133 S137 L411 V412 S417 S418 | T133-T415 HydrophobicContact CG2-CG2 3.92Å; S137-T415 PolarHBondContact OG-OG1 2.96Å; L411-T415 WeakPolarHBondContact O-CB 3.49Å; L411-T415 PolarHBondContact O-N 3.3Å; L411-T415 VanDerWaalsContact O-N 3.14Å; L411-T415 PolarHBondContact O-OG1 3.32Å; V412-T415 PolarHBondContact O-N 2.99Å; T415-S417 PolarHBondContact O-N 3.26Å; T415-S418 PolarHBondContact O-N 3.32Å; T415-S418 PolarHBondContact O-OG 3.35Å |
| 416 | A | 77 | Confident | 75.8 | Confident | 29 Ų | 29 | 22.7 Ų | 22.7 | 24% | 0.24 | 14% | 0.138 | C | C | . | . | H | α-helix | trans | -65.5 | -39.6 | 179 | 0 | 0 | 0 | 0 | 0 | 112.6 | V412 T413 A414 S418 V419 | V412-A416 WeakPolarHBondContact O-CB 3.34Å; V412-A416 PolarHBondContact O-N 3.01Å; T413-A416 PolarHBondContact O-N 3.22Å; A414-A416 PolarHBondContact O-N 3.48Å; A416-S418 VanDerWaalsContact C-N 3.32Å; A416-S418 PolarHBondContact O-N 3.14Å; A416-V419 PolarHBondContact O-N 3.24Å |
| 417 | S | 75.8 | Confident | 75 | Confident | 5 Ų | 5 | 21 Ų | 21 | 4% | 0.035 | 13% | 0.132 | C | C | . | . | H | α-helix | trans | -70.9 | -29 | -179.5 | -173.2 | 0 | 0 | 0 | 0 | 112.7 | T413 A414 T415 V419 G420 A421 T431 I434 | T413-S417 WeakPolarHBondContact O-CA 3.46Å; T413-S417 WeakPolarHBondContact O-CB 3.07Å; T413-S417 PolarHBondContact O-N 2.74Å; A414-S417 PolarHBondContact O-N 2.73Å; T415-S417 PolarHBondContact O-N 3.26Å; S417-V419 VanDerWaalsContact C-N 3.28Å; S417-V419 PolarHBondContact O-N 3.08Å; S417-G420 PolarHBondContact O-N 3.29Å; S417-G420 VanDerWaalsContact O-N 3.11Å; S417-A421 PolarHBondContact O-N 3.35Å; S417-A421 VanDerWaalsContact O-N 3.11Å; S417-T431 VanDerWaalsContact OG-CB 3.23Å; S417-T431 WeakPolarHBondContact OG-CB 3.45Å; S417-T431 WeakPolarHBondContact OG-CG2 3.4Å; S417-I434 WeakPolarHBondContact OG-CD1 3.25Å |
| 418 | S | 80.9 | Confident | 74 | Confident | 0 Ų | 0 | 20 Ų | 20 | 0% | 0 | 13% | 0.127 | C | C | . | . | H | α-helix | trans | -64.8 | -32.5 | 178.4 | 75.3 | 0 | 0 | 0 | 0 | 112.4 | T133 M380 A414 T415 A416 G420 A421 | T133-S418 WeakPolarHBondContact CG2-OG 3.46Å; M380-S418 WeakPolarHBondContact CB-O 3.45Å; M380-S418 WeakPolarHBondContact CG-O 2.98Å; A414-S418 VanDerWaalsContact O-CB 3.28Å; A414-S418 WeakPolarHBondContact O-CB 3.44Å; A414-S418 PolarHBondContact O-N 3.47Å; T415-S418 PolarHBondContact O-N 3.32Å; T415-S418 PolarHBondContact O-OG 3.35Å; A416-S418 VanDerWaalsContact C-N 3.32Å; A416-S418 PolarHBondContact O-N 3.14Å; S418-G420 PolarHBondContact O-N 3.37Å; S418-A421 PolarHBondContact O-N 2.78Å |
| 419 | V | 74.3 | Confident | 73.4 | Confident | 31 Ų | 31 | 16.5 Ų | 16.5 | 19% | 0.188 | 11% | 0.109 | C | C | . | . | H | α-helix | trans | -65.4 | -28.4 | 172.9 | 179.5 | 0 | 0 | 0 | 0 | 112.1 | L106 F130 T377 V378 A416 S417 | L106-V419 HydrophobicContact CD2-CG1 4.28Å; F130-V419 HydrophobicContact CE1-CG2 4.18Å; T377-V419 VanDerWaalsContact O-O 3.06Å; V378-V419 HydrophobicContact CB-CG1 4.4Å; V378-V419 HydrophobicContact CG1-CG1 4.09Å; V378-V419 HydrophobicContact CG1-CG2 4.23Å; V378-V419 HydrophobicContact CG2-CG1 4.31Å; A416-V419 PolarHBondContact O-N 3.24Å; S417-V419 VanDerWaalsContact C-N 3.28Å; S417-V419 PolarHBondContact O-N 3.08Å |
| 420 | G | 61.4 | Low | 72.7 | Confident | 5 Ų | 5 | 17.4 Ų | 17.4 | 5% | 0.052 | 11% | 0.114 | C | C | . | . | H | α-helix | trans | -91.9 | -10 | 179.5 | 0 | 0 | 0 | 0 | 0 | 114 | L106 S417 S418 A422 | L106-G420 VanDerWaalsContact CD2-CA 3.44Å; S417-G420 PolarHBondContact O-N 3.29Å; S417-G420 VanDerWaalsContact O-N 3.11Å; S418-G420 PolarHBondContact O-N 3.37Å; G420-A422 PolarHBondContact O-N 2.84Å |
| 421 | A | 66.6 | Low | 72 | Confident | 2 Ų | 2 | 17.7 Ų | 17.7 | 2% | 0.017 | 12% | 0.116 | C | C | . | . | S | Bend | trans | -69 | 125.5 | 174.2 | 0 | 0 | 0 | 0 | 0 | 108 | M380 S417 S418 T431 | M380-A421 WeakPolarHBondContact CE-O 3.45Å; M380-A421 HydrophobicContact SD-CB 3.51Å; M380-A421 VanDerWaalsContact SD-CB 3.51Å; S417-A421 PolarHBondContact O-N 3.35Å; S417-A421 VanDerWaalsContact O-N 3.11Å; S418-A421 PolarHBondContact O-N 2.78Å; A421-T431 HydrophobicContact CB-CG2 4.26Å |
| 422 | A | 59.4 | Low | 71.6 | Confident | 11 Ų | 11 | 16.1 Ų | 16.1 | 9% | 0.091 | 11% | 0.107 | C | C | . | . | trans | -75.4 | 149.5 | 173.6 | 0 | 0 | 0 | 0 | 0 | 109.3 | M260 G420 I424 | M260-A422 HydrophobicContact CE-CB 3.71Å; M260-A422 HydrophobicContact SD-CB 4.14Å; G420-A422 PolarHBondContact O-N 2.84Å; A422-I424 HydrophobicContact CB-CD1 4.25Å; A422-I424 HydrophobicContact CB-CG1 3.8Å; A422-I424 WeakPolarHBondContact O-CG1 3.27Å; A422-I424 PolarHBondContact O-N 3.16Å | ||
| 423 | G | 59.6 | Low | 70.8 | Confident | 5 Ų | 5 | 12.4 Ų | 12.4 | 5% | 0.052 | 9% | 0.085 | C | C | . | . | S | Bend | trans | -72 | 40.7 | -177.2 | 0 | 0 | 0 | 0 | 0 | 114.3 | S345 S346 S347 | S345-G423 WeakPolarHBondContact CA-O 3.41Å; S345-G423 WeakPolarHBondContact CB-O 3.35Å; S345-G423 PolarHBondContact OG-O 3.18Å; S346-G423 PolarHBondContact N-O 3.45Å; S347-G423 PolarHBondContact N-O 3.02Å; S347-G423 PolarHBondContact OG-O 3.34Å |
| 424 | I | 62.3 | Low | 70.2 | Confident | 37 Ų | 37 | 12.5 Ų | 12.5 | 19% | 0.19 | 9% | 0.086 | C | C | . | . | S | Bend | trans | -111.7 | 157.3 | -177.5 | 47 | 161.1 | 0 | 0 | 0 | 111.5 | M260 V263 A422 G427 | M260-I424 HydrophobicContact CE-CB 4.16Å; M260-I424 HydrophobicContact CE-CD1 3.89Å; M260-I424 HydrophobicContact CE-CG1 3.96Å; M260-I424 HydrophobicContact CE-CG2 3.2Å; M260-I424 HydrophobicContact SD-CD1 3.9Å; M260-I424 HydrophobicContact SD-CG2 4.49Å; V263-I424 HydrophobicContact CG1-CD1 3.79Å; A422-I424 HydrophobicContact CB-CD1 4.25Å; A422-I424 HydrophobicContact CB-CG1 3.8Å; A422-I424 WeakPolarHBondContact O-CG1 3.27Å; A422-I424 PolarHBondContact O-N 3.16Å; I424-G427 PolarHBondContact O-N 3.18Å |
| 425 | P | 61.6 | Low | 69.7 | Low | 45 Ų | 45 | 12.5 Ų | 12.5 | 29% | 0.292 | 9% | 0.086 | S | C | . | . | T | Hydrogen-bonded Turn | trans | -56.7 | 141.4 | 177.1 | -22.3 | 33.5 | 0 | 0 | 0 | 111.7 | M267 S344 G427 D457 | M267-P425 HydrophobicContact CE-CB 3.96Å; M267-P425 VanDerWaalsContact CE-O 3.27Å; M267-P425 WeakPolarHBondContact CE-O 3.31Å; S344-P425 WeakPolarHBondContact O-CA 3.03Å; S344-P425 WeakPolarHBondContact O-CG 3.3Å; P425-G427 PolarHBondContact O-N 3.47Å; P425-G427 VanDerWaalsContact O-N 3.12Å; P425-D457 WeakPolarHBondContact CA-OD2 3.36Å |
| 426 | A | 65.4 | Low | 69 | Low | 17 Ų | 17 | 11.9 Ų | 11.9 | 14% | 0.14 | 8% | 0.082 | C | C | . | . | T | Hydrogen-bonded Turn | trans | 57.9 | 14.7 | -178.9 | 0 | 0 | 0 | 0 | 0 | 115.9 | M267 G428 V429 D453 D457 | M267-A426 HydrophobicContact CE-CB 3.77Å; A426-G428 PolarHBondContact O-N 3.03Å; A426-V429 PolarHBondContact O-N 3.14Å; A426-D453 WeakPolarHBondContact CA-OD2 3.47Å; A426-D453 WeakPolarHBondContact CB-OD2 3.17Å; A426-D457 PolarHBondContact N-OD2 3.02Å |
| 427 | G | 62.6 | Low | 68.4 | Low | 8 Ų | 8 | 12.9 Ų | 12.9 | 8% | 0.082 | 8% | 0.082 | C | C | . | . | H | α-helix | trans | -60 | -32 | 177.4 | 0 | 0 | 0 | 0 | 0 | 113.3 | I424 P425 L430 T431 | I424-G427 PolarHBondContact O-N 3.18Å; P425-G427 PolarHBondContact O-N 3.47Å; P425-G427 VanDerWaalsContact O-N 3.12Å; G427-L430 PolarHBondContact O-N 2.67Å; G427-T431 PolarHBondContact O-N 3.31Å; G427-T431 PolarHBondContact O-OG1 2.96Å |
| 428 | G | 68 | Low | 67.7 | Low | 6 Ų | 6 | 14.6 Ų | 14.6 | 6% | 0.062 | 10% | 0.096 | C | C | . | . | H | α-helix | trans | -66.8 | -34.9 | 177.9 | 0 | 0 | 0 | 0 | 0 | 114.1 | Q387 A426 T431 L432 | Q387-G428 PolarHBondContact NE2-O 3.39Å; A426-G428 PolarHBondContact O-N 3.03Å; G428-T431 WeakPolarHBondContact CA-OG1 3.38Å; G428-T431 PolarHBondContact O-OG1 3.39Å; G428-L432 PolarHBondContact O-N 3.27Å |
| 429 | V | 71.6 | Confident | 67.2 | Low | 5 Ų | 5 | 15.3 Ų | 15.3 | 3% | 0.03 | 10% | 0.099 | C | C | . | . | H | α-helix | trans | -69.6 | -37.6 | 177.9 | -177.3 | 0 | 0 | 0 | 0 | 110.9 | F386 A426 T431 L432 I446 I449 L450 D453 | F386-V429 HydrophobicContact CE1-CG2 4.27Å; F386-V429 HydrophobicContact CZ-CG2 3.79Å; A426-V429 PolarHBondContact O-N 3.14Å; V429-T431 VanDerWaalsContact C-N 3.26Å; V429-T431 PolarHBondContact O-N 2.91Å; V429-L432 WeakPolarHBondContact O-CB 3.31Å; V429-L432 PolarHBondContact O-N 3.35Å; V429-I446 HydrophobicContact CG1-CG2 3.59Å; V429-I449 HydrophobicContact CG2-CG2 4.47Å; V429-L450 HydrophobicContact CB-CD1 4.38Å; V429-L450 HydrophobicContact CG1-CB 4.32Å; V429-L450 HydrophobicContact CG1-CD1 3.95Å; V429-L450 HydrophobicContact CG2-CD1 4.36Å; V429-D453 HydrophobicContact CG2-CB 3.7Å; V429-D453 VanDerWaalsContact CG2-OD1 3.23Å; V429-D453 WeakPolarHBondContact CG2-OD1 3.36Å; V429-D453 WeakPolarHBondContact CG2-OD2 3.49Å |
| 430 | L | 63.8 | Low | 66.7 | Low | 26 Ų | 26 | 17 Ų | 17 | 14% | 0.136 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -61.5 | -41.1 | 179.8 | -136.6 | 79.2 | 0 | 0 | 0 | 111.5 | L94 I97 I98 L101 G427 | L94-L430 HydrophobicContact CB-CD1 3.76Å; L94-L430 HydrophobicContact CD1-CD1 4.34Å; L94-L430 HydrophobicContact CD2-CD1 3.58Å; L94-L430 HydrophobicContact CG-CD1 4.06Å; I97-L430 HydrophobicContact CD1-CD1 4.23Å; I97-L430 HydrophobicContact CD1-CD2 3.69Å; I97-L430 HydrophobicContact CG1-CD2 4.05Å; I98-L430 HydrophobicContact CD1-CG 4.48Å; I98-L430 HydrophobicContact CG1-CD2 4.08Å; I98-L430 HydrophobicContact CG1-CG 3.94Å; L101-L430 HydrophobicContact CD2-CD2 3.89Å; G427-L430 PolarHBondContact O-N 2.67Å |
| 431 | T | 74.8 | Confident | 67.2 | Low | 7 Ų | 7 | 17.3 Ų | 17.3 | 4% | 0.043 | 12% | 0.123 | C | C | . | . | H | α-helix | trans | -80.9 | -17.5 | -179.6 | 39.1 | 0 | 0 | 0 | 0 | 112.7 | Q387 S417 A421 G427 G428 V429 A433 I434 | Q387-T431 PolarHBondContact NE2-OG1 3.24Å; S417-T431 VanDerWaalsContact OG-CB 3.23Å; S417-T431 WeakPolarHBondContact OG-CB 3.45Å; S417-T431 WeakPolarHBondContact OG-CG2 3.4Å; A421-T431 HydrophobicContact CB-CG2 4.26Å; G427-T431 PolarHBondContact O-N 3.31Å; G427-T431 PolarHBondContact O-OG1 2.96Å; G428-T431 WeakPolarHBondContact CA-OG1 3.38Å; G428-T431 PolarHBondContact O-OG1 3.39Å; V429-T431 VanDerWaalsContact C-N 3.26Å; V429-T431 PolarHBondContact O-N 2.91Å; T431-A433 VanDerWaalsContact C-N 3.26Å; T431-A433 PolarHBondContact O-N 3.19Å; T431-I434 HydrophobicContact CG2-CD1 3.97Å; T431-I434 WeakPolarHBondContact O-CB 3.19Å; T431-I434 VanDerWaalsContact O-CG1 3.3Å; T431-I434 WeakPolarHBondContact O-CG1 3.33Å; T431-I434 PolarHBondContact O-N 2.96Å |
| 432 | L | 80.7 | Confident | 67.3 | Low | 0 Ų | 0 | 19.8 Ų | 19.8 | 0% | 0 | 14% | 0.139 | C | C | . | . | H | α-helix | trans | -61.3 | -32.8 | 172.7 | 178.5 | 61.8 | 0 | 0 | 0 | 112.8 | A390 A391 I394 G428 V429 I434 I435 L436 I449 | A390-L432 HydrophobicContact CB-CD1 3.86Å; A390-L432 HydrophobicContact CB-CD2 3.55Å; A390-L432 HydrophobicContact CB-CG 4.37Å; A391-L432 HydrophobicContact CB-CD1 4.32Å; I394-L432 HydrophobicContact CD1-CD2 4.32Å; G428-L432 PolarHBondContact O-N 3.27Å; V429-L432 WeakPolarHBondContact O-CB 3.31Å; V429-L432 PolarHBondContact O-N 3.35Å; L432-I434 PolarHBondContact O-N 2.86Å; L432-I435 PolarHBondContact O-N 2.85Å; L432-I435 VanDerWaalsContact O-N 3.08Å; L432-L436 HydrophobicContact CD1-CG 4.39Å; L432-L436 HydrophobicContact CG-CD1 4.23Å; L432-L436 HydrophobicContact CG-CG 4.33Å; L432-L436 PolarHBondContact O-N 3.09Å; L432-L436 VanDerWaalsContact O-N 3.14Å; L432-I449 HydrophobicContact CD2-CB 4.45Å; L432-I449 HydrophobicContact CD2-CG1 4.16Å; L432-I449 HydrophobicContact CD2-CG2 4.21Å |
| 433 | A | 67.1 | Low | 67.7 | Low | 4 Ų | 4 | 20.7 Ų | 20.7 | 3% | 0.033 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -55.5 | -38 | 176.3 | 0 | 0 | 0 | 0 | 0 | 112.1 | I98 T431 I435 L436 E437 I446 | I98-A433 HydrophobicContact CD1-CB 4.39Å; T431-A433 VanDerWaalsContact C-N 3.26Å; T431-A433 PolarHBondContact O-N 3.19Å; A433-I435 VanDerWaalsContact C-N 3.28Å; A433-I435 PolarHBondContact O-N 3.01Å; A433-L436 PolarHBondContact O-N 3.41Å; A433-E437 WeakPolarHBondContact O-CB 3.34Å; A433-E437 WeakPolarHBondContact O-CG 3.23Å; A433-E437 PolarHBondContact O-N 3.21Å; A433-I446 HydrophobicContact CB-CD1 3.66Å |
| 434 | I | 64.9 | Low | 67.9 | Low | 7 Ų | 7 | 23.6 Ų | 23.6 | 4% | 0.036 | 16% | 0.163 | C | C | . | . | H | α-helix | trans | -55.7 | -45.8 | 177.3 | -55.2 | 175.7 | 0 | 0 | 0 | 110.8 | V102 I224 S417 T431 L432 A438 | V102-I434 HydrophobicContact CG2-CD1 4.29Å; I224-I434 HydrophobicContact CB-CB 4.34Å; I224-I434 HydrophobicContact CB-CD1 4.48Å; I224-I434 HydrophobicContact CB-CG1 3.94Å; I224-I434 HydrophobicContact CB-CG2 3.95Å; I224-I434 HydrophobicContact CD1-CB 4.28Å; I224-I434 HydrophobicContact CD1-CG1 3.57Å; I224-I434 HydrophobicContact CG1-CG1 4.33Å; I224-I434 HydrophobicContact CG2-CB 4.26Å; I224-I434 HydrophobicContact CG2-CD1 3.52Å; I224-I434 HydrophobicContact CG2-CG1 3.5Å; I224-I434 VanDerWaalsContact CG2-CG1 3.5Å; I224-I434 HydrophobicContact CG2-CG2 3.92Å; S417-I434 WeakPolarHBondContact OG-CD1 3.25Å; T431-I434 HydrophobicContact CG2-CD1 3.97Å; T431-I434 WeakPolarHBondContact O-CB 3.19Å; T431-I434 VanDerWaalsContact O-CG1 3.3Å; T431-I434 WeakPolarHBondContact O-CG1 3.33Å; T431-I434 PolarHBondContact O-N 2.96Å; L432-I434 PolarHBondContact O-N 2.86Å; I434-A438 VanDerWaalsContact O-CB 3.29Å; I434-A438 WeakPolarHBondContact O-CB 3.4Å; I434-A438 PolarHBondContact O-N 3.42Å |
| 435 | I | 77.8 | Confident | 68.5 | Low | 0 Ų | 0 | 22.7 Ų | 22.7 | 0% | 0 | 16% | 0.159 | C | C | . | . | H | α-helix | trans | -73.9 | -41.9 | -173.6 | -60.4 | 166.3 | 0 | 0 | 0 | 109.8 | Q387 A391 I410 A414 L432 A433 A438 I439 | Q387-I435 HydrophobicContact CB-CD1 3.48Å; Q387-I435 VanDerWaalsContact CB-CD1 3.48Å; Q387-I435 HydrophobicContact CG-CD1 3.77Å; A391-I435 HydrophobicContact CB-CG2 3.87Å; I410-I435 HydrophobicContact CB-CG2 4.33Å; I410-I435 HydrophobicContact CG1-CG2 4.02Å; I410-I435 HydrophobicContact CG2-CG2 4.19Å; A414-I435 HydrophobicContact CB-CD1 3.8Å; L432-I435 PolarHBondContact O-N 2.85Å; L432-I435 VanDerWaalsContact O-N 3.08Å; A433-I435 VanDerWaalsContact C-N 3.28Å; A433-I435 PolarHBondContact O-N 3.01Å; I435-A438 PolarHBondContact O-N 3.34Å; I435-I439 WeakPolarHBondContact O-CG1 3.38Å; I435-I439 PolarHBondContact O-N 3.3Å |
| 436 | L | 73.6 | Confident | 69.1 | Low | 0 Ų | 0 | 21.3 Ų | 21.3 | 0% | 0 | 15% | 0.149 | C | C | . | . | H | α-helix | trans | -64.3 | -44.4 | 178 | -63.8 | 177.5 | 0 | 0 | 0 | 111.6 | A391 I394 L432 A433 I439 G440 L441 T443 I446 | A391-L436 HydrophobicContact CB-CD2 4.27Å; I394-L436 HydrophobicContact CB-CD2 4.2Å; I394-L436 HydrophobicContact CD1-CD1 3.61Å; I394-L436 HydrophobicContact CD1-CD2 4.03Å; I394-L436 HydrophobicContact CD1-CG 4.43Å; I394-L436 HydrophobicContact CG2-CD2 4.12Å; L432-L436 HydrophobicContact CD1-CG 4.39Å; L432-L436 HydrophobicContact CG-CD1 4.23Å; L432-L436 HydrophobicContact CG-CG 4.33Å; L432-L436 PolarHBondContact O-N 3.09Å; L432-L436 VanDerWaalsContact O-N 3.14Å; A433-L436 PolarHBondContact O-N 3.41Å; L436-I439 WeakPolarHBondContact O-CG1 3.45Å; L436-I439 PolarHBondContact O-N 2.96Å; L436-G440 PolarHBondContact O-N 2.8Å; L436-L441 HydrophobicContact CB-CB 4.25Å; L436-L441 HydrophobicContact CD2-CB 4.01Å; L436-L441 HydrophobicContact CD2-CD1 3.95Å; L436-L441 PolarHBondContact O-N 2.62Å; L436-T443 HydrophobicContact CB-CG2 4.31Å; L436-I446 HydrophobicContact CD1-CD1 3.96Å; L436-I446 HydrophobicContact CD1-CG1 3.57Å |
| 437 | E | 64 | Low | 69.4 | Low | 50 Ų | 50 | 20.8 Ų | 20.8 | 23% | 0.234 | 14% | 0.144 | C | C | . | . | H | α-helix | trans | -62.5 | -42.7 | 175.5 | -73.1 | 174.9 | 180 | 0 | 0 | 111.1 | I224 A433 I439 G440 T443 | I224-E437 WeakPolarHBondContact CD1-OE2 3.44Å; A433-E437 WeakPolarHBondContact O-CB 3.34Å; A433-E437 WeakPolarHBondContact O-CG 3.23Å; A433-E437 PolarHBondContact O-N 3.21Å; E437-I439 PolarHBondContact O-N 3.49Å; E437-I439 VanDerWaalsContact O-N 3.14Å; E437-G440 PolarHBondContact O-N 3.5Å; E437-G440 VanDerWaalsContact O-N 3.07Å; E437-T443 HydrophobicContact CG-CG2 3.88Å |
| 438 | A | 61.8 | Low | 70 | Confident | 40 Ų | 40 | 21.1 Ų | 21.1 | 33% | 0.331 | 14% | 0.144 | S | C | . | . | H | α-helix | trans | -61.7 | -23.3 | 179 | 0 | 0 | 0 | 0 | 0 | 114.4 | T409 T413 I434 I435 | T409-A438 HydrophobicContact CG2-CB 4.18Å; T413-A438 HydrophobicContact CG2-CB 4.11Å; I434-A438 VanDerWaalsContact O-CB 3.29Å; I434-A438 WeakPolarHBondContact O-CB 3.4Å; I434-A438 PolarHBondContact O-N 3.42Å; I435-A438 PolarHBondContact O-N 3.34Å |
| 439 | I | 70.9 | Confident | 70.7 | Confident | 15 Ų | 15 | 20.8 Ų | 20.8 | 8% | 0.077 | 14% | 0.141 | C | C | . | . | H | α-helix | trans | -108.2 | 1.6 | 176.6 | 64.1 | -176.9 | 0 | 0 | 0 | 113.6 | L402 Q406 T409 I410 I435 L436 E437 L441 | L402-I439 HydrophobicContact CD2-CD1 4.3Å; Q406-I439 HydrophobicContact CB-CG2 4.24Å; Q406-I439 HydrophobicContact CG-CB 4.48Å; Q406-I439 HydrophobicContact CG-CG2 4.49Å; Q406-I439 PolarHBondContact NE2-O 3.23Å; T409-I439 HydrophobicContact CG2-CG2 3.88Å; I410-I439 HydrophobicContact CD1-CD1 3.75Å; I410-I439 HydrophobicContact CG1-CD1 3.78Å; I410-I439 HydrophobicContact CG1-CG2 3.91Å; I435-I439 WeakPolarHBondContact O-CG1 3.38Å; I435-I439 PolarHBondContact O-N 3.3Å; L436-I439 WeakPolarHBondContact O-CG1 3.45Å; L436-I439 PolarHBondContact O-N 2.96Å; E437-I439 PolarHBondContact O-N 3.49Å; E437-I439 VanDerWaalsContact O-N 3.14Å; I439-L441 HydrophobicContact CD1-CD1 3.45Å; I439-L441 VanDerWaalsContact CD1-CD1 3.45Å; I439-L441 HydrophobicContact CD1-CG 3.91Å; I439-L441 HydrophobicContact CG1-CB 4.25Å; I439-L441 HydrophobicContact CG1-CD1 3.99Å; I439-L441 HydrophobicContact CG1-CG 3.87Å |
| 440 | G | 63.4 | Low | 70.9 | Confident | 66 Ų | 66 | 21.3 Ų | 21.3 | 68% | 0.68 | 14% | 0.143 | S | C | * | . | T | Hydrogen-bonded Turn | trans | 74.7 | 29.1 | 178.3 | 0 | 0 | 0 | 0 | 0 | 114.8 | L436 E437 | L436-G440 PolarHBondContact O-N 2.8Å; E437-G440 PolarHBondContact O-N 3.5Å; E437-G440 VanDerWaalsContact O-N 3.07Å |
| 441 | L | 71.1 | Confident | 71.3 | Confident | 12 Ų | 12 | 20.6 Ų | 20.6 | 6% | 0.063 | 14% | 0.141 | C | C | . | . | trans | -92.5 | 149.1 | 175.5 | -73.4 | -178.8 | 0 | 0 | 0 | 112.3 | I394 A395 T400 L436 I439 T443 | I394-L441 HydrophobicContact CG2-CD1 4.41Å; A395-L441 HydrophobicContact CB-CD1 3.69Å; T400-L441 HydrophobicContact CG2-CD2 3.93Å; L436-L441 HydrophobicContact CB-CB 4.25Å; L436-L441 HydrophobicContact CD2-CB 4.01Å; L436-L441 HydrophobicContact CD2-CD1 3.95Å; L436-L441 PolarHBondContact O-N 2.62Å; I439-L441 HydrophobicContact CD1-CD1 3.45Å; I439-L441 VanDerWaalsContact CD1-CD1 3.45Å; I439-L441 HydrophobicContact CD1-CG 3.91Å; I439-L441 HydrophobicContact CG1-CB 4.25Å; I439-L441 HydrophobicContact CG1-CD1 3.99Å; I439-L441 HydrophobicContact CG1-CG 3.87Å; L441-T443 PolarHBondContact O-N 3.39Å | ||
| 442 | P | 68.4 | Low | 71.4 | Confident | 55 Ų | 55 | 21.1 Ų | 21.1 | 36% | 0.357 | 14% | 0.144 | S | C | . | . | trans | -65.3 | 133.2 | 179.6 | 26.5 | -33.8 | 0 | 0 | 0 | 112 | S444 | P442-S444 VanDerWaalsContact C-N 3.32Š| ||
| 443 | T | 67.6 | Low | 71.4 | Confident | 29 Ų | 29 | 21.3 Ų | 21.3 | 18% | 0.178 | 15% | 0.146 | C | C | . | . | G | 310 helix | trans | -83.9 | -3.9 | 178.6 | 56.9 | 0 | 0 | 0 | 0 | 113.7 | K95 L436 E437 L441 D445 I446 | K95-T443 PolarHBondContact NZ-OG1 3.42Å; K95-T443 VanDerWaalsContact NZ-OG1 3.08Å; L436-T443 HydrophobicContact CB-CG2 4.31Å; E437-T443 HydrophobicContact CG-CG2 3.88Å; L441-T443 PolarHBondContact O-N 3.39Å; T443-D445 PolarHBondContact O-N 3.12Å; T443-I446 HydrophobicContact CG2-CD1 4.11Å; T443-I446 WeakPolarHBondContact O-CB 3.46Å; T443-I446 VanDerWaalsContact O-CG1 3.31Å; T443-I446 WeakPolarHBondContact O-CG1 3.17Å; T443-I446 PolarHBondContact O-N 3.39Å |
| 444 | S | 65.5 | Low | 71.8 | Confident | 66 Ų | 66 | 25.1 Ų | 25.1 | 46% | 0.462 | 16% | 0.159 | S | C | . | . | G | 310 helix | trans | -60 | -30 | 176.5 | 50.2 | 0 | 0 | 0 | 0 | 112.9 | P442 I446 S447 | P442-S444 VanDerWaalsContact C-N 3.32Å; S444-I446 VanDerWaalsContact C-N 3.31Å; S444-I446 PolarHBondContact O-N 3.36Å; S444-S447 PolarHBondContact O-OG 2.91Å |
| 445 | D | 73.9 | Confident | 72.6 | Confident | 18 Ų | 18 | 27.1 Ų | 27.1 | 10% | 0.096 | 17% | 0.169 | C | C | . | . | G | 310 helix | trans | -85.5 | -5.7 | -173.2 | -57.8 | -23.2 | 0 | 0 | 0 | 113.1 | I394 N398 T443 S447 L448 | I394-D445 HydrophobicContact CD1-CB 4.36Å; I394-D445 HydrophobicContact CG1-CB 4.21Å; I394-D445 HydrophobicContact CG2-CB 4.05Å; N398-D445 PolarHBondContact ND2-OD2 3.2Å; N398-D445 PolarHBondContact OD1-OD2 2.87Å; T443-D445 PolarHBondContact O-N 3.12Å; D445-S447 PolarHBondContact O-N 3.47Å; D445-S447 VanDerWaalsContact O-N 3.17Å; D445-L448 WeakPolarHBondContact O-CB 3.33Å; D445-L448 PolarHBondContact O-N 3.33Å |
| 446 | I | 75.1 | Confident | 73.1 | Confident | 17 Ų | 17 | 27.1 Ų | 27.1 | 9% | 0.087 | 17% | 0.169 | C | C | . | . | H | α-helix | trans | -56.2 | -30.8 | 168.3 | -63.1 | 175.9 | 0 | 0 | 0 | 110.6 | V429 A433 L436 T443 S444 L448 I449 L450 | V429-I446 HydrophobicContact CG1-CG2 3.59Å; A433-I446 HydrophobicContact CB-CD1 3.66Å; L436-I446 HydrophobicContact CD1-CD1 3.96Å; L436-I446 HydrophobicContact CD1-CG1 3.57Å; T443-I446 HydrophobicContact CG2-CD1 4.11Å; T443-I446 WeakPolarHBondContact O-CB 3.46Å; T443-I446 VanDerWaalsContact O-CG1 3.31Å; T443-I446 WeakPolarHBondContact O-CG1 3.17Å; T443-I446 PolarHBondContact O-N 3.39Å; S444-I446 VanDerWaalsContact C-N 3.31Å; S444-I446 PolarHBondContact O-N 3.36Å; I446-L448 VanDerWaalsContact C-N 3.26Å; I446-L448 PolarHBondContact O-N 3.37Å; I446-I449 WeakPolarHBondContact O-CB 3.28Å; I446-I449 PolarHBondContact O-N 3.03Å; I446-I449 VanDerWaalsContact O-N 3.1Å; I446-L450 WeakPolarHBondContact O-CB 3.29Å; I446-L450 PolarHBondContact O-N 3.3Å |
| 447 | S | 70.4 | Confident | 73.7 | Confident | 6 Ų | 6 | 27.9 Ų | 27.9 | 4% | 0.042 | 17% | 0.174 | C | C | . | . | H | α-helix | trans | -57.1 | -36.5 | 176 | 56.8 | 0 | 0 | 0 | 0 | 113.6 | K281 S444 D445 A451 | K281-S447 WeakPolarHBondContact CE-OG 3.32Å; S444-S447 PolarHBondContact O-OG 2.91Å; D445-S447 PolarHBondContact O-N 3.47Å; D445-S447 VanDerWaalsContact O-N 3.17Å; S447-A451 PolarHBondContact O-N 3.44Å |
| 448 | L | 75.1 | Confident | 74.8 | Confident | 14 Ų | 14 | 26.5 Ų | 26.5 | 7% | 0.073 | 17% | 0.166 | C | C | . | . | H | α-helix | trans | -69 | -37.5 | 177 | -65.6 | 175.1 | 0 | 0 | 0 | 111.4 | K281 L291 L295 L397 D445 I446 | K281-L448 HydrophobicContact CB-CD2 3.84Å; K281-L448 HydrophobicContact CD-CD2 4.1Å; K281-L448 HydrophobicContact CD-CG 4.37Å; K281-L448 HydrophobicContact CG-CD2 3.88Å; K281-L448 HydrophobicContact CG-CG 4.47Å; L291-L448 HydrophobicContact CD1-CD2 3.88Å; L295-L448 HydrophobicContact CD2-CB 4.43Å; L397-L448 HydrophobicContact CD1-CD1 4.04Å; D445-L448 WeakPolarHBondContact O-CB 3.33Å; D445-L448 PolarHBondContact O-N 3.33Å; I446-L448 VanDerWaalsContact C-N 3.26Å; I446-L448 PolarHBondContact O-N 3.37Å |
| 449 | I | 83.9 | Confident | 76.2 | Confident | 0 Ų | 0 | 25.8 Ų | 25.8 | 0% | 0 | 16% | 0.158 | C | C | . | . | H | α-helix | trans | -68.2 | -47.9 | 176 | -55.9 | -56.7 | 0 | 0 | 0 | 110.2 | Y298 F386 A390 F393 I394 V429 L432 I446 A451 V452 D453 | Y298-I449 HydrophobicContact CE1-CD1 4Å; Y298-I449 HydrophobicContact CE2-CD1 4.06Å; F386-I449 HydrophobicContact CE2-CG2 3.7Å; F386-I449 HydrophobicContact CZ-CG2 3.5Å; A390-I449 HydrophobicContact CB-CD1 4.21Å; A390-I449 HydrophobicContact CB-CG1 4.39Å; A390-I449 HydrophobicContact CB-CG2 4.48Å; F393-I449 HydrophobicContact CD1-CD1 3.67Å; F393-I449 HydrophobicContact CE1-CD1 3.85Å; I394-I449 HydrophobicContact CD1-CG1 4Å; I394-I449 HydrophobicContact CG1-CG1 4.47Å; V429-I449 HydrophobicContact CG2-CG2 4.47Å; L432-I449 HydrophobicContact CD2-CB 4.45Å; L432-I449 HydrophobicContact CD2-CG1 4.16Å; L432-I449 HydrophobicContact CD2-CG2 4.21Å; I446-I449 WeakPolarHBondContact O-CB 3.28Å; I446-I449 PolarHBondContact O-N 3.03Å; I446-I449 VanDerWaalsContact O-N 3.1Å; I449-A451 PolarHBondContact O-N 2.97Å; I449-A451 VanDerWaalsContact O-N 3.16Å; I449-V452 VanDerWaalsContact O-CG2 3.24Å; I449-V452 WeakPolarHBondContact O-CG2 3.26Å; I449-V452 PolarHBondContact O-N 2.74Å; I449-D453 WeakPolarHBondContact O-CB 3.49Å; I449-D453 PolarHBondContact O-N 3.17Å |
| 450 | L | 75.3 | Confident | 77.3 | Confident | 15 Ų | 15 | 25.2 Ų | 25.2 | 8% | 0.079 | 16% | 0.155 | C | C | . | . | H | α-helix | trans | -57.5 | -33.3 | -179.7 | -171.5 | 68.6 | 0 | 0 | 0 | 112.4 | L90 I91 L94 I274 L277 V429 I446 V452 | L90-L450 HydrophobicContact CD2-CD2 3.88Å; I91-L450 HydrophobicContact CD1-CD2 4.33Å; L94-L450 HydrophobicContact CD1-CD2 4.14Å; I274-L450 HydrophobicContact CD1-CG 4.39Å; I274-L450 HydrophobicContact CG1-CD2 4.17Å; I274-L450 HydrophobicContact CG1-CG 4.24Å; L277-L450 HydrophobicContact CD1-CD2 4.01Å; V429-L450 HydrophobicContact CB-CD1 4.38Å; V429-L450 HydrophobicContact CG1-CB 4.32Å; V429-L450 HydrophobicContact CG1-CD1 3.95Å; V429-L450 HydrophobicContact CG2-CD1 4.36Å; I446-L450 WeakPolarHBondContact O-CB 3.29Å; I446-L450 PolarHBondContact O-N 3.3Å; L450-V452 VanDerWaalsContact C-N 3.29Å; L450-V452 PolarHBondContact O-N 3.09Å |
| 451 | A | 71.4 | Confident | 78.5 | Confident | 12 Ų | 12 | 22.3 Ų | 22.3 | 10% | 0.099 | 12% | 0.124 | C | C | . | . | H | α-helix | trans | -63.5 | -31.3 | 177 | 0 | 0 | 0 | 0 | 0 | 114.1 | V60 V278 S447 I449 | V60-A451 WeakPolarHBondContact CG2-O 3.4Å; V278-A451 HydrophobicContact CG2-CB 3.41Å; V278-A451 VanDerWaalsContact CG2-CB 3.41Å; S447-A451 PolarHBondContact O-N 3.44Å; I449-A451 PolarHBondContact O-N 2.97Å; I449-A451 VanDerWaalsContact O-N 3.16Å |
| 452 | V | 77.8 | Confident | 79.6 | Confident | 17 Ų | 17 | 23.1 Ų | 23.1 | 10% | 0.103 | 13% | 0.13 | C | C | . | . | H | α-helix | trans | -106.9 | -10.6 | -178.2 | -61.3 | 0 | 0 | 0 | 0 | 112.9 | L295 Y298 I299 I449 L450 W454 L455 | L295-V452 HydrophobicContact CB-CG1 4.48Å; L295-V452 HydrophobicContact CD1-CG1 4.32Å; L295-V452 HydrophobicContact CD2-CG1 4.26Å; L295-V452 HydrophobicContact CD2-CG2 4.45Å; Y298-V452 HydrophobicContact CD1-CG2 3.94Å; Y298-V452 HydrophobicContact CE1-CG2 3.68Å; I299-V452 HydrophobicContact CD1-CB 3.92Å; I299-V452 HydrophobicContact CD1-CG1 3.95Å; I299-V452 HydrophobicContact CG1-CB 4.09Å; I299-V452 HydrophobicContact CG1-CG1 4.49Å; I299-V452 HydrophobicContact CG1-CG2 4.35Å; I449-V452 VanDerWaalsContact O-CG2 3.24Å; I449-V452 WeakPolarHBondContact O-CG2 3.26Å; I449-V452 PolarHBondContact O-N 2.74Å; L450-V452 VanDerWaalsContact C-N 3.29Å; L450-V452 PolarHBondContact O-N 3.09Å; V452-W454 PolarHBondContact O-N 3.36Å; V452-L455 PolarHBondContact O-N 2.81Å; V452-L455 VanDerWaalsContact O-N 3.11Å |
| 453 | D | 81.3 | Confident | 80.9 | Confident | 5 Ų | 5 | 20.7 Ų | 20.7 | 3% | 0.027 | 11% | 0.113 | C | C | . | . | H | α-helix | trans | -58.4 | -34.2 | -175.3 | -174.2 | 60.3 | 0 | 0 | 0 | 112.9 | A426 V429 I449 L455 V456 D457 | A426-D453 WeakPolarHBondContact CA-OD2 3.47Å; A426-D453 WeakPolarHBondContact CB-OD2 3.17Å; V429-D453 HydrophobicContact CG2-CB 3.7Å; V429-D453 VanDerWaalsContact CG2-OD1 3.23Å; V429-D453 WeakPolarHBondContact CG2-OD1 3.36Å; V429-D453 WeakPolarHBondContact CG2-OD2 3.49Å; I449-D453 WeakPolarHBondContact O-CB 3.49Å; I449-D453 PolarHBondContact O-N 3.17Å; D453-L455 PolarHBondContact O-N 3.03Å; D453-V456 PolarHBondContact O-N 3.15Å; D453-D457 WeakPolarHBondContact O-CB 3.5Å; D453-D457 PolarHBondContact O-N 3.47Å |
| 454 | W | 74.1 | Confident | 82.2 | Confident | 83 Ų | 83 | 19.7 Ų | 19.7 | 31% | 0.314 | 11% | 0.107 | S | C | . | . | H | α-helix | trans | -51.6 | -31.8 | 177.6 | 74.3 | -90.6 | 0 | 0 | 0 | 112.8 | V57 V452 R458 | V57-W454 HydrophobicContact CG2-CD2 3.7Å; V57-W454 HydrophobicContact CG2-CE3 3.54Å; V57-W454 HydrophobicContact CG2-CG 4.44Å; V57-W454 HydrophobicContact CG2-CH2 3.89Å; V57-W454 HydrophobicContact CG2-CZ2 4.03Å; V57-W454 HydrophobicContact CG2-CZ3 3.64Å; V452-W454 PolarHBondContact O-N 3.36Å; W454-R458 WeakPolarHBondContact O-CD 3.43Å; W454-R458 WeakPolarHBondContact O-CG 3.4Å; W454-R458 PolarHBondContact O-NH1 3.34Å |
| 455 | L | 81.6 | Confident | 83.5 | Confident | 49 Ų | 49 | 16.8 Ų | 16.8 | 26% | 0.257 | 9% | 0.086 | S | C | . | . | H | α-helix | trans | -84.9 | -44.1 | 176.4 | -179.3 | 61.2 | 0 | 0 | 0 | 111.9 | I299 V452 D453 | I299-L455 HydrophobicContact CG2-CD2 3.87Å; V452-L455 PolarHBondContact O-N 2.81Å; V452-L455 VanDerWaalsContact O-N 3.11Å; D453-L455 PolarHBondContact O-N 3.03Å |
| 456 | V | 89.3 | Confident | 84.6 | Confident | 0 Ų | 0 | 16.4 Ų | 16.4 | 0% | 0 | 8% | 0.084 | C | C | . | . | H | α-helix | trans | -71.1 | -42.3 | -173.3 | -176.7 | 0 | 0 | 0 | 0 | 111.2 | I299 C302 F386 D453 R458 T459 C460 | I299-V456 HydrophobicContact CG1-CG2 4.28Å; I299-V456 HydrophobicContact CG2-CG2 4.45Å; C302-V456 HydrophobicContact CB-CG1 3.64Å; C302-V456 HydrophobicContact CB-CG2 4.45Å; F386-V456 HydrophobicContact CD2-CG1 3.68Å; F386-V456 HydrophobicContact CE2-CG1 4.31Å; D453-V456 PolarHBondContact O-N 3.15Å; V456-R458 PolarHBondContact O-N 3.07Å; V456-T459 WeakPolarHBondContact O-CA 3.44Å; V456-T459 PolarHBondContact O-N 3.14Å; V456-T459 PolarHBondContact O-OG1 2.91Å; V456-C460 PolarHBondContact O-N 3.13Å; V456-C460 PolarHBondContact O-SG 3.08Å |
| 457 | D | 86.3 | Confident | 85.6 | Confident | 17 Ų | 17 | 15.6 Ų | 15.6 | 9% | 0.091 | 8% | 0.08 | C | C | . | . | H | α-helix | trans | -57 | -32.4 | 179.7 | -173.3 | 48.3 | 0 | 0 | 0 | 113 | P425 A426 D453 C460 T461 | P425-D457 WeakPolarHBondContact CA-OD2 3.36Å; A426-D457 PolarHBondContact N-OD2 3.02Å; D453-D457 WeakPolarHBondContact O-CB 3.5Å; D453-D457 PolarHBondContact O-N 3.47Å; D457-C460 WeakPolarHBondContact O-CB 3.4Å; D457-C460 PolarHBondContact O-N 3.12Å; D457-T461 WeakPolarHBondContact O-CB 3.5Å; D457-T461 PolarHBondContact O-N 2.99Å; D457-T461 PolarHBondContact O-OG1 2.85Å |
| 458 | R | 86.5 | Confident | 86.7 | Confident | 21 Ų | 21 | 15.6 Ų | 15.6 | 8% | 0.079 | 8% | 0.079 | C | C | . | . | H | α-helix | trans | -61.1 | -46.6 | 173.3 | -70 | 172.4 | 152.5 | 63.2 | 26.5 | 111.9 | F341 S344 W454 V456 T461 V462 | F341-R458 HydrophobicContact CD2-CB 3.79Å; F341-R458 HydrophobicContact CE2-CB 3.72Å; F341-R458 HydrophobicContact CG-CB 4.37Å; F341-R458 HydrophobicContact CZ-CB 4.24Å; F341-R458 WeakPolarHBondContact O-CG 3.49Å; S344-R458 WeakPolarHBondContact OG-CG 3.29Å; W454-R458 WeakPolarHBondContact O-CD 3.43Å; W454-R458 WeakPolarHBondContact O-CG 3.4Å; W454-R458 PolarHBondContact O-NH1 3.34Å; V456-R458 PolarHBondContact O-N 3.07Å; R458-T461 PolarHBondContact O-N 3.25Å; R458-V462 WeakPolarHBondContact O-CG2 3.45Å; R458-V462 PolarHBondContact O-N 3.29Å |
| 459 | T | 92.3 | Very high | 87.6 | Confident | 25 Ų | 25 | 14.9 Ų | 14.9 | 15% | 0.153 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -72.2 | -32.5 | 177.7 | 59.2 | 0 | 0 | 0 | 0 | 111.9 | H306 F341 V456 V462 L463 | H306-T459 PolarHBondContact CE1-OG1 3.46Å; H306-T459 PolarHBondContact ND1-OG1 3.08Å; F341-T459 HydrophobicContact CE2-CG2 4.11Å; V456-T459 WeakPolarHBondContact O-CA 3.44Å; V456-T459 PolarHBondContact O-N 3.14Å; V456-T459 PolarHBondContact O-OG1 2.91Å; T459-V462 PolarHBondContact O-N 3.29Å; T459-L463 PolarHBondContact O-N 3.24Å |
| 460 | C | 92.9 | Very high | 88.2 | Confident | 3 Ų | 3 | 15 Ų | 15 | 2% | 0.02 | 8% | 0.076 | C | C | . | . | H | α-helix | trans | -59.7 | -48.8 | 170.7 | -64.8 | 0 | 0 | 0 | 0 | 111.2 | H306 G382 F386 V456 D457 V462 L463 N464 | H306-C460 PolarHBondContact CE1-SG 3.26Å; H306-C460 PolarHBondContact NE2-SG 3.33Å; G382-C460 PolarHBondContact O-SG 3.41Å; F386-C460 VanDerWaalsContact CB-SG 3.56Å; V456-C460 PolarHBondContact O-N 3.13Å; V456-C460 PolarHBondContact O-SG 3.08Å; D457-C460 WeakPolarHBondContact O-CB 3.4Å; D457-C460 PolarHBondContact O-N 3.12Å; C460-V462 VanDerWaalsContact C-N 3.33Å; C460-V462 PolarHBondContact O-N 3.43Å; C460-L463 PolarHBondContact O-N 2.81Å; C460-L463 VanDerWaalsContact O-N 3.12Å; C460-N464 PolarHBondContact O-N 3.08Å; C460-N464 PolarHBondContact O-OD1 2.75Å |
| 461 | T | 89.5 | Confident | 89.1 | Confident | 4 Ų | 4 | 14.5 Ų | 14.5 | 3% | 0.025 | 8% | 0.075 | C | C | . | . | H | α-helix | trans | -59.8 | -44.7 | -178.5 | -54.3 | 0 | 0 | 0 | 0 | 111.2 | A340 S344 D457 R458 L463 N464 V465 | A340-T461 HydrophobicContact CB-CG2 4.01Å; S344-T461 VanDerWaalsContact C-OG1 3.28Å; S344-T461 WeakPolarHBondContact CA-OG1 3.49Å; S344-T461 PolarHBondContact O-OG1 3.48Å; D457-T461 WeakPolarHBondContact O-CB 3.5Å; D457-T461 PolarHBondContact O-N 2.99Å; D457-T461 PolarHBondContact O-OG1 2.85Å; R458-T461 PolarHBondContact O-N 3.25Å; T461-L463 VanDerWaalsContact C-N 3.27Å; T461-L463 PolarHBondContact O-N 3.06Å; T461-N464 PolarHBondContact O-N 3.23Å; T461-V465 WeakPolarHBondContact O-CG2 3.46Å; T461-V465 PolarHBondContact O-N 3.23Å; T461-V465 VanDerWaalsContact O-N 3.15Å |
| 462 | V | 94.4 | Very high | 90.1 | Very high | 30 Ų | 30 | 14 Ų | 14 | 18% | 0.182 | 7% | 0.07 | C | C | . | . | H | α-helix | trans | -56.1 | -45.1 | 176.3 | 171.4 | 0 | 0 | 0 | 0 | 111 | L337 A340 F341 R458 T459 C460 V465 E466 | L337-V462 HydrophobicContact CB-CG1 4.33Å; L337-V462 HydrophobicContact CD2-CG1 4.31Å; A340-V462 HydrophobicContact CB-CG2 4.49Å; F341-V462 HydrophobicContact CB-CG2 3.61Å; F341-V462 HydrophobicContact CD2-CG2 4.08Å; F341-V462 HydrophobicContact CG-CG2 4.36Å; R458-V462 WeakPolarHBondContact O-CG2 3.45Å; R458-V462 PolarHBondContact O-N 3.29Å; T459-V462 PolarHBondContact O-N 3.29Å; C460-V462 VanDerWaalsContact C-N 3.33Å; C460-V462 PolarHBondContact O-N 3.43Å; V462-V465 VanDerWaalsContact O-CG2 3.22Å; V462-V465 WeakPolarHBondContact O-CG2 3.35Å; V462-E466 WeakPolarHBondContact O-CB 3.34Å; V462-E466 PolarHBondContact O-N 3.49Å |
| 463 | L | 95.6 | Very high | 90.8 | Very high | 3 Ų | 3 | 13.4 Ų | 13.4 | 2% | 0.016 | 7% | 0.068 | C | C | . | . | H | α-helix | trans | -68.3 | -43 | -177.7 | -145.3 | 163 | 0 | 0 | 0 | 111.7 | H306 H309 L314 D381 T459 C460 T461 V465 E466 G467 | H306-L463 VanDerWaalsContact CA-CD1 3.45Å; H306-L463 HydrophobicContact CB-CD1 3.74Å; H306-L463 WeakPolarHBondContact O-CD1 3.38Å; H309-L463 HydrophobicContact CB-CD1 4.18Å; H309-L463 WeakPolarHBondContact CD2-CD2 3.37Å; L314-L463 HydrophobicContact CD1-CD2 3.92Å; D381-L463 HydrophobicContact CB-CD2 3.65Å; T459-L463 PolarHBondContact O-N 3.24Å; C460-L463 PolarHBondContact O-N 2.81Å; C460-L463 VanDerWaalsContact O-N 3.12Å; T461-L463 VanDerWaalsContact C-N 3.27Å; T461-L463 PolarHBondContact O-N 3.06Å; L463-V465 PolarHBondContact O-N 3.39Å; L463-E466 WeakPolarHBondContact O-CB 3.45Å; L463-E466 PolarHBondContact O-N 3.16Å; L463-G467 PolarHBondContact O-N 3.32Å |
| 464 | N | 94.1 | Very high | 91.3 | Very high | 9 Ų | 9 | 13.6 Ų | 13.6 | 5% | 0.048 | 7% | 0.069 | C | C | . | . | H | α-helix | trans | -55.1 | -51.9 | 176.7 | -64.2 | -14.3 | 0 | 0 | 0 | 110.9 | M380 D381 G382 A383 C460 T461 E466 G467 D468 | M380-N464 VanDerWaalsContact CA-OD1 3.32Å; M380-N464 WeakPolarHBondContact CA-OD1 3.45Å; D381-N464 PolarHBondContact N-OD1 3.42Å; G382-N464 VanDerWaalsContact CA-OD1 3.3Å; G382-N464 WeakPolarHBondContact CA-OD1 3.02Å; G382-N464 PolarHBondContact N-OD1 3.37Å; A383-N464 PolarHBondContact N-OD1 3.39Å; C460-N464 PolarHBondContact O-N 3.08Å; C460-N464 PolarHBondContact O-OD1 2.75Å; T461-N464 PolarHBondContact O-N 3.23Å; N464-E466 VanDerWaalsContact C-N 3.33Å; N464-E466 PolarHBondContact O-N 3.36Å; N464-G467 PolarHBondContact O-N 3.06Å; N464-D468 PolarHBondContact O-N 2.82Å |
| 465 | V | 93.8 | Very high | 92.1 | Very high | 4 Ų | 4 | 10 Ų | 10 | 2% | 0.024 | 6% | 0.056 | C | C | . | . | H | α-helix | trans | -70.2 | -31 | -179.1 | -56.8 | 0 | 0 | 0 | 0 | 112.5 | L337 A340 T349 M353 T461 V462 L463 D468 A469 | L337-V465 HydrophobicContact CD2-CG2 3.72Å; A340-V465 HydrophobicContact CB-CG1 4.38Å; A340-V465 HydrophobicContact CB-CG2 3.69Å; T349-V465 WeakPolarHBondContact OG1-CG1 3.29Å; M353-V465 HydrophobicContact CE-CB 3.76Å; M353-V465 HydrophobicContact CE-CG2 3.84Å; M353-V465 VanDerWaalsContact CE-O 3.27Å; M353-V465 WeakPolarHBondContact CE-O 3.14Å; T461-V465 WeakPolarHBondContact O-CG2 3.46Å; T461-V465 PolarHBondContact O-N 3.23Å; T461-V465 VanDerWaalsContact O-N 3.15Å; V462-V465 VanDerWaalsContact O-CG2 3.22Å; V462-V465 WeakPolarHBondContact O-CG2 3.35Å; L463-V465 PolarHBondContact O-N 3.39Å; V465-D468 PolarHBondContact O-N 2.89Å; V465-A469 PolarHBondContact O-N 2.99Å; V465-A469 VanDerWaalsContact O-N 3.09Å |
| 466 | E | 96.7 | Very high | 92.5 | Very high | 11 Ų | 11 | 9 Ų | 9 | 5% | 0.051 | 5% | 0.05 | C | C | . | . | H | α-helix | trans | -63.6 | -44.6 | 174.6 | 178.3 | 175.4 | -154.5 | 0 | 0 | 111.3 | G310 L314 L330 L337 V462 L463 N464 D468 A469 F470 | G310-E466 WeakPolarHBondContact CA-OE2 3.3Å; G310-E466 VanDerWaalsContact O-OE1 3.09Å; L314-E466 HydrophobicContact CD1-CG 4.24Å; L330-E466 HydrophobicContact CD2-CG 4Å; L330-E466 WeakPolarHBondContact CD2-OE1 2.95Å; L337-E466 HydrophobicContact CD2-CB 3.99Å; V462-E466 WeakPolarHBondContact O-CB 3.34Å; V462-E466 PolarHBondContact O-N 3.49Å; L463-E466 WeakPolarHBondContact O-CB 3.45Å; L463-E466 PolarHBondContact O-N 3.16Å; N464-E466 VanDerWaalsContact C-N 3.33Å; N464-E466 PolarHBondContact O-N 3.36Å; E466-D468 VanDerWaalsContact C-N 3.33Å; E466-D468 PolarHBondContact O-N 2.9Å; E466-A469 PolarHBondContact O-N 2.77Å; E466-F470 HydrophobicContact CG-CD2 3.74Å; E466-F470 HydrophobicContact CG-CE2 3.63Å; E466-F470 WeakPolarHBondContact O-CD2 3.41Å; E466-F470 PolarHBondContact O-N 2.97Å |
| 467 | G | 95.3 | Very high | 92.5 | Very high | 0 Ų | 0 | 11.3 Ų | 11.3 | 0% | 0 | 6% | 0.061 | C | C | . | . | H | α-helix | trans | -56.9 | -45.2 | 174.2 | 0 | 0 | 0 | 0 | 0 | 112.1 | L463 N464 A469 F470 G471 | L463-G467 PolarHBondContact O-N 3.32Å; N464-G467 PolarHBondContact O-N 3.06Å; G467-A469 PolarHBondContact O-N 2.99Å; G467-F470 PolarHBondContact O-N 3.2Å; G467-G471 PolarHBondContact O-N 3.08Å |
| 468 | D | 93.8 | Very high | 92.6 | Very high | 5 Ų | 5 | 12.9 Ų | 12.9 | 3% | 0.027 | 7% | 0.067 | C | C | . | . | H | α-helix | trans | -61.6 | -44.5 | 178.1 | -60.8 | -18.6 | 0 | 0 | 0 | 112.2 | L372 G375 A376 N379 N464 V465 E466 G471 A472 | L372-D468 HydrophobicContact CD2-CB 3.81Å; L372-D468 WeakPolarHBondContact CD2-O 3.14Å; G375-D468 VanDerWaalsContact C-CG 3.45Å; G375-D468 VanDerWaalsContact C-OD1 3.26Å; G375-D468 VanDerWaalsContact CA-OD1 3.22Å; G375-D468 WeakPolarHBondContact CA-OD1 3.2Å; A376-D468 PolarHBondContact N-OD2 2.83Å; A376-D468 VanDerWaalsContact N-OD2 3.15Å; N379-D468 VanDerWaalsContact CB-OD1 3.32Å; N379-D468 WeakPolarHBondContact CB-OD1 3.36Å; N379-D468 PolarHBondContact ND2-N 2.81Å; N379-D468 PolarHBondContact ND2-OD1 2.96Å; N464-D468 PolarHBondContact O-N 2.82Å; V465-D468 PolarHBondContact O-N 2.89Å; E466-D468 VanDerWaalsContact C-N 3.33Å; E466-D468 PolarHBondContact O-N 2.9Å; D468-G471 PolarHBondContact O-N 2.91Å; D468-A472 PolarHBondContact O-N 3.41Å |
| 469 | A | 94.9 | Very high | 92.5 | Very high | 0 Ų | 0 | 13.7 Ų | 13.7 | 0% | 0 | 7% | 0.074 | C | C | . | . | H | α-helix | trans | -65.4 | -43.3 | 179.7 | 0 | 0 | 0 | 0 | 0 | 111.7 | F329 I333 M353 V357 V465 E466 G467 G471 A472 G473 | F329-A469 HydrophobicContact CE1-CB 4.11Å; F329-A469 WeakPolarHBondContact CE1-O 3.29Å; F329-A469 WeakPolarHBondContact CZ-O 3.2Å; I333-A469 HydrophobicContact CD1-CB 3.47Å; I333-A469 VanDerWaalsContact CD1-CB 3.47Å; M353-A469 HydrophobicContact CE-CB 3.87Å; M353-A469 HydrophobicContact SD-CB 3.85Å; V357-A469 HydrophobicContact CG2-CB 4.11Å; V465-A469 PolarHBondContact O-N 2.99Å; V465-A469 VanDerWaalsContact O-N 3.09Å; E466-A469 PolarHBondContact O-N 2.77Å; G467-A469 PolarHBondContact O-N 2.99Å; A469-G471 VanDerWaalsContact C-N 3.34Å; A469-A472 PolarHBondContact O-N 3.34Å; A469-G473 PolarHBondContact O-N 2.99Å |
| 470 | F | 95.9 | Very high | 92.2 | Very high | 2 Ų | 2 | 15.5 Ų | 15.5 | 1% | 0.009 | 8% | 0.083 | C | C | . | . | H | α-helix | trans | -63.7 | -40 | 173.4 | -83.2 | -57.7 | 0 | 0 | 0 | 112.1 | F128 L314 P315 Y318 P326 F329 L330 E466 G467 A472 G473 L474 | F128-F470 HydrophobicContact CZ-CB 4.44Å; L314-F470 HydrophobicContact CB-CD2 3.81Å; L314-F470 HydrophobicContact CB-CE2 3.94Å; L314-F470 HydrophobicContact CD1-CD2 4.32Å; P315-F470 HydrophobicContact CG-CE2 4.24Å; P315-F470 HydrophobicContact CG-CZ 3.95Å; Y318-F470 HydrophobicContact CD1-CE1 4.35Å; Y318-F470 AromaticContact CD2-CD1 3.58Å; Y318-F470 HydrophobicContact CD2-CD1 3.58Å; Y318-F470 HydrophobicContact CD2-CE1 4.19Å; Y318-F470 HydrophobicContact CE2-CD1 4.27Å; Y318-F470 AromaticContact CG-CD1 3.71Å; Y318-F470 HydrophobicContact CG-CD1 3.71Å; Y318-F470 AromaticContact CG-CE1 3.91Å; Y318-F470 HydrophobicContact CG-CE1 3.91Å; P326-F470 HydrophobicContact CB-CE1 4.06Å; P326-F470 HydrophobicContact CB-CZ 4.35Å; F329-F470 HydrophobicContact CD1-CD1 4.04Å; F329-F470 AromaticContact CD1-CE1 3.97Å; F329-F470 HydrophobicContact CD1-CE1 3.97Å; F329-F470 HydrophobicContact CE1-CD1 4.28Å; L330-F470 HydrophobicContact CD1-CE2 4.41Å; L330-F470 HydrophobicContact CD1-CZ 3.9Å; L330-F470 HydrophobicContact CD2-CE2 3.65Å; L330-F470 HydrophobicContact CD2-CZ 3.61Å; L330-F470 HydrophobicContact CG-CE1 4.44Å; L330-F470 HydrophobicContact CG-CE2 4.13Å; L330-F470 HydrophobicContact CG-CZ 3.57Å; E466-F470 HydrophobicContact CG-CD2 3.74Å; E466-F470 HydrophobicContact CG-CE2 3.63Å; E466-F470 WeakPolarHBondContact O-CD2 3.41Å; E466-F470 PolarHBondContact O-N 2.97Å; G467-F470 PolarHBondContact O-N 3.2Å; F470-A472 PolarHBondContact O-N 3.26Å; F470-G473 PolarHBondContact O-N 3.48Å; F470-L474 VanDerWaalsContact O-CB 3.27Å; F470-L474 WeakPolarHBondContact O-CB 3.46Å; F470-L474 PolarHBondContact O-N 3.17Å |
| 471 | G | 93.4 | Very high | 91.7 | Very high | 5 Ų | 5 | 21.9 Ų | 21.9 | 5% | 0.052 | 11% | 0.11 | C | C | . | . | H | α-helix | trans | -56.3 | -48.7 | 173.4 | 0 | 0 | 0 | 0 | 0 | 111.7 | G467 D468 A469 G473 L474 L475 | G467-G471 PolarHBondContact O-N 3.08Å; D468-G471 PolarHBondContact O-N 2.91Å; A469-G471 VanDerWaalsContact C-N 3.34Å; G471-G473 PolarHBondContact O-N 3.16Å; G471-L474 PolarHBondContact O-N 3.3Å; G471-L475 VanDerWaalsContact O-CB 3.26Å; G471-L475 WeakPolarHBondContact O-CB 3.48Å; G471-L475 PolarHBondContact O-N 2.82Å |
| 472 | A | 92.3 | Very high | 91.1 | Very high | 0 Ų | 0 | 25.3 Ų | 25.3 | 0% | 0 | 13% | 0.131 | C | C | . | . | H | α-helix | trans | -61 | -42.7 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.6 | V357 V363 I371 L372 D468 A469 F470 Q476 | V357-A472 HydrophobicContact CG1-CB 4.34Å; V363-A472 HydrophobicContact CG1-CB 4.44Å; I371-A472 HydrophobicContact CG2-CB 4.47Å; L372-A472 HydrophobicContact CD2-CB 4.02Å; L372-A472 HydrophobicContact CG-CB 4.37Å; D468-A472 PolarHBondContact O-N 3.41Å; A469-A472 PolarHBondContact O-N 3.34Å; F470-A472 PolarHBondContact O-N 3.26Å; A472-Q476 PolarHBondContact O-N 3.32Å |
| 473 | G | 93 | Very high | 90.1 | Very high | 5 Ų | 5 | 27 Ų | 27 | 5% | 0.052 | 15% | 0.145 | C | C | . | . | H | α-helix | trans | -68.3 | -38.7 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.7 | A469 F470 G471 H477 | A469-G473 PolarHBondContact O-N 2.99Å; F470-G473 PolarHBondContact O-N 3.48Å; G471-G473 PolarHBondContact O-N 3.16Å; G473-H477 PolarHBondContact O-N 3.07Å |
| 474 | L | 92.8 | Very high | 88.8 | Confident | 10 Ų | 10 | 34.2 Ų | 34.2 | 5% | 0.052 | 18% | 0.176 | C | C | . | . | H | α-helix | trans | -65 | -44 | 175.9 | -172.8 | 68.8 | 0 | 0 | 0 | 110.7 | F128 F321 T322 F470 G471 H477 F478 | F128-L474 HydrophobicContact CD2-CD2 3.43Å; F128-L474 VanDerWaalsContact CD2-CD2 3.43Å; F128-L474 HydrophobicContact CE2-CD2 3.7Å; F128-L474 HydrophobicContact CG-CD2 4.17Å; F321-L474 HydrophobicContact CB-CD1 3.31Å; F321-L474 HydrophobicContact CD2-CD1 4.14Å; F321-L474 HydrophobicContact CG-CD1 3.95Å; T322-L474 HydrophobicContact CG2-CD1 3.84Å; F470-L474 VanDerWaalsContact O-CB 3.27Å; F470-L474 WeakPolarHBondContact O-CB 3.46Å; F470-L474 PolarHBondContact O-N 3.17Å; G471-L474 PolarHBondContact O-N 3.3Å; L474-H477 WeakPolarHBondContact O-CB 3.5Å; L474-H477 PolarHBondContact O-N 3.49Å; L474-H477 VanDerWaalsContact O-N 3.13Å; L474-F478 HydrophobicContact CD1-CE2 4.16Å; L474-F478 HydrophobicContact CD2-CE2 3.98Å; L474-F478 HydrophobicContact CG-CD2 4.09Å; L474-F478 HydrophobicContact CG-CE2 3.69Å; L474-F478 WeakPolarHBondContact O-CD2 3.37Å; L474-F478 PolarHBondContact O-N 3.43Å; L474-F478 VanDerWaalsContact O-N 3.13Å |
| 475 | L | 89.8 | Confident | 87.2 | Confident | 7 Ų | 7 | 39.4 Ų | 39.4 | 4% | 0.037 | 20% | 0.2 | C | C | . | . | H | α-helix | trans | -67.6 | -38.5 | -177.9 | -154.2 | 66.7 | 0 | 0 | 0 | 111.9 | L121 W124 A125 I367 I371 G471 H477 F478 V479 | L121-L475 HydrophobicContact CD1-CD1 3.68Å; L121-L475 HydrophobicContact CD1-CD2 4.01Å; L121-L475 HydrophobicContact CD1-CG 3.52Å; L121-L475 HydrophobicContact CD2-CD2 4.39Å; L121-L475 HydrophobicContact CG-CD1 4.25Å; L121-L475 HydrophobicContact CG-CD2 3.79Å; L121-L475 HydrophobicContact CG-CG 3.91Å; L121-L475 WeakPolarHBondContact O-CD1 3.38Å; W124-L475 HydrophobicContact CB-CD1 4Å; A125-L475 HydrophobicContact CB-CD1 4.38Å; A125-L475 HydrophobicContact CB-CD2 3.89Å; I367-L475 HydrophobicContact CG2-CB 4.22Å; I367-L475 HydrophobicContact CG2-CD2 4.27Å; I371-L475 HydrophobicContact CD1-CD2 3.53Å; I371-L475 HydrophobicContact CG1-CD2 3.51Å; G471-L475 VanDerWaalsContact O-CB 3.26Å; G471-L475 WeakPolarHBondContact O-CB 3.48Å; G471-L475 PolarHBondContact O-N 2.82Å; L475-H477 VanDerWaalsContact C-N 3.27Å; L475-H477 PolarHBondContact O-N 3.44Å; L475-F478 PolarHBondContact O-N 3.26Å; L475-F478 VanDerWaalsContact O-N 3.14Å; L475-V479 WeakPolarHBondContact O-CG2 3.26Å; L475-V479 PolarHBondContact O-N 2.85Å |
| 476 | Q | 90.4 | Very high | 85.6 | Confident | 28 Ų | 28 | 44.7 Ų | 44.7 | 13% | 0.131 | 22% | 0.224 | C | C | . | . | H | α-helix | trans | -54.4 | -44.8 | 169.8 | -178.5 | 66.7 | 55.6 | 0 | 0 | 111.7 | V363 S364 I367 A472 F478 V479 D480 | V363-Q476 HydrophobicContact CG1-CB 4.34Å; V363-Q476 HydrophobicContact CG2-CB 4.49Å; S364-Q476 VanDerWaalsContact CB-OE1 3.23Å; S364-Q476 PolarHBondContact OG-OE1 3.35Å; I367-Q476 HydrophobicContact CD1-CB 4.12Å; A472-Q476 PolarHBondContact O-N 3.32Å; Q476-F478 VanDerWaalsContact C-N 3.33Å; Q476-F478 PolarHBondContact O-N 3.29Å; Q476-V479 PolarHBondContact O-N 3.46Å; Q476-D480 PolarHBondContact NE2-OD1 3.45Å; Q476-D480 PolarHBondContact O-N 2.88Å |
| 477 | H | 89.8 | Confident | 83.7 | Confident | 49 Ų | 49 | 45.3 Ų | 45.3 | 23% | 0.227 | 23% | 0.234 | C | C | . | . | H | α-helix | trans | -63.2 | -38.6 | 178.4 | -174.6 | 69.4 | 0 | 0 | 0 | 112.6 | F321 T322 G473 L474 L475 K481 | F321-H477 PolarHBondContact O-CD2 2.98Å; F321-H477 PolarHBondContact O-NE2 2.92Å; T322-H477 HydrophobicContact CG2-CB 3.84Å; G473-H477 PolarHBondContact O-N 3.07Å; L474-H477 WeakPolarHBondContact O-CB 3.5Å; L474-H477 PolarHBondContact O-N 3.49Å; L474-H477 VanDerWaalsContact O-N 3.13Å; L475-H477 VanDerWaalsContact C-N 3.27Å; L475-H477 PolarHBondContact O-N 3.44Å; H477-K481 WeakPolarHBondContact O-CB 3.14Å; H477-K481 PolarHBondContact O-N 2.86Å |
| 478 | F | 87.2 | Confident | 81.9 | Confident | 49 Ų | 49 | 49.8 Ų | 49.8 | 22% | 0.215 | 26% | 0.261 | C | S | . | . | H | α-helix | trans | -65.8 | -39.4 | 175.7 | -77.4 | -59.3 | 0 | 0 | 0 | 112.8 | F321 L474 L475 Q476 T482 | F321-F478 AromaticContact CD1-CZ 3.84Å; F321-F478 HydrophobicContact CD1-CZ 3.84Å; F321-F478 HydrophobicContact CE1-CZ 4.32Å; F321-F478 HydrophobicContact CG-CZ 4.36Å; L474-F478 HydrophobicContact CD1-CE2 4.16Å; L474-F478 HydrophobicContact CD2-CE2 3.98Å; L474-F478 HydrophobicContact CG-CD2 4.09Å; L474-F478 HydrophobicContact CG-CE2 3.69Å; L474-F478 WeakPolarHBondContact O-CD2 3.37Å; L474-F478 PolarHBondContact O-N 3.43Å; L474-F478 VanDerWaalsContact O-N 3.13Å; L475-F478 PolarHBondContact O-N 3.26Å; L475-F478 VanDerWaalsContact O-N 3.14Å; Q476-F478 VanDerWaalsContact C-N 3.33Å; Q476-F478 PolarHBondContact O-N 3.29Å; F478-T482 PolarHBondContact O-N 2.75Å; F478-T482 PolarHBondContact O-OG1 3.23Å |
| 479 | V | 85.1 | Confident | 80 | Confident | 39 Ų | 39 | 54.3 Ų | 54.3 | 24% | 0.236 | 28% | 0.282 | C | S | . | . | H | α-helix | trans | -63.7 | -51.4 | 174.2 | 179.1 | 0 | 0 | 0 | 0 | 110.3 | L121 I367 L475 Q476 K481 T482 S483 | L121-V479 HydrophobicContact CD1-CG2 3.31Å; L121-V479 HydrophobicContact CD2-CG2 3.72Å; L121-V479 HydrophobicContact CG-CG2 4.16Å; I367-V479 HydrophobicContact CD1-CB 4.24Å; I367-V479 HydrophobicContact CD1-CG2 3.71Å; L475-V479 WeakPolarHBondContact O-CG2 3.26Å; L475-V479 PolarHBondContact O-N 2.85Å; Q476-V479 PolarHBondContact O-N 3.46Å; V479-K481 PolarHBondContact O-N 2.82Å; V479-T482 PolarHBondContact O-N 2.85Å; V479-S483 PolarHBondContact O-N 3.19Å; V479-S483 PolarHBondContact O-OG 3.09Å |
| 480 | D | 85.3 | Confident | 77.9 | Confident | 63 Ų | 63 | 60.6 Ų | 60.6 | 34% | 0.337 | 31% | 0.311 | S | S | . | . | H | α-helix | trans | -57.9 | -36 | -178.4 | -67.4 | -14.2 | 0 | 0 | 0 | 112.2 | Q476 K484 | Q476-D480 PolarHBondContact NE2-OD1 3.45Å; Q476-D480 PolarHBondContact O-N 2.88Å; D480-K484 WeakPolarHBondContact O-CB 3.46Å; D480-K484 VanDerWaalsContact O-CG 3.28Å; D480-K484 WeakPolarHBondContact O-CG 3.16Å; D480-K484 PolarHBondContact O-N 2.99Å |
| 481 | K | 82.1 | Confident | 76 | Confident | 136 Ų | 136 | 66.3 Ų | 66.3 | 59% | 0.591 | 34% | 0.341 | S | S | * | . | H | α-helix | trans | -72.2 | -41.8 | 177.7 | -170.7 | 178 | 178.5 | -177.1 | 0 | 112 | H477 V479 K484 H485 | H477-K481 WeakPolarHBondContact O-CB 3.14Å; H477-K481 PolarHBondContact O-N 2.86Å; V479-K481 PolarHBondContact O-N 2.82Å; K481-K484 PolarHBondContact O-N 3.17Å; K481-H485 PolarHBondContact O-N 2.81Å; K481-H485 VanDerWaalsContact O-N 3.15Å |
| 482 | T | 78 | Confident | 73.9 | Confident | 76 Ų | 76 | 68.7 Ų | 68.7 | 47% | 0.466 | 36% | 0.357 | S | S | . | . | H | α-helix | trans | -64.7 | -47.7 | 177.9 | -50.3 | 0 | 0 | 0 | 0 | 110.7 | F478 V479 K484 H485 E486 | F478-T482 PolarHBondContact O-N 2.75Å; F478-T482 PolarHBondContact O-OG1 3.23Å; V479-T482 PolarHBondContact O-N 2.85Å; T482-K484 VanDerWaalsContact C-N 3.28Å; T482-K484 PolarHBondContact O-N 3.41Å; T482-H485 WeakPolarHBondContact O-CB 3.31Å; T482-H485 PolarHBondContact O-N 3.35Å; T482-E486 PolarHBondContact O-N 2.7Å |
| 483 | S | 72.3 | Confident | 72 | Confident | 67 Ų | 67 | 74.9 Ų | 74.9 | 47% | 0.469 | 39% | 0.386 | S | S | . | . | H | α-helix | trans | -63.4 | -31.6 | 178.2 | -57 | 0 | 0 | 0 | 0 | 113.2 | V479 G487 | V479-S483 PolarHBondContact O-N 3.19Å; V479-S483 PolarHBondContact O-OG 3.09Å; S483-G487 PolarHBondContact O-N 3.15Å |
| 484 | K | 68.9 | Low | 70 | Confident | 153 Ų | 153 | 79.5 Ų | 79.5 | 67% | 0.665 | 41% | 0.413 | S | S | * | . | H | α-helix | trans | -69.6 | -32.6 | 171.7 | -80 | 179.1 | -179.1 | -176 | 0 | 112.9 | D480 K481 T482 V488 | D480-K484 WeakPolarHBondContact O-CB 3.46Å; D480-K484 VanDerWaalsContact O-CG 3.28Å; D480-K484 WeakPolarHBondContact O-CG 3.16Å; D480-K484 PolarHBondContact O-N 2.99Å; K481-K484 PolarHBondContact O-N 3.17Å; T482-K484 VanDerWaalsContact C-N 3.28Å; T482-K484 PolarHBondContact O-N 3.41Å; K484-V488 WeakPolarHBondContact O-CB 3.32Å; K484-V488 WeakPolarHBondContact O-CG2 3.46Å; K484-V488 PolarHBondContact O-N 3.34Å; K484-V488 VanDerWaalsContact O-N 3.15Å |
| 485 | H | 61.3 | Low | 67.9 | Low | 119 Ų | 119 | 88.2 Ų | 88.2 | 55% | 0.551 | 45% | 0.445 | S | S | * | . | H | α-helix | trans | -73.4 | -45 | 178.1 | -146.5 | -73.1 | 0 | 0 | 0 | 110.8 | K481 T482 V488 E489 | K481-H485 PolarHBondContact O-N 2.81Å; K481-H485 VanDerWaalsContact O-N 3.15Å; T482-H485 WeakPolarHBondContact O-CB 3.31Å; T482-H485 PolarHBondContact O-N 3.35Å; H485-V488 PolarHBondContact O-N 2.76Å; H485-E489 IonicContact CE1-OE1 2.7Å; H485-E489 PolarHBondContact CE1-OE1 2.85Å; H485-E489 VanDerWaalsContact CE1-OE1 3.29Å; H485-E489 IonicContact ND1-OE1 2.66Å; H485-E489 PolarHBondContact ND1-OE1 3.47Å; H485-E489 PolarHBondContact O-N 2.92Å |
| 486 | E | 60.1 | Low | 65.9 | Low | 114 Ų | 114 | 94.6 Ų | 94.6 | 53% | 0.533 | 48% | 0.476 | S | S | . | . | H | α-helix | trans | -62.6 | -44 | 175.7 | -71.2 | 173.9 | 167.3 | 0 | 0 | 111.5 | T482 V488 E489 E490 | T482-E486 PolarHBondContact O-N 2.7Å; E486-V488 VanDerWaalsContact C-N 3.3Å; E486-V488 PolarHBondContact O-N 2.78Å; E486-E489 PolarHBondContact O-N 2.57Å; E486-E490 PolarHBondContact O-N 2.9Å |
| 487 | G | 55.3 | Low | 63.9 | Low | 25 Ų | 25 | 99.7 Ų | 99.7 | 26% | 0.258 | 50% | 0.504 | S | S | . | . | H | α-helix | trans | -66.9 | -28 | 175.8 | 0 | 0 | 0 | 0 | 0 | 114 | S483 L491 | S483-G487 PolarHBondContact O-N 3.15Å; G487-L491 VanDerWaalsContact O-CB 3.28Å; G487-L491 WeakPolarHBondContact O-CB 3.49Å; G487-L491 VanDerWaalsContact O-CD1 3.27Å; G487-L491 WeakPolarHBondContact O-CD1 3.24Å; G487-L491 WeakPolarHBondContact O-CG 3.2Å; G487-L491 PolarHBondContact O-N 2.81Å; G487-L491 VanDerWaalsContact O-N 3.08Å |
| 488 | V | 58.8 | Low | 61.7 | Low | 94 Ų | 94 | 99.6 Ų | 99.6 | 57% | 0.57 | 52% | 0.517 | S | S | * | . | H | α-helix | trans | -76.7 | -35.9 | 173.3 | 169.3 | 0 | 0 | 0 | 0 | 111.1 | K484 H485 E486 S492 | K484-V488 WeakPolarHBondContact O-CB 3.32Å; K484-V488 WeakPolarHBondContact O-CG2 3.46Å; K484-V488 PolarHBondContact O-N 3.34Å; K484-V488 VanDerWaalsContact O-N 3.15Å; H485-V488 PolarHBondContact O-N 2.76Å; E486-V488 VanDerWaalsContact C-N 3.3Å; E486-V488 PolarHBondContact O-N 2.78Å; V488-S492 VanDerWaalsContact O-CB 3.26Å; V488-S492 WeakPolarHBondContact O-CB 3.3Å; V488-S492 PolarHBondContact O-N 3.14Å; V488-S492 PolarHBondContact O-OG 2.89Å |
| 489 | E | 52.5 | Low | 59.6 | Low | 100 Ų | 100 | 104.1 Ų | 104.1 | 47% | 0.467 | 54% | 0.543 | S | S | . | . | H | α-helix | trans | -64.6 | -48.5 | 173 | -78.8 | 173.4 | -163.6 | 0 | 0 | 111 | H485 E486 L491 S492 E493 | H485-E489 IonicContact CE1-OE1 2.7Å; H485-E489 PolarHBondContact CE1-OE1 2.85Å; H485-E489 VanDerWaalsContact CE1-OE1 3.29Å; H485-E489 IonicContact ND1-OE1 2.66Å; H485-E489 PolarHBondContact ND1-OE1 3.47Å; H485-E489 PolarHBondContact O-N 2.92Å; E486-E489 PolarHBondContact O-N 2.57Å; E489-L491 PolarHBondContact O-N 3.04Å; E489-S492 WeakPolarHBondContact CA-OG 3.48Å; E489-S492 CarbonylContact O-C 3.58Å; E489-S492 PolarHBondContact O-N 2.86Å; E489-S492 PolarHBondContact O-OG 2.8Å; E489-E493 PolarHBondContact O-N 3.04Å |
| 490 | E | 52.8 | Low | 57.5 | Low | 132 Ų | 132 | 106.4 Ų | 106.4 | 62% | 0.617 | 57% | 0.566 | S | S | * | * | H | α-helix | trans | -60.4 | -42.6 | 174.4 | -74.9 | -176.5 | 168.4 | 0 | 0 | 112.3 | E486 S492 E493 V494 | E486-E490 PolarHBondContact O-N 2.9Å; E490-S492 VanDerWaalsContact C-N 3.27Å; E490-S492 PolarHBondContact O-N 3.42Å; E490-E493 PolarHBondContact O-N 2.53Å; E490-V494 WeakPolarHBondContact O-CB 3.48Å; E490-V494 WeakPolarHBondContact O-CG2 3.4Å; E490-V494 PolarHBondContact O-N 2.77Å |
| 491 | L | 54.6 | Low | 55.2 | Low | 121 Ų | 121 | 107.1 Ų | 107.1 | 63% | 0.634 | 58% | 0.581 | S | S | * | * | H | α-helix | trans | -67.4 | -26.9 | 175.3 | -77.3 | 165.7 | 0 | 0 | 0 | 112.9 | G487 E489 R495 | G487-L491 VanDerWaalsContact O-CB 3.28Å; G487-L491 WeakPolarHBondContact O-CB 3.49Å; G487-L491 VanDerWaalsContact O-CD1 3.27Å; G487-L491 WeakPolarHBondContact O-CD1 3.24Å; G487-L491 WeakPolarHBondContact O-CG 3.2Å; G487-L491 PolarHBondContact O-N 2.81Å; G487-L491 VanDerWaalsContact O-N 3.08Å; E489-L491 PolarHBondContact O-N 3.04Å; L491-R495 WeakPolarHBondContact O-CB 3.43Å; L491-R495 PolarHBondContact O-N 3.06Å |
| 492 | S | 49.6 | Very low | 53 | Low | 56 Ų | 56 | 104.8 Ų | 104.8 | 39% | 0.392 | 59% | 0.587 | S | S | . | * | H | α-helix | trans | -80 | -37.7 | 175.6 | 74.1 | 0 | 0 | 0 | 0 | 112.3 | V488 E489 E490 R495 M496 | V488-S492 VanDerWaalsContact O-CB 3.26Å; V488-S492 WeakPolarHBondContact O-CB 3.3Å; V488-S492 PolarHBondContact O-N 3.14Å; V488-S492 PolarHBondContact O-OG 2.89Å; E489-S492 WeakPolarHBondContact CA-OG 3.48Å; E489-S492 CarbonylContact O-C 3.58Å; E489-S492 PolarHBondContact O-N 2.86Å; E489-S492 PolarHBondContact O-OG 2.8Å; E490-S492 VanDerWaalsContact C-N 3.27Å; E490-S492 PolarHBondContact O-N 3.42Å; S492-R495 PolarHBondContact O-N 2.94Å; S492-M496 WeakPolarHBondContact O-CG 3.42Å; S492-M496 PolarHBondContact O-N 2.87Å |
| 493 | E | 51.9 | Low | 51.2 | Low | 130 Ų | 130 | 106.2 Ų | 106.2 | 61% | 0.607 | 61% | 0.607 | S | S | * | * | H | α-helix | trans | -64.4 | -44.6 | 172 | -76.3 | -174.6 | 161.8 | 0 | 0 | 110.8 | E489 E490 R495 M496 D497 | E489-E493 PolarHBondContact O-N 3.04Å; E490-E493 PolarHBondContact O-N 2.53Å; E493-R495 VanDerWaalsContact C-N 3.27Å; E493-R495 PolarHBondContact O-N 2.96Å; E493-M496 PolarHBondContact O-N 3.45Å; E493-M496 VanDerWaalsContact O-N 3.1Å; E493-D497 PolarHBondContact O-N 3.35Å |
| 494 | V | 52 | Low | 49.4 | Very low | 101 Ų | 101 | 111 Ų | 111 | 61% | 0.612 | 62% | 0.624 | S | S | * | * | H | α-helix | trans | -63.8 | -31.4 | 174.9 | 174.2 | 0 | 0 | 0 | 0 | 112.1 | E490 G498 | E490-V494 WeakPolarHBondContact O-CB 3.48Å; E490-V494 WeakPolarHBondContact O-CG2 3.4Å; E490-V494 PolarHBondContact O-N 2.77Å; V494-G498 PolarHBondContact O-N 2.85Å |
| 495 | R | 47.5 | Very low | 47.9 | Very low | 193 Ų | 193 | 109.2 Ų | 109.2 | 73% | 0.728 | 63% | 0.627 | S | S | * | * | H | α-helix | trans | -72.9 | -37.2 | 171.7 | -92.2 | -179.3 | 168.6 | 172 | -2.6 | 112.8 | L491 S492 E493 G498 D499 | L491-R495 WeakPolarHBondContact O-CB 3.43Å; L491-R495 PolarHBondContact O-N 3.06Å; S492-R495 PolarHBondContact O-N 2.94Å; E493-R495 VanDerWaalsContact C-N 3.27Å; E493-R495 PolarHBondContact O-N 2.96Å; R495-G498 PolarHBondContact O-N 2.98Å; R495-D499 WeakPolarHBondContact O-CB 3.43Å; R495-D499 PolarHBondContact O-N 3.33Å |
| 496 | M | 48.9 | Very low | 46.7 | Very low | 142 Ų | 142 | 113 Ų | 113 | 70% | 0.7 | 65% | 0.645 | S | S | * | * | H | α-helix | trans | -68.9 | -36 | 177.1 | -64.6 | -115.5 | 68.6 | 0 | 0 | 111.6 | S492 E493 | S492-M496 WeakPolarHBondContact O-CG 3.42Å; S492-M496 PolarHBondContact O-N 2.87Å; E493-M496 PolarHBondContact O-N 3.45Å; E493-M496 VanDerWaalsContact O-N 3.1Å |
| 497 | D | 48.2 | Very low | 45.6 | Very low | 134 Ų | 134 | 116.1 Ų | 116.1 | 72% | 0.717 | 66% | 0.66 | S | S | * | * | H | α-helix | trans | -76.4 | -25.8 | 172.9 | -75.5 | -22.4 | 0 | 0 | 0 | 112.6 | E493 | E493-D497 PolarHBondContact O-N 3.35Å |
| 498 | G | 43.9 | Very low | 45.1 | Very low | 47 Ų | 47 | 119.1 Ų | 119.1 | 49% | 0.485 | 68% | 0.676 | S | S | . | * | H | α-helix | trans | -79.7 | -24.2 | 176.6 | 0 | 0 | 0 | 0 | 0 | 115.2 | V494 R495 | V494-G498 PolarHBondContact O-N 2.85Å; R495-G498 PolarHBondContact O-N 2.98Å |
| 499 | D | 43.1 | Very low | 44.2 | Very low | 145 Ų | 145 | 120.7 Ų | 120.7 | 78% | 0.775 | 69% | 0.688 | S | S | * | * | S | Bend | trans | -91.4 | -3.8 | -179 | -83.2 | -21.5 | 0 | 0 | 0 | 113.8 | R495 | R495-D499 WeakPolarHBondContact O-CB 3.43Å; R495-D499 PolarHBondContact O-N 3.33Å |
| 500 | A | 40.9 | Very low | 43.7 | Very low | 87 Ų | 87 | 123.3 Ų | 123.3 | 72% | 0.719 | 71% | 0.705 | S | S | * | * | S | Bend | trans | -96.7 | -5.5 | 176.5 | 0 | 0 | 0 | 0 | 0 | 114.5 | ||
| 501 | A | 36.7 | Very low | 43.3 | Very low | 77 Ų | 77 | 124 Ų | 124 | 64% | 0.636 | 71% | 0.711 | S | S | * | * | S | Bend | trans | -104.2 | 99.1 | 173.4 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||
| 502 | A | 36.2 | Very low | 42.5 | Very low | 87 Ų | 87 | 126 Ų | 126 | 72% | 0.719 | 72% | 0.722 | S | S | * | * | trans | -41.4 | 137.3 | 177.7 | 0 | 0 | 0 | 0 | 0 | 113.7 | M504 | A502-M504 PolarHBondContact O-N 3.27Š| ||
| 503 | A | 39.8 | Very low | 41.9 | Very low | 107 Ų | 107 | 133.2 Ų | 133.2 | 88% | 0.884 | 75% | 0.747 | S | S | * | * | trans | -47 | 104.6 | 164.1 | 0 | 0 | 0 | 0 | 0 | 110.9 | ||||
| 504 | M | 33.4 | Very low | 41 | Very low | 168 Ų | 168 | 139.2 Ų | 139.2 | 83% | 0.828 | 76% | 0.764 | S | S | * | * | trans | -105.5 | 130.1 | 157.5 | -67.4 | -150.1 | -155.7 | 0 | 0 | 107.8 | A502 E506 | A502-M504 PolarHBondContact O-N 3.27Å; M504-E506 PolarHBondContact O-N 3.48Å | ||
| 505 | P | 37.8 | Very low | 40 | Very low | 114 Ų | 114 | 137.6 Ų | 137.6 | 74% | 0.74 | 77% | 0.768 | S | S | * | * | trans | -69 | 121.2 | 176.6 | 26.2 | -29.8 | 0 | 0 | 0 | 109.8 | H507 | P505-H507 PolarHBondContact O-N 3.11Å; P505-H507 VanDerWaalsContact O-N 3.15Å | ||
| 506 | E | 37.6 | Very low | 39.3 | Very low | 199 Ų | 199 | 136.9 Ų | 136.9 | 93% | 0.93 | 78% | 0.778 | S | S | * | * | trans | -61.9 | 111 | 170.9 | -76.3 | -173.4 | 147 | 0 | 0 | 110.1 | M504 | M504-E506 PolarHBondContact O-N 3.48Š| ||
| 507 | H | 36.4 | Very low | 38.4 | Very low | 180 Ų | 180 | 139.6 Ų | 139.6 | 83% | 0.833 | 79% | 0.789 | S | S | * | * | trans | -85.6 | 114.4 | 166.9 | -98.4 | -72.5 | 0 | 0 | 0 | 109.9 | P505 | P505-H507 PolarHBondContact O-N 3.11Å; P505-H507 VanDerWaalsContact O-N 3.15Å | ||
| 508 | S | 43.9 | Very low | 37.5 | Very low | 87 Ų | 87 | 136.6 Ų | 136.6 | 61% | 0.608 | 79% | 0.79 | S | S | * | * | trans | -71.4 | 128.1 | 171.4 | -171.7 | 0 | 0 | 0 | 0 | 110.6 | L510 | S508-L510 PolarHBondContact O-N 3.13Å; S508-L510 VanDerWaalsContact O-N 3.12Å | ||
| 509 | P | 40.3 | Very low | 36.8 | Very low | 127 Ų | 127 | 138.7 Ų | 138.7 | 83% | 0.825 | 80% | 0.802 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -82.5 | 18.2 | -171.1 | 32.3 | -34.4 | 0 | 0 | 0 | 114.8 | ||
| 510 | L | 41.7 | Very low | 36.2 | Very low | 155 Ų | 155 | 142 Ų | 142 | 81% | 0.812 | 81% | 0.81 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -123.7 | 10.5 | -170.3 | -75.7 | 174.1 | 0 | 0 | 0 | 116.3 | S508 | S508-L510 PolarHBondContact O-N 3.13Å; S508-L510 VanDerWaalsContact O-N 3.12Å |
| 511 | I | 44.3 | Very low | 35.6 | Very low | 147 Ų | 147 | 141.1 Ų | 141.1 | 75% | 0.754 | 81% | 0.809 | S | S | * | * | S | Bend | trans | -134.4 | 68.7 | 176.4 | -48.3 | 178.2 | 0 | 0 | 0 | 109.6 | ||
| 512 | D | 38 | Very low | 35.4 | Very low | 162 Ų | 162 | 144.4 Ų | 144.4 | 87% | 0.866 | 82% | 0.816 | S | S | * | * | trans | -164.5 | 72.1 | 153.2 | -112.4 | -15.5 | 0 | 0 | 0 | 111.2 | ||||
| 513 | K | 36.8 | Very low | 35.2 | Very low | 208 Ų | 208 | 147.4 Ų | 147.4 | 90% | 0.904 | 82% | 0.819 | S | S | * | * | trans | -160.8 | 68.3 | 160.6 | -112.4 | 173 | -168.9 | -179.5 | 0 | 110.8 | ||||
| 514 | R | 33 | Very low | 34.7 | Very low | 256 Ų | 256 | 147 Ų | 147 | 97% | 0.966 | 81% | 0.81 | S | S | * | * | S | Bend | trans | -151.4 | 105.2 | 154 | -110.5 | -179.6 | -167.8 | -175.9 | 4.3 | 109.9 | ||
| 515 | G | 32.3 | Very low | 34.6 | Very low | 68 Ų | 68 | 143.6 Ų | 143.6 | 70% | 0.701 | 80% | 0.802 | S | S | * | * | trans | 118.8 | 79.5 | 162.7 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 516 | L | 31.9 | Very low | 34.3 | Very low | 178 Ų | 178 | 144.6 Ų | 144.6 | 93% | 0.932 | 80% | 0.797 | S | S | * | * | trans | -172 | 101 | 131.4 | -98.3 | 144.6 | 0 | 0 | 0 | 108.9 | ||||
| 517 | Q | 30.2 | Very low | 34.1 | Very low | 198 Ų | 198 | 142.1 Ų | 142.1 | 93% | 0.925 | 78% | 0.783 | S | S | * | * | trans | -62.7 | 136.4 | 156.7 | -74 | 168.6 | -13.2 | 0 | 0 | 108.4 | ||||
| 518 | G | 28.5 | Very low | 34 | Very low | 72 Ų | 72 | 141.8 Ų | 141.8 | 74% | 0.742 | 78% | 0.782 | S | S | * | * | trans | 163.9 | 79.3 | 167.4 | 0 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 519 | A | 30.1 | Very low | 33.4 | Very low | 90 Ų | 90 | 142.1 Ų | 142.1 | 74% | 0.744 | 78% | 0.784 | S | S | * | * | trans | 71.1 | 125 | 140.6 | 0 | 0 | 0 | 0 | 0 | 121.6 | ||||
| 520 | K | 31.1 | Very low | 33.1 | Very low | 216 Ų | 216 | 140.8 Ų | 140.8 | 94% | 0.939 | 78% | 0.778 | S | S | * | * | trans | 67.6 | 133.1 | 151.2 | -63.3 | 174 | 176.2 | -179.1 | 0 | 115.7 | ||||
| 521 | G | 28.6 | Very low | 32.9 | Very low | 68 Ų | 68 | 146.2 Ų | 146.2 | 70% | 0.701 | 80% | 0.803 | S | S | * | * | cis | 164.3 | 151.9 | 8.3 | 0 | 0 | 0 | 0 | 0 | 106.7 | ||||
| 522 | D | 31.1 | Very low | 32.3 | Very low | 145 Ų | 145 | 146.2 Ų | 146.2 | 78% | 0.775 | 81% | 0.805 | S | S | * | * | trans | 71.5 | 123.1 | 158.1 | -81.6 | -16.9 | 0 | 0 | 0 | 122.9 | ||||
| 523 | L | 32.2 | Very low | 32 | Very low | 150 Ų | 150 | 145.3 Ų | 145.3 | 79% | 0.785 | 80% | 0.802 | S | S | * | * | trans | 62.5 | 138.3 | 132.8 | -61.2 | 157.5 | 0 | 0 | 0 | 116.9 | ||||
| 524 | S | 30.3 | Very low | 31.8 | Very low | 99 Ų | 99 | 141.8 Ų | 141.8 | 69% | 0.692 | 80% | 0.796 | S | S | * | * | cis | -179.8 | 157.8 | 6 | 40.7 | 0 | 0 | 0 | 0 | 106.1 | ||||
| 525 | S | 30 | Very low | 31.7 | Very low | 96 Ų | 96 | 135.1 Ų | 135.1 | 67% | 0.671 | 79% | 0.786 | S | S | * | * | trans | 23.9 | 146.9 | 145.4 | 114.3 | 0 | 0 | 0 | 0 | 119.8 | ||||
| 526 | E | 32.5 | Very low | 31.6 | Very low | 135 Ų | 135 | 139.3 Ų | 139.3 | 63% | 0.631 | 79% | 0.791 | S | S | * | * | cis | 176.8 | 163 | 19.8 | -125 | 170.5 | 118.6 | 0 | 0 | 105.9 | ||||
| 527 | K | 33.6 | Very low | 31.6 | Very low | 148 Ų | 148 | 136.7 Ų | 136.7 | 64% | 0.643 | 78% | 0.782 | S | S | * | * | trans | 73.6 | 121.4 | 142.3 | -79.7 | 173.8 | 175.1 | 156.7 | 0 | 120.2 | ||||
| 528 | E | 33.3 | Very low | 31.7 | Very low | 172 Ų | 172 | 132.4 Ų | 132.4 | 80% | 0.804 | 77% | 0.772 | S | S | * | * | 77.1 | 145.8 | 104.7 | -80 | 178.8 | 138.7 | 0 | 0 | 111.8 | |||||
| 529 | S | 32.3 | Very low | 32 | Very low | 94 Ų | 94 | 137 Ų | 137 | 66% | 0.657 | 77% | 0.774 | S | S | * | * | cis | -170.5 | 150.9 | -2.8 | -179.6 | 0 | 0 | 0 | 0 | 104.1 | ||||
| 530 | S | 34.4 | Very low | 32.1 | Very low | 100 Ų | 100 | 140.9 Ų | 140.9 | 70% | 0.699 | 78% | 0.777 | S | S | * | * | trans | 23.5 | 119.1 | 147.3 | 61.3 | 0 | 0 | 0 | 0 | 120.1 | ||||
| 531 | M | 36.2 | Very low | 32.2 | Very low | 268 Ų | 268 | 134.1 Ų | 134.1 | 100% | 1.32 | 76% | 0.762 | S | S | * | * | -161.9 | 0 | 106.6 | -107.1 | -175.9 | -176.2 | 0 | 0 | 110.5 |
Retrieved 531 of 531 residues in 645.9 ms
(Link to these results)